id
string
text
string
source
string
created
timestamp[s]
added
string
metadata
dict
0903.2854
# Symmetric Ground States Solutions of m-Coupled nonlinear Schrödinger equations Hichem Hajaiej Justus-Liebig-Universität Giessen Mathematisches Institut Arnd Str 2, 35392 Giessen Germany hichem.hajaiej@gmail.com ###### Abstract. We prove the existence of radial and radially decreasing ground states of an m-coupled nonlinear Schrödinger equation with a general nonlinearity. ## 1\. Introduction The following Cauchy problem of an m-coupled nonlinear Schrödinger equations: (1.1) $\begin{cases}i\partial_{t}\Phi_{1}+\Delta\Phi_{1}+g_{1}\left(|x|,|\Phi_{1}|^{2},\ldots,|\Phi_{m}|^{2}\right)\Phi_{1}&=0,\\\ \qquad\qquad\vdots&\\\ i\partial_{t}\Phi_{m}+\Delta\Phi_{m}+g_{m}\left(|x|,|\Phi_{1}|^{2},\ldots,|\Phi_{m}|^{2}\right)\Phi_{m}&=0,\\\ \hfill\Phi_{i}(0,x)&=\Phi_{i}^{0}(x)\,\quad\mbox{for}\,1\leq i\leq m.\end{cases}$ For $1\leq i\leq m:\Phi_{i}^{0}:\mathbb{R}^{N}\rightarrow\mathbb{C}$ and $g_{i}:\mathbb{R}_{+}^{*}\times\mathbb{R}_{+}^{m}\rightarrow\mathbb{R}$, $\Phi_{i}:\mathbb{R}_{+}\times\mathbb{R}^{N}\rightarrow\mathbb{C}$, has numerous applications in physical problems. It appears in the study of spatial solitons in nonlinear waveguides [30], the theory of Bose-Einstein condensates [12], interactions of m-wave packets [5], optical pulse propagation in birefringent fibers [25, 26], wavelength division multiplexed optical systems. Physically, the solution $\Phi_{i}$ is the $i$th component of the beam in Kerr-like photorefractive media [1]. In the most relevant cases, it is possible to write (1.1) in a vectorial form as follows: (1.2) $\begin{cases}i\frac{\partial\Phi}{\partial t}=E^{\prime}(\Phi)&\\\ \Phi(0,x)=\Phi^{0}=(\Phi^{0}_{1},\ldots,\Phi^{0}_{m})&\end{cases}$ where (1.3) $E(\Phi)=\frac{1}{2}\|\nabla\Phi\|_{2}^{2}-\int{G\left(|x|,\Phi_{1},\ldots,\Phi_{m}\right)}\,dx.$ $G:(0,\infty)\times\mathbb{R}^{m}\rightarrow\mathbb{R}$ satisfies the following system: (1.4) $\begin{cases}\frac{\partial G}{\partial u_{1}}=g_{1}\left(|x|,u_{1}^{2},\ldots,u_{m}^{2}\right)u_{1},&\\\ \qquad\vdots&\\\ \frac{\partial G}{\partial u_{m}}=g_{m}\left(|x|,u_{1}^{2},\ldots,u_{m}^{2}\right)u_{m}.&\end{cases}$ When $m=1$, $G$ can be easily given by the explicit expression: $G(r,s)=\frac{1}{2}\int_{0}^{s^{2}}g(r,t)\,dt$. In the general case: (1.5) $\displaystyle G(r,u_{1},\ldots,u_{m})$ $\displaystyle=$ $\displaystyle\frac{1}{2}\int_{0}^{u_{1}^{2}}g_{1}(r,t,u_{2}^{2},\ldots,u_{m}^{2})\,dt+K_{1}(u_{2},\ldots,u_{m})$ $\displaystyle=$ $\displaystyle\frac{1}{2}\int_{0}^{u_{i}^{2}}g_{i}(r,u_{1}^{2},\ldots,t_{i},\ldots,u_{m}^{2})\,dt_{i}+K_{i}(u_{1},\ldots,u_{i-1},u_{i+1},\ldots,u_{m})$ $\displaystyle=$ $\displaystyle\quad\ldots$ $\displaystyle=$ $\displaystyle\frac{1}{2}\int_{0}^{u_{m}^{2}}g_{m}(r,u_{1}^{2},\ldots,t)\,dt+K_{m}(u_{1},\ldots,u_{m-1}).$ A soliton or standing wave of (1.1) is a solution of the form: $\Phi(t,x)=\left(\Phi_{1}(t,x),\ldots,\Phi_{m}(t,x)\right)$, where for $1\leq j\leq m:\Phi_{j}(t,x)=u_{j}(x)e^{-i\lambda_{j}t}$, $\lambda_{j}$ are real numbers. Therefore $\mathcal{U}=(u_{1},\ldots,u_{m})$ is a solution of the following $m\times m$ elliptic eigenvalue problem: (1.6) $\begin{cases}\Delta u_{1}+\lambda_{1}u_{1}+g_{1}\left(|x|,u_{1}^{2},\ldots,u_{m}^{2}\right)u_{1}=0,&\\\ \qquad\vdots&\\\ \Delta u_{m}+\lambda_{m}u_{m}+g_{m}\left(|x|,u_{1}^{2},\ldots,u_{m}^{2}\right)u_{m}=0.&\end{cases}$ Among all the standing waves, let us mention the ground states which correspond to the least energy solutions $\mathcal{U}$ of (1.6), defined by: (1.7) $E(\mathcal{U})=\frac{1}{2}\sum\limits_{i=1}^{m}|\nabla u_{i}|_{2}^{2}-\int_{\mathbb{R}^{N}}G\left(|x|,u_{1}(x),\ldots,u_{m}(x)\right)\,dx$ under constraints (1.8) $S_{c}=\left\\{\mathcal{U}=(u_{1},\ldots,u_{m})\in\mathrm{H}^{1}(\mathbb{R}^{N})\times\ldots\mathrm{H}^{1}(\mathbb{R}^{N}):\int_{\mathbb{R}^{N}}u_{i}^{2}=c_{i}\right\\}$ where $c_{i}>0$ are $m$ prescribed numbers. Ground states are solutions of the minimization problem: (1.9) $\mbox{For given }\hfill c_{i}>0,M_{c}=\inf_{\mathcal{U}\in S_{c}}E(\mathcal{U}).\hfill$ Profiles of stable electromagnetic waves traveling along a medium are given by (1.9). Note that in (1.7), $|x|$ is the position relative to the optical axis, $G$ is related to the index of refraction of the medium. In the most relevant cases, $G$ has jumps at interfaces between layers of different media (core and claddings). Therefore, $G$ is not continuous with respect to the first variable in many practical cases. The existence of ground states has been investigated by many authors following different methods. In [2, 14, 17, 21, 15, 16, 27, 31, 32, 34, 33] by numerical arguments; in [3, 4, 22, 23, 24, 28], the mathematical analysis using the variational approach has been pursued to prove the existence of ground states. These works addressed the special case $m=2$ and (1.10) $\begin{cases}g_{1}(|x|,u_{1}^{2},u_{2}^{2})=\left(|u_{1}|^{2p-2}+\beta|u_{1}|^{p-2}|u_{2}|^{p}\right),&\\\ g_{2}(|x|,u_{1}^{2},u_{2}^{2})=\left(|u_{2}|^{2p-2}+\beta|u_{2}|^{p-2}|u_{1}|^{p}\right).&\end{cases}$ This is a very interesting case where we can easily determine $G$, indeed using (1.5) it is obvious that $G(r,s_{1},s_{2})=\frac{1}{2p}u_{1}^{2p}+\frac{\beta}{p}u_{1}^{p}u_{2}^{p}+K_{1}(u_{2})=\frac{1}{2p}u_{2}^{2p}+\frac{\beta}{p}u_{1}^{p}u_{2}^{p}+K_{2}(u_{1})$. A straightforward computation implies: $G(r,s_{1},s_{2})=\frac{1}{2p}s_{1}^{2p}+\frac{1}{2p}s_{2}^{2p}+\frac{\beta}{p}s_{1}^{p}s_{2}^{p}$. In [3, 24], not only the existence of ground states has been established, for (1.1) with $g_{i}$ given by (1.10), but also the orbital stability has been discussed. Of course, we are interested in the orbital stability of ground states of (1.1) with general non-linearities. However, an inescapable step consists in the establishment of suitable assumptions of $g_{i}$ under which (1.1) admits a unique solution. This is a very challenging open question under investigation. Following a self-contained approach, we establish the existence of radial and radially decreasing ground states [Theorem 3.1]. Our main assumptions are that $G$ satisfies a growth condition and it is a supermodular function, that is to say: (1.11) $G(r,y+he_{i}+ke_{j})+G(r,y)\geq G(r,y+he_{i})+G(r,y+ke_{j})$ (1.12) $G(r_{1},y+he_{i})+G(r_{0},y)\leq G(r_{1},y)+G(r_{0},y+he_{i})$ for every $i\neq j,h,k>0;y=(y_{1},\ldots,y_{m})$ and $e_{i}$ denotes the $i$th standard basis vector in $\mathbb{R}^{m},r>0$ and $0<r_{0}<r_{1}$. These inequalities are connected to the cooperativity of (1.6). When $\lambda_{i}\equiv 0$, W.C. Troy proved in [35] the necessity of this hypothesis. Contrary to previous works, we will not use minimization under the so-called Nehari Manifold; neither results involving the Palais-Smale condition. Instead, we take advantage of some recent results of symmetrization inequalities. More precisely, in [13], it has been proved that if $G$ satisfies (1.11) and (1.12), then: (1.13) $\int_{\mathbb{R}^{N}}G\left(|x|,u_{1}(x),\ldots,u_{m}(x)\right)\,dx\leq\int_{\mathbb{R}^{N}}G\left(|x|,u^{*}_{1}(x),\ldots,u^{*}_{m}(x)\right)\,dx.$ Here $u^{*}$ denotes the Schwarz symmetrization of a function $u$ vanishing at infinity. It is well known that the norm of the gradient does not increase under Schwarz symmetrization in L2. Moreover rearrangements preserve the L2 norm: $\int|\nabla u^{*}|^{2}\leq\int|\nabla u|^{2}$ $\int u^{2}=\int{(u^{*})}^{2}.$ Finally let us point out that, as mentioned in [11], in many valuable papers the study of (1.9) with $m=1$ relied on the fact that one could look for minima in the class of radial functions using rearrangement inequalities. The compact embedding of such functions in Lp enables us to conclude [6, 7, 8, 9, 10, 36, 37]. H. Brezis and E.H. Lieb [11] concluded this remark saying “It is not known whether the minimum action lies in the class of radial solutions for $m>1$ because rearrangement inequalities are not applicable.” In this paper we build on a method enabling us to use such vectorial inequalities to solve (1.9). Thanks to these inequalities, we first prove that: Given $c_{1},\ldots,c_{m}>0$: 1. (1) (1.9) always admits a minimizing sequence $\mathcal{U}_{n}=(u_{n,1},\ldots,u_{n,m})$ such that each component $u_{n,i}$ is radial and radially decreasing. 2. (2) Noticing that any minimizing sequence of (1.9) is bounded, we will prove that if $\mathcal{U}_{n}=\mathcal{U}^{*}_{n}\rightharpoonup\mathcal{U}$ then $\lim\limits_{n\rightarrow+\infty}\int_{\mathbb{R}^{N}}G\left(|x|,u_{n,1},\ldots,u_{n,m}\right)\,dx=\int_{\mathbb{R}^{N}}G\left(|x|,u_{1}(x),\ldots,u_{m}(x)\right)\,dx$ which implies that $\mathcal{U}=(u_{1},\ldots,u_{m})$ is such that $E(\mathcal{U})\leq M_{c}$. 3. (3) To conclude, it is sufficient to prove that $\mathcal{U}\in S_{c}$. This paper contains four more sections. In the next section, we introduce the notation and definitions. In the third section, we state our main result and give a detailed proof. The fourth part is dedicated to a variant of our approach. The last section is dedicated to some challenging open problems. ## 2\. Preliminaries and Notation * • In the sequel, $m,N\in\mathbb{N}^{*}$. * • For $1\leq p<\infty$, $|\cdot|_{p}$ denotes the norm in L${}^{p}(\mathbb{R}^{N})$. * • If $V=(v_{1},\ldots,v_{m})$ with $v_{i}\in$L${}^{2}(\mathbb{R}^{N}):\|V\|_{2}^{2}=|v_{1}|_{2}^{2}+\ldots+|v_{m}|_{2}^{2}$. * • If $V=(v_{1},\ldots,v_{m})$ with $v_{i}\in$H${}^{1}(\mathbb{R}^{N}):\|\nabla V\|_{2}^{2}=|\nabla v_{1}|_{2}^{2}+\ldots+|\nabla v_{m}|_{2}^{2}$. * $[$H${}^{1}(\mathbb{R}^{N})]^{m}=$H${}^{1}(\mathbb{R}^{N})\times\ldots\times$H${}^{1}(\mathbb{R}^{N})$. * • All statements about measurability refer to the Lebesgue measure, $\mu$, on $\mathbb{R}^{N}$ or $(0,\infty)$. When no domain of integration is indicated, the integral extends over $\mathbb{R}^{N}$. * • M$(\mathbb{R}^{N})$ is the set of measurable functions on $\mathbb{R}^{N}$. * • F$(\mathbb{R}^{N})$ is the set of symmetrizable functions: $\left\\{u\in\textrm{M}(\mathbb{R}^{N}):u\geq 0\mbox{ and }\mu\\{x\in\mathbb{R}^{N}:u(x)>t\\}<\infty\quad\forall t>0\right\\}.$ * • For $u\in$F$(R^{N})$, $u^{*}$ denotes the Schwarz symmetrization of $u$. For more details, see [13]. * • We say that $u$ is Schwarz symmetric if $u\equiv u^{*}$. * • For $V\in\mathrm{F}(\mathbb{R}^{N})\times\ldots\times\mathrm{F}(\mathbb{R}^{N})$, $V$ is Schwarz symmetric if each of its components has its property. * • For the convenience of the reader, let us recall some important symmetrization inequalities [18]: (2.1) $\displaystyle\forall u\in\mathrm{H}^{1}(\mathbb{R}^{N}):|\nabla u|_{2}^{2}$ $\displaystyle=$ $\displaystyle\Big{|}\nabla|u|\Big{|}^{2}_{2}\geq\Big{|}\nabla|u|^{*}\Big{|}^{2}_{2}$ (2.2) $\displaystyle\forall u\in\mathrm{L}^{2}(\mathbb{R}^{N}):|u|_{2}^{2}$ $\displaystyle=$ $\displaystyle|u^{*}|_{2}^{2}.$ ###### Definition 2.1. A function $G:(0,\infty)\times\mathbb{R}^{m}\rightarrow\mathbb{R}$ is an m-Carathéodory function if 1. (1) $G(\cdot,s_{1},\ldots,s_{m}):(0,\infty)\rightarrow\mathbb{R}$ is measurable on $(0,\infty)\setminus\Gamma$, where $\Gamma$ is a subset of $(0,\infty)$ having one dimensional measure zero, for all $s_{1},\ldots,s_{m}\geq 0$, 2. (2) For all $1\leq n\leq m$, every $(m-1)$ tuple $s_{i}\geq 0$ and $r\in(0,\infty)\setminus\Gamma$, the function: $\displaystyle\mathbb{R}$ $\displaystyle\rightarrow$ $\displaystyle\mathbb{R}$ $\displaystyle s_{n}$ $\displaystyle\mapsto$ $\displaystyle G(r,\ldots,s_{n},\ldots)$ is continuous on $\mathbb{R}$. This definition establishes the standard context for handling the measurability of the composite functions $G\left(|x|,u_{1}(x),\ldots,u_{m}(x)\right),u_{i}\in M(\mathbb{R}^{N})$. An important property of an m-Carathéodory function is that $x\mapsto G\left(|x|,u_{1}(x),\ldots,u_{m}(x)\right)$ is measurable on $\mathbb{R}^{N}$ for every $u_{1},\ldots,u_{m}\in M(\mathbb{R}^{N})$ * • For the convenience of the reader, let us also recall that for an m-Carathéodory function satisfying (1.11) and (1.12), we have (1.13); [13]. * • For $r>0:B(0,r)=\\{x\in\mathbb{R}^{N}:|x|<r\\},|x|$ is the euclidean norm in $\mathbb{R}^{N}$, there is a constant $V_{N}$ such that $\mu(B(0,r))=V_{N}r^{N}$ for all $r>0$. ## 3\. Main result ###### Theorem 3.1. Let $G:(0,\infty)\times\mathbb{R}^{m}\rightarrow\mathbb{R}$ be such that: * (G0) $G$ is an m-Carathéodory function such that $G(r,s_{1},\ldots,s_{m})\leq G(r,|s_{1}|,\ldots,|s_{m}|)$ for every $r>0$ and $s_{1},\ldots,s_{m}\in\mathbb{R}$, * (G1) For all $r>0;s_{1},\ldots,s_{m}\geq 0$, we have $0\leq G(r,s_{1},\ldots,s_{m})\leq K\left(|s|^{2}+\sum\limits_{i=1}^{m}s_{i}^{\ell_{i}+2}\right):\newline s=(s_{1},\ldots,s_{m});K>0\textrm{ and }0<\ell_{i}<\frac{4}{N},$ * (G2) $G$ satisfies (1.11) and (1.12), * (G3) $\forall\varepsilon>0,\exists R_{0}>0$ and $S_{0}>0$ such that $G(r,s_{1},\ldots,s_{m})\leq\varepsilon|s|^{2}$ for all $r>R_{0}$, $s_{1},\ldots,s_{m}<S_{0};s=(s_{1},\ldots,s_{m})$, * (G4) $G(r,t_{1}s_{1},\ldots,t_{m}s_{m})\geq t^{2}_{\max}G(r,s_{1},\ldots,s_{m})$ for any $t_{1},\ldots,t_{m}\geq 1;r>0;s_{1},\ldots,s_{m}\geq 0$ where $t_{\max}=\max\limits_{1\leq i\leq m}t_{i}$. Suppose additionally that $M_{c}<0$, then: $\forall c_{1},\ldots,c_{m}>0$ there exist $V_{c}=\left(v_{1}^{c_{1}},\ldots,v_{m}^{c_{m}}\right)$ such that $V_{c}\in S_{c}$ and $E(V_{c})=M_{c}$. The proof of the result is divided in three parts: (step 1 $\rightarrow$ step 3): ###### Lemma 3.2. Suppose that $G$ satisfies (G0) and (G1), then all the minimizing sequences of (1.9) are bounded in $[\mathrm{H}^{1}(\mathbb{R}^{N})]^{m}$. Proof: Let $\mathcal{U}=(u_{1},\ldots,u_{m})\in S_{c}$, (G0) and (G1) imply that $\int G(|x|,\mathcal{U}(x))\,dx\leq Kc+K\int\sum\limits_{i=1}^{m}|u_{i}(x)|^{\ell_{i}+2}\,dx.$ For $1\leq i\leq m$, the Gagliardo-Nirenberg inequality tells us that: $|u_{i}|_{\ell_{i}+2}\leq C|u_{i}|_{2}^{1-\sigma_{i}}\cdot|\nabla u_{i}|_{2}^{\sigma_{i}};\sigma_{i}=\frac{N}{2}\frac{\ell_{i}}{\ell_{i}+2}.$ Now let $\varepsilon>0,p_{i}=\frac{4}{N\ell_{i}},q_{i}$ is such that $\frac{1}{p_{i}}+\frac{1}{q_{i}}=1$. Applying Young’s inequality, we obtain: $|u_{i}|_{\ell_{i}+2}\leq\left\\{\frac{C^{\ell_{i}+2}}{\varepsilon}|u_{i}|_{2}^{(1-\sigma_{i})(\ell_{i}+2)}\right\\}^{q_{i}}\frac{1}{q_{i}}+\frac{N\ell_{i}}{4}\left\\{\varepsilon^{\frac{4}{N\ell_{i}}}|\nabla u_{i}|^{2}_{2}\right\\}.$ Consequently: $E(\mathcal{U})\geq\left\\{\frac{1}{2}-Km\sum_{i=1}^{m}\frac{N\ell_{i}}{4}\varepsilon^{\frac{4}{N\ell_{i}}}\right\\}\|\nabla\mathcal{U}\|_{2}^{2}-Kc-\sum\limits_{i=1}^{m}\frac{1}{q_{i}}C^{\ell_{i}+2}c^{\frac{(1-\sigma_{i})(\ell_{i}+2)}{2}}.$ Taking $\varepsilon$ such that $\frac{1}{2}-Km\sum_{i=1}^{m}\frac{N\ell_{i}}{4}\varepsilon^{\frac{4}{N\ell_{i}}}\geq 0$, we prove that $E$ is bounded from below. To show that any minimizing sequence of (1.9) is bounded in $[\mathrm{H}^{1}(\mathbb{R}^{N})]^{m}$, it is enough to take the latter inequality with the strict sign. ###### Remark 3.3. * • The lemma remains true if we replace (G1) by the more general growth condition: $G(r,s_{1},\ldots,s_{m})\leq K\left(|s|^{2}+\sum\limits_{k=0}^{\alpha}\left(\xi_{1,k}s_{1}+\ldots+\xi_{m,k}s_{m}\right)^{\ell_{k}+2}\right),$ for all $r>0$ and $s_{1},\ldots,s_{m}\geq 0$, where $K$ is a positive constant, $\alpha\in\mathbb{N}^{*}$ and for $0\leq k\leq\alpha,0<\ell_{k}<\frac{4}{N}$. For $0\leq k\leq\alpha,1\leq j\leq m:\xi_{j,k}$ can take arbitrarily the value 0 or 1. * • The growth condition stated in our lemma is optimal, in the sense that if $\ell>\frac{4}{N}$, we can prove that $M_{c}=-\infty$. Under the hypotheses of Theorem 3.1, we will first prove that: Step 1: (3.1) $\mbox{For any }\mathcal{U}=(u_{1},\ldots,u_{m})\in\left[\mathrm{H}^{1}(\mathbb{R}^{N})\right]^{m}:E(\mathcal{U})\geq E(\mathcal{U}^{*}).$ This inequality enables us to assert that for any m-tuple $c_{1},\ldots,c_{m}>0$, (1.9) always admits a Schwarz symmetric minimizing sequence. For such minimizing sequence, we have the following compactness property: Step 2: If $\mathcal{U}_{n}=U_{n}^{*}\rightharpoonup\mathcal{U}$ in $\left[\mathrm{H}^{1}(\mathbb{R}^{N})\right]^{m}:E[\mathcal{U}]\leq\lim\inf E(\mathcal{U}_{n})$. Finally we will show that this $\mathcal{U}$ belongs to the constraint when $M_{c}<0$. Step 1: ###### Lemma 3.4. Suppose that $G$ satisfies (G0), (G1) and (G2). If $(\mathcal{U}_{n})$ is a minimizing sequence of (1.9), $\left(|\mathcal{U}_{n}|^{*}\right)$ also has this property. Proof: Let $\mathcal{U}=(u_{1},\ldots,u_{m})\in\left[\mathrm{H}^{1}(\mathbb{R}^{N})\right]^{m}$. First note that for any $u_{i}\in\mathrm{H}^{1}(\mathbb{R}^{N})$ and $|\nabla u_{i}|_{2}=\Big{|}\nabla|u_{i}|\Big{|}_{2}$, thus using (G0); $E(|\mathcal{U}|)=E(|u_{1}|,\ldots,|u_{m}|)\leq E(u_{1},\ldots,u_{m})$. To achieve the proof, it is sufficient to show that for any $V=(v_{1},\ldots,v_{m})$ with $v_{i}\geq 0$, $E(v_{1}^{*},\ldots,v_{m}^{*})\leq E(v_{1},\ldots,v_{m})$, which follows immediately from (2.1) and (1.13). Note finally that by (2.2): if $\int v_{i}^{2}=c_{i}$ then $\int(v_{i}^{*})^{2}=c_{i}$, this completes the proof. From now on: (3.2) $\mathcal{U}_{n}=(u_{n,1},\ldots,u_{n,m})\textrm{ is a minimizing sequence of~{}(\ref{eq1.9}), which is Schwarz symmetric. }$ By Lemma 3.2, it is bounded in $[\mathrm{H}^{1}(\mathbb{R}^{N})]^{m}$. We know that (up to a subsequence) there exists $\mathcal{U}=(u_{1},\ldots,u_{m})$ such that (3.3) $u_{n,j}\rightharpoonup u_{j}\quad\forall 1\leq j\leq m.$ Step 2: ###### Lemma 3.5. Let $G$ be a function satisfying (G0), (G1) and (G3). ($\mathcal{U}_{n}$) be a minimizing sequence satisfying (3.2) and (3.3) then $E(\mathcal{U})\leq\lim\inf E(\mathcal{U}_{n})$. Proof: $\forall 1\leq i\leq m$, we know that $|\nabla u_{i}|_{2}^{2}\leq|\nabla u_{n,i}|_{2}^{2}$. Let us prove that $\lim\limits_{n\rightarrow+\infty}\int G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx=\int G(|x|,u_{1}(x),\ldots,u_{m}(x))\,dx.$ Let $R>0$, we first show that $\lim\limits_{n\rightarrow+\infty}\int_{|x|\leq R}G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx=\int_{|x|\leq R}G(|x|,u_{1}(x),\ldots,u_{m}(x))\,dx.$ For $1\leq i\leq m$, $(u_{n,i})$ converges weakly to $u_{i}$ in H${}^{1}(\mathbb{R}^{N})$, it then converges to $u_{i}$ in L${}^{\ell_{i}+2}$ $(|x|\leq R)$. Therefore, up to a subsequence (which we also denote by $u_{n,i}$), $u_{n,i}\rightarrow u_{i}$ for almost every $|x|\leq R$, $|u_{n,i}|<h_{i}$ where $h_{i}\in\mathrm{L}^{\ell_{i}+2}(|x|\leq R)$. Now using (G1): $G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\leq K\left(\sum\limits_{i=1}^{m}h^{2}_{i}(x)+\sum\limits_{i=1}^{m}h_{i}^{\ell_{i}+2}(x)\right).$ All functions involved in this sum are in L${}^{1}(|x|\leq R)$. By the dominated convergence theorem, it follows that (3.4) $\lim\limits_{n\rightarrow+\infty}\int_{|x|\leq R}G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx=\int_{|x|\leq R}G(|x|,u_{1}(x),\ldots,u_{m}(x))\,dx.$ Now fix $n\in\mathbb{N}$ and $1\leq i\leq n$. Since $u_{n,i}$ is Schwarz symmetric: $V_{N}|x|^{N}u_{n,i}^{2}(x)\leq\int_{|y|\leq|x|}u^{2}_{n,i}(y)\,dy\leq c_{i}.$ Consequently $u_{n,i}(x)\leq\frac{c_{i}^{1/2}}{V_{N}^{1/2}|x|^{N/2}}\leq\frac{c_{i}^{1/2}}{V_{N}^{1/2}R^{N/2}}$ for all $|x|>R$. Let $\varepsilon>0$, choose $R$ large enough, (G3) implies that $\int_{|x|>R}G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx\leq\varepsilon\sum\limits_{i=1}^{m}\int_{|x|>R}u_{n,i}^{2}(x)\,dx\leq\varepsilon c,$ where $c=\sum\limits_{i=1}^{m}c_{i}$. Proving that: (3.5) $\lim\limits_{R\rightarrow\infty}\lim\limits_{n\rightarrow\infty}\int\limits_{|x|>R}G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx=0.$ The two properties we need to prove (3.5) are: $\int u_{n,i}^{2}(x)\leq c_{i}$ and $(u_{n,i})$ is Schwarz symmetric $\forall 1\leq i\leq m$. Clearly $\int u_{i}^{2}\leq c_{i}$. The second property is inherited by $u_{i}$ almost everywhere. Indeed for $R>0$, there exists $n_{k}(R)$ such that $(u_{n_{k},i})$ converges to $u_{i}$ almost everywhere and we obtain: $\lim\limits_{R\rightarrow\infty}\int\limits_{|x|>R}G(|x|,u_{1}(x),\ldots,u_{m}(x))\,dx=0.$ Consequently $\lim\limits_{n\rightarrow\infty}\int G(|x|,u_{n,1}(x),\ldots,u_{n,m}(x))\,dx=\int G(|x|,u_{1}(x),\ldots,u_{m}(x))\,dx.$ Thanks to our lemmas, we know that $E(\mathcal{U})\leq M_{c}$; ($\mathcal{U}=(u_{1},\ldots,u_{m})$ is given by (3.3)): (3.6) $|u_{i}|^{2}_{2}\leq c_{i}\quad\forall 1\leq i\leq m.$ Step 3: To conclude that the infinum is achieved, we have to prove that $\mathcal{U}\in S_{c}$. Suppose that $M_{c}<0$, set $t_{i}=\frac{c_{i}^{1/2}}{|u_{i}|_{2}}$, by (3.6): (3.7) $t_{i}\geq 1\mbox{ and }(t_{1}u_{1},\ldots,t_{m}u_{m})\in S_{c}\qquad t_{\max}=\max\limits_{1\leq i\leq m}t_{i}\geq 1.$ $E\left(t_{1}u_{1},\ldots,t_{m}u_{m}\right)=\frac{1}{2}\sum\limits_{i=1}^{m}|t_{i}\nabla u_{i}|^{2}_{2}-\int G(|x|,t_{1}u_{1}(x),\ldots,t_{m}u_{m}(x))\,dx.$ By (G4): $\displaystyle E(t_{1}u_{1},\ldots t_{m}u_{m})$ $\displaystyle\leq$ $\displaystyle t_{\max}^{2}E(u_{1},\ldots,u_{m}).$ $\displaystyle M_{c}\leq E(t_{1}u_{1},\ldots t_{m}u_{m})$ $\displaystyle\leq$ $\displaystyle t_{\max}^{2}E(u_{1},\ldots,u_{m})\leq t_{\max}^{2}M_{c},$ since $t_{i}\geq 1$ by Lemma 3.5, it follows that $M_{c}\leq t^{2}_{\max}M_{c}\Rightarrow t^{2}_{\max}\leq 1$, hence $t_{i}=1$ for any $1\leq i\leq m$. This ends the proof of Theorem 3.1. On the hypothesis $\mathbf{M_{c}<0}$: Inspired by [29] and closely following the approach therein, we prove that if $G$ satisfies: * (G5) There exist $R_{1}>0,S_{1}>0$. For any $1\leq i\leq m$, there exist $A_{i}>0,t_{i}\in[0,2)$ and $0\leq\sigma_{i}\leq\frac{2(2-t_{i})}{N}$ such that $G(r,s_{1},\ldots,s_{m})\geq\sum\limits_{i=1}^{m}A_{i}r^{-t_{i}}s_{i}^{\sigma_{i}+2}\mbox{ for all }r>R_{1},0<s<s_{1}$ then $M_{c}<0$. Set $d(N)=\int e^{-2|y|^{2}}\,dy,D(N)=\frac{4}{d^{2}(N)}\int|y|^{2}e^{-2|y|^{2}}\,dy$. For $\alpha\in(0,1]$, we set $w_{\alpha}:\mathbb{R}^{N}\rightarrow\mathbb{R}$ defined by $w_{\alpha}(x)=\frac{\alpha^{N/4}e^{-\alpha|x|^{2}}}{d(N)}$. A straightforward computation shows that $|w_{\alpha}|_{2}=1$ and $|\nabla w_{\alpha}|_{2}^{2}=\alpha D(N)$. On the other hand, there exists $B>R_{1}$ such that for any $|x|>B$, $w_{\alpha}(x)\leq S_{1}$. $\int G(|x|,w_{\alpha}(x),\ldots,w_{\alpha}(x))\geq\int_{|x|\geq B}\sum\limits_{i=1}^{m}\frac{A_{i}}{[d(N)]^{\sigma_{i}+2}}|x|^{-t_{i}}e^{-\alpha(\sigma_{i}+2)|x|^{2}}\alpha^{\frac{N}{4}(\sigma_{i}+2)}\,dx.$ By the change of variable $y=\alpha^{\frac{1}{2}}x$, we obtain: $\displaystyle=$ $\displaystyle\sum\limits_{i=1}^{m}\frac{A_{i}}{[d(N)]^{\sigma_{i}+2}}\alpha^{\frac{N\sigma_{i}}{4}+\frac{t_{i}}{2}}\int_{|y|\geq B\alpha^{\frac{1}{2}}}|y|^{-t_{i}}e^{-(\sigma_{i}+2)|y|^{2}}\,dy$ $\displaystyle\geq$ $\displaystyle\sum\limits_{i=1}^{m}\frac{A_{i}}{[d(N)]^{\sigma_{i}+2}}\alpha^{\frac{N\sigma_{i}}{4}+\frac{t_{i}}{2}}\int_{|y|\geq B}|y|^{-t_{i}}e^{-(\sigma_{i}+2)|y|^{2}}\,dy$ Set $I_{i}=\int_{|y|\geq B}|y|^{-t_{i}}e^{-(\sigma_{i}+2)|y|^{2}}\,dy$, it follows that: $E(w_{\alpha},\ldots,w_{\alpha})\leq\alpha\left\\{mD(N)-\sum\limits_{i=1}^{m}\frac{A_{i}}{[d(N)]^{\sigma_{i}+2}}I_{i}\alpha^{\frac{N\sigma_{i}}{4}+\frac{t_{i}}{2}-1}\right\\}.$ The fact that $\sigma_{i}<2(2-t_{i})/N$ enables us to conclude that $E(w_{\alpha},\ldots,w_{\alpha})<0$ for $\alpha$ sufficiently small. Taking $u_{i}=\frac{c_{i}^{1/2}w_{\alpha}}{|w_{\alpha}|_{2}}$, we can easily see that $E(u_{1},\ldots,u_{m})<0$ with $(u_{1},\ldots,u_{m})\in S_{c}$, thus $M_{c}<0$. ## 4\. Variant of our result Our approach also applies to the following variational problem: $\tilde{M_{c}}=\inf_{\mathcal{U}\in\tilde{S_{c}}}\tilde{E}(\mathcal{U}),\mbox{ for }\mathcal{U}=(u_{1},\ldots,u_{m})\in\left[\mathrm{H}^{1}(\mathbb{R}^{N})\right]^{m},$ $\tilde{E}(\mathcal{U})=\frac{1}{2}\sum\limits_{i=1}^{m}|\nabla u_{i}|_{2}^{2}-\frac{1}{2}\int p(|x|)\sum\limits_{i=1}^{m}u_{i}^{2}(x)-\int G(|x|,u_{1}(x),\ldots,u_{m}(x)).$ For a prescribed $c>0$: $\tilde{S_{c}}=\left\\{\mathcal{U}=(u_{1},\ldots,u_{m}):\|\mathcal{U}\|^{2}_{2}=c\right\\}$. Then we have the following result: ###### Theorem 4.1. Suppose that $p:(0,\infty)\rightarrow\mathbb{R}$ satisfies * (P1) $p$ is non-negative, non-increasing and $\lim\limits_{r\rightarrow\infty}p(r)=0$; * (P2) * – If $N=1,2$, there exists $a\in(0,1]$ such that $p(a)>0$; * – If $N\geq 3$, there exists $R>0$ such that $p(r)>\frac{j^{2}_{N/2-1,1}}{R^{2}}$ where $j^{2}_{N/2-1,1}$ is the first zero of the Bessel function $J_{N/2-1}$. Suppose that $G$ satisfies $(G0)\rightarrow(G4)$ in which each $t_{i}$ is replaced by $t$, then, for any $c>0$, there exists $\mathcal{U}_{c}=(u_{c}^{1},\ldots,u_{c}^{m})$ Schwarz symmetric such that $\tilde{E}(\mathcal{U}_{c})=\tilde{M_{c}}$. Proof: Following the same approach as in the previous Theorem, step 1, step 2 and step 3 can be proven under minor modifications. Therefore we are done if $\tilde{M_{c}}<0$. Since $G$ is non-negative, it is sufficient to prove that we can construct $v\in\mathrm{H}^{1}(\mathbb{R}^{N})$ such that (4.1) $\frac{1}{2}|\nabla v|_{2}^{2}-\frac{1}{2}\int p(|x|)v^{2}<0.$ For the convenience of the reader, we will mention all the details. These test functions were constructed in [19] and used in [20]. * • Case $N=1$: Take $w(x)=e^{-|x|}$, $\alpha\in(0,1],0<d\leq a$ and $w_{\alpha}(x)=w(\alpha x)$ (4.2) $\frac{1}{2}\int|\nabla w_{\alpha}|^{2}-p(|x|)w^{2}_{\alpha}(x)\,dx=\frac{1}{2}\int\alpha^{2}|\nabla w(\alpha x)|^{2}-p(|x|)w^{2}(\alpha x)\,dx.$ By the change of variables $y=\alpha x$, we obtain: $\displaystyle(\ref{eq4.2})$ $\displaystyle\leq$ $\displaystyle\frac{1}{2\alpha}\left\\{\alpha^{2}|\nabla w|_{2}^{2}-\int p\left(\frac{|y|}{\alpha}\right)w^{2}(y)\,dy\right\\}\leq\frac{1}{2\alpha}\left\\{\alpha^{2}|\nabla w|_{2}^{2}-w^{2}(d)\int_{|y|\leq d}p\left(\frac{|y|}{\alpha}\right)\,dy\right\\}$ $\displaystyle(\ref{eq4.2})$ $\displaystyle\leq$ $\displaystyle\frac{\alpha}{2}\left\\{|\nabla w|_{2}^{2}-\frac{w^{2}(d)p(d)2d}{\alpha}\right\\}.$ In the last inequality, we have used the change of variables $z=\frac{y}{\alpha}$, then used the monotonicity of $p$. Therefore for $\alpha$ small enough, (4.2)$<0$. Now for $c>0$ and $\alpha$ small enough take: $v_{i}=\frac{c^{1/2}w_{\alpha}}{m^{1/2}|w_{\alpha}|_{2}}$, then $\frac{1}{2}\int|\nabla v_{i}|_{2}^{2}-\frac{1}{2}\int p(|x|)v_{i}^{2}<0$, $v=(v_{1},\ldots,v_{m})\in\tilde{S_{c}}$ and $\tilde{E}(v_{1},\ldots,v_{m})<0$. * • Case $N=2$: Let $u(x)=\begin{cases}\left(\log{\frac{1}{|x|}}\right)^{1/3}&\mbox{if }|x|<1,\\\ 0&\mbox{otherwise.}\end{cases}$ $u\in\mathrm{H}^{1}(\mathbb{R}^{2})$ but it is an unbounded function because of its singularity in $0$. Let $K=\left(\int_{|x|\leq 1}p(|x|)\,dx\right)^{-1}$, there exists $d\in\mathbb{R}^{2}$ such that (4.3) $u^{2}(d)>K|\nabla u|_{2}^{2}.$ Set $w_{d}(x)=u(|d|x),w_{d}\in\mathrm{H}^{1}(\mathbb{R}^{2})$ and: $\displaystyle\frac{1}{2}|\nabla w_{d}|^{2}_{2}-\frac{1}{2}\int p(|x|)w_{d}^{2}(x)\,dx\leq\frac{1}{2}\int|d|^{2}\Big{|}\nabla u(|d|x)\Big{|}^{2}-p(|x|)u^{2}(|d|x)\,dx$ $\displaystyle\leq$ $\displaystyle\frac{1}{2}\int|\nabla u(y)|^{2}-\frac{1}{|d|^{2}}p\left(\frac{|y|}{|d|}\right)u^{2}(y)\,dy\leq\frac{1}{2}\int|\nabla u(y)|^{2}-\frac{1}{2|d|^{2}}\int_{|y|\leq d}p\left(\frac{|y|}{|d|}\right)u^{2}(y)\,dy$ $\displaystyle\leq$ $\displaystyle\frac{1}{2}\left\\{|\nabla u|^{2}_{2}-u^{2}(d)\int_{|z|\leq 1}p(|z|)\,dz\right\\}<0\mbox{ by (\ref{eq4.3})}.$ The proof goes as previously setting $v_{i}=\frac{c^{1/2}w_{d}}{m^{1/2}|w_{d}|_{2}}$ for $1\leq i\leq n$. * • Case $N\geq 3$: Let $x\in\mathcal{B}(0,1)$, set $\varphi_{1}(x)=|x|^{-\left(\frac{N}{2}-1\right)}J_{N/2-1}\left(j_{N/2-1,1}|x|\right)$. It is easy to check that $\varphi_{0}\in\mathrm{H}_{0}^{1}(|x|<1)$ and $-\Delta\varphi_{1}=j^{2}_{N/2-1,1}\varphi_{1}$. For $R$ given by (P2), set $\varphi_{R}(x)=\varphi_{1}\left(\frac{x}{R}\right)$ then $\varphi_{R}\in\mathrm{H}_{0}^{1}(|x|<R)$ and $-\nabla\varphi_{R}=\frac{j^{2}_{N/2-1,1}}{R^{2}}\varphi_{R}$. Now set $w_{R}=\begin{cases}\varphi_{R}&\mbox{if }|x|<R\\\ 0&\mbox{otherwise.}\end{cases}$ $w_{R}\in\mathrm{H}^{1}(\mathbb{R}^{N})$ and $\frac{1}{2}\int|\nabla w_{R}|-\frac{1}{2}\int p(|x|)w^{2}_{R}(x)\,dx\leq\frac{1}{2}\int_{|x|\leq R}\left\\{\frac{j^{2}_{N/2-1,1}}{R^{2}}-p(|x|)\right\\}w_{R}^{2}(x)\,dx<0$ by (P2). We conclude in the same way as in the previous cases. ###### Remark 4.2. Theorem 4.1 holds true when (P2) is replaced by (G5). Examples of functions $\mathbf{G}$ satisfying $\mathbf{(G0)\rightarrow(G5)}$: Let $m=2,k\in\mathbb{N}^{*}$: (R) $G(r,s)=b(r)|s|^{2}+a(r)\sum\limits_{j=1}^{k}|s_{1}|^{\ell_{1,j}+1}|s_{2}|^{\ell_{2,j}+1}$ * (R1) $\ell_{1,j}$ and $\ell_{2,j}>1$ with $\ell_{1,j}+\ell_{2,j}<\frac{4}{N}$ for $1\leq j\leq k$. * (R2) $a(r)$ is a non-negative, non-increasing function bounded from above and below by two positive constants. * (R3) $b(r)$ is a non-negative, non-increasing bounded function tending to zero as $r$ goes to infinity. Then $G$ satisfies $(G0)\rightarrow(G5)$. Remarks: * • For $m>2$, functions $G$ satisfying $(G0)$ to $(G5)$ are given in a similar way as (R) with a sum involving products of all $s_{i},1\leq i\leq m$. This ensures $(G4)$. * • Note that in (R), $|s|^{2}$ can be replaced by $|s|^{\sigma+2}$ with $0<\sigma<\frac{4}{N}$. In this case $b(r)$ can be taken as a positive constant: (R’) * • Finally when one deals with functions $G$ that are not necessarily sums of products involving all $s_{i}$ with $1\leq i\leq m$, we should apply Theorem 4.1, from which we can easily see that (1.10) is a particular case of this result. More precisely, take $a\equiv\frac{\beta}{p}$, $b=\frac{1}{2p}$, $\ell_{1}=\ell_{2}=\frac{\sigma}{2}=p-1$ with $1<p<\frac{2}{N}$ in (R’). ## 5\. Concluding remarks In this paper, we have determined suitable assumptions of the operator $G$, involved in the m-coupled nonlinear Schrödinger equations such that (1.1) admits a radial and radially decreasing ground state with respect to each component. Moreover, if (1.11) and (1.12) hold true with strict inequality [21, Theorem 2], it follows that $E(\mathcal{U}^{*})<E(\mathcal{U})$ for any $\mathcal{U}\in[H^{1}(\mathbb{R}^{N})]^{m}$. Consequently all the ground states of (1.1) are Schwarz symmetric. A challenging question is the establishment of the uniqueness of these least energy solutions. Until now, we are not aware of any result in this direction when $N>1$ and $m>1$. Another very interesting question is the study of the orbital stability of these standing waves. We expect that for $\ell_{i}<4/N$, the ground states are stable. A crucial step to establish such a result is to prove the uniqueness of the solutions of (1.1). For more general nonlinearities $g_{i}$, this open problem, under investigation, seems to be extremely complicated. ## Acknowledgment The author is extremely grateful to Dr. Yvan Pointurier for his precious help. The author is also grateful to the referees, Stefan Le Coz and Louis Jeanjean for their valuable comments. ## References * [1] Akhmediev, N. Ankiewicz. Partially coherent solitons on a finite background Phys. Rev. Lett. 82, 2661 (1999). * [2] Akhmediev, N. Ankiewicz. Solitons, nonlinear pulses and beams, Chapman and Hall, London, 1997. * [3] A. Ambrosetti, E. Colorado. Standing waves of some coupled nonlinear Schrödinger equations. J. London Math. Soc., 75(2007), 67–82. * [4] T. Bartsch, Z.Q. Wang. Note on ground state of nonlinear Schrödinger systems. J. Partial Differential Equations, 19(2006), 200–207. * [5] D.J. Bennery, A.C. Newell. The propagation of nonlinear wave envelopes. J. Math. Phys., 46(1967), 133–139. * [6] H. Berestycki, T. Gallouet, O. Kavian. Equations de champs scalaires Euclidiens non linéaires dans le plan. Compt. Rend. Acad. Sci. 297, 307–310 (1983). * [7] H. Berestycki, T. Gallouet, O. Kavian. Semilinear elliptic problems in $\mathbb{R}^{2}$. (in preparation) * [8] H. Berestycki, P.-L. Lions. Existence of stationary states of non-linear scalar field equations. Bifurcation phenomena in mathematical physics and related topics, C. Bardos, D. Bessis, (eds.). Proc. NATO ASI, Cargese, 1979, Reidel, 1980. * [9] H. Berestycki, P.-L. Lions. Nonlinear scalar field equations.I.Existence of a ground state.84, 313-345 (1983). * [10] H. Berestycki, P.-L. Lions. Existence d’états multiples dans les équations de champs scalaires non linéaires dans le cas de masse nulle. Compt. Rend. Acad. Sci. 297,1, 267-270 (1983) * [11] H. Brezis and E.H. Lieb. Minimum action solutions of some vector field equations. Commun. Math. Phys., 96, 97–113 (1984). * [12] J.C. Bronski, L.D. Carr, B. Deconink, J.N. Kutz. Bose-Einstein condensates in standing waves. Phys. Rev. Lett., 86(2001), 1402–1405. * [13] A. Burchard and H. Hajaiej. Rearrangement inequalities for functionals with monotone integrands. J. Funct. Anal., 233(2):561–582, 2006. * [14] D.N. Christodoulides, S.R. Singh, M.I. Carvalho, M. Segev. Observation of bound-states of interacting vector solitons. Opt. Lett., 25(2000), 561–582. * [15] R.Cipolatti, W Zumpichiatti. On the existence and regularity of ground states for nonlinear system of coupled Schrödinger equations. Comput. Appl. Math., 18(1999), 19–36. * [16] R.Cipolatti, W Zumpichiatti. Orbital stable standing waves for a system of coupled nonlinear Schrödinger equations, Nonlinear Anal., 42( 2000), 445–461. * [17] M. Haelterman, A.P. Sheppard. Bifurcation phenomena and multiple soliton-bound states in isotropic Kerr media. Phy. Rev. E, 49(1994), 3376–3381. * [18] G.H. Hardy, J.E. Littlewood, G. Polya. Inequalities, Cambridge Univ. Press, London, 1934. * [19] H. Hajaiej. Inégalité de symétrisation et application, Thèse 2465, EPFL. * [20] H. Hajaiej, C.A. Stuart. Existence and non-existence of Schwarz symmetric ground states for eigenvalue problems. Ann. Mat. Pura. App., 3(2004), 297–314. * [21] Y.S. Kivshar, G.P. Agrawal. Optical solitons: from fibers to photonic crystals, Academic Press, San Diego, 2003. * [22] T.C. Lin, J. Wei. Ground states of N coupled nonlinear Schrödinger equations in $\mathbb{R}^{n},n\leq 3$. Comm. Math. Phy., 255(2005), 629–653. * [23] L.A. Maia, E. Montefusco, B. Pellacci. Positive solutions for a weakly coupled nonlinear Schrödinger system. J. Diff. Eqs., 229(2006), 743–767. * [24] L.A. Maia, E. Montefusco, B. Pellacci. Orbital stability of ground state solutions of coupled nonlinear Schrödinger equations. Preprint. * [25] S.V. Mankov. On the theory of two-dimensional stationary self-focusing of electromagnetic waves. Sov. Phgs., JETP38(1974), 248–253. * [26] C.R. Menyuk. Nonlinear pulse propagation in birefringent optical fibers. IEEE J. Quantum Electron., 23(1987), 174–176. * [27] E.A. Ostrovskaya, Y.S. Kivshar, D.V. Skrybin, W.J. Firth. Stability of multihump optical solitons. J. Opt. B1 (1999), 77–83. * [28] B. Sirakov. Least energy solitary waves for a system of nonlinear Schrödinger equations in $\mathbb{R}^{n}$. Comm. Math. Phys. 271(2007), 199–221. * [29] C.A. Stuart. Bifurcation for Dirichlet problems without eigenvalues. Proc. London Math. Soc., 45(1982), 169–192. * [30] A.A. Sukhorukov, Y.S. Kivshar. Stability of spatial optical solitons, in Spatial Optical Solitons, editors T. Torruellas and S. Trillo, Springer, New York, 2001. * [31] A.W. Synder, S.J. Hewlett, D.J. Mitchell. Dynamic spatial solitons. Phys. Rev. Lett., 72(1994). * [32] J. Stubbe. Linear stability theory of solitary waves arising in Hamiltonian systems with symmetry. Portugal Math., 46(1989), 17–32. * [33] A. Pomponio. Coupled nonlinear Schrödinger systems with potentials. J. Differential Equations, 227, 258–281. * [34] M.V. Tratnik, J.E. Sipe. Bound solitary waves in optical fibers. Phys. Rev., A38(1988), 2011–2017. * [35] W.C. Troy. Symmetry properties in systems of semilinear elliptic equations. J. Diff. Eq., 42(3), 400–413 (1981). * [36] W.A. Strauss. Existence of solitary waves in higher dimensions. Commun. Math. Phys. 55, 149-162 (1977). * [37] W.A. Strauss, L. Vazquez. Existence of localized solutions for certain model field theories. J. Math. Phys. 22, 1005-1009 (1981).
arxiv-papers
2009-03-16T20:51:59
2024-09-04T02:49:01.188801
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Hichem Hajaiej", "submitter": "Hichem Hajaiej", "url": "https://arxiv.org/abs/0903.2854" }
0903.2900
# Time evolution of Wigner function in laser process derived by entangled state representation Li-yun Hu1,2∗and Hong-yi Fan2 1College of Physics & Communication Electronics, Jiangxi Normal University, Nanchang 330022, China 2Department of Physics, Shanghai Jiao Tong University, Shanghai, 200030, P.R. China *Corresponding author. E-mail addresses: hlyun2008@126.com ###### Abstract Evaluating the Wigner function of quantum states in the entangled state representation is introduced, based on which we present a new approach for deriving time evolution formula of Wigner function in laser process. Application of this fomula to calculating time evolution of photon number is also presented, as an example, the case when the initial state is photon-added coherent state is discussed. ## I Introduction One of the major topics in Quantum Statistical Mechanics is the evolution of pure states into mixed states 1 ; 2 . Such evolution usually happens when a system is immersed in a thermal environment, or a signal (a quantum state) passes through a quantum channel, and is described by a master equation. Alternately, description of evolution of density matrices $\rho$ can be replaced by its Wigner function’s evolution in phase space 3 ; 4 . The partial negativity of Wigner function can be considered as an indicator of nonclassicality of quantum state. On the basis of the entangled state representation and the thermo field dynamics we present a new approach for deriving time evolution formula of Wigner function in amplitude-damping channel and laser process. Application of this fomula to calculating time evolution of photon number is also presented, as an example, the case when the initial state is photon-added coherent state is discussed. ## II Wigner function formula in thermo entangled state representation We begin with briefly reviewing the thermo entangled state representation (TESR). On the basis of Umezawa-Takahash thermo field dynamcs (TFD) 5 ; 6 ; 7 we have constructed the TESR in doubled Fock space 8 ; 9 , $\left|\eta\right\rangle=\exp\left[-\frac{1}{2}|\eta|^{2}+\eta a^{\dagger}-\eta^{\ast}\tilde{a}^{\dagger}+a^{\dagger}\tilde{a}^{\dagger}\right]\left|0,\tilde{0}\right\rangle,$ (1) or $\left|\eta\right\rangle=D\left(\eta\right)\left|\eta=0\right\rangle,\text{ \ }D\left(\eta\right)=e^{\eta a^{\dagger}-\eta^{\ast}a},$ (2) where $D\left(\eta\right)$ is the displacement operator, $\tilde{a}^{\dagger}$ is a fictitious mode accompanying the real photon creation operator $a^{\dagger},$ $\left|0,\tilde{0}\right\rangle=\left|0\right\rangle\left|\tilde{0}\right\rangle,$ and $\left|\tilde{0}\right\rangle$ is annihilated by $\tilde{a},$ $\left[\tilde{a},\tilde{a}^{\dagger}\right]=1$. Operating $a$ and $\tilde{a}$ on $\left|\eta\right\rangle$ in Eq.(1) we obtain the eigen-equations of $\left|\eta\right\rangle$, $\displaystyle(a-\tilde{a}^{\dagger})\left|\eta\right\rangle$ $\displaystyle=\eta\left|\eta\right\rangle,\;(a^{\dagger}-\tilde{a})\left|\eta\right\rangle=\eta^{\ast}\left|\eta\right\rangle,$ $\displaystyle\left\langle\eta\right|(a^{\dagger}-\tilde{a})$ $\displaystyle=\eta^{\ast}\left\langle\eta\right|,\ \left\langle\eta\right|(a-\tilde{a}^{\dagger})=\eta\left\langle\eta\right|.$ (3) Note that $\left[(a-\tilde{a}^{\dagger}),(a^{\dagger}-\tilde{a})\right]=0,$ thus $\left|\eta\right\rangle$ is the common eigenvector of $(a-\tilde{a}^{\dagger})$ and $(\tilde{a}-a^{\dagger}).$ Using the normally ordered form of vacuum projector $\left|0,\tilde{0}\right\rangle\left\langle 0,\tilde{0}\right|=\colon\exp\left(-a^{\dagger}a-\tilde{a}^{\dagger}\tilde{a}\right)\colon,$ and the technique of integration within an ordered product (IWOP) of operators 10 ; 11 ; 12 , we can easily prove that $\left|\eta\right\rangle$ is complete and orthonormal, $\int\frac{d^{2}\eta}{\pi}\left|\eta\right\rangle\left\langle\eta\right|=1,\text{ }\left\langle\eta^{\prime}\right.\left|\eta\right\rangle=\pi\delta\left(\eta^{\prime}-\eta\right)\delta\left(\eta^{\prime\ast}-\eta^{\ast}\right).$ (4) It is easily seen that $\left|\eta=0\right\rangle$ has the properties $\text{ \ }\left|\eta=0\right\rangle=e^{a^{\dagger}\tilde{a}^{\dagger}}\left|0,\tilde{0}\right\rangle=\sum_{n=0}^{\infty}\left|n,\tilde{n}\right\rangle,$ (5) and $\displaystyle a\text{\ }\left|\eta=0\right\rangle$ $\displaystyle=\tilde{a}^{\dagger}\left|\eta=0\right\rangle,$ $\displaystyle a^{\dagger}\left|\eta=0\right\rangle$ $\displaystyle=\tilde{a}\left|\eta=0\right\rangle,$ (6) $\displaystyle\left(a^{\dagger}a\right)^{n}\left|\eta=0\right\rangle$ $\displaystyle=\left(\tilde{a}^{\dagger}\tilde{a}\right)^{n}\left|\eta=0\right\rangle.$ Note that density operators $\rho$($a^{\dagger}$,$a)$ are defined in the real space which are commutative with operators ($\tilde{a}^{\dagger}$,$\tilde{a})$ in the tilde space. Next, we shall derive a new expression of Wigner function in the TESR. According to the definition of Wigner function 13 ; 14 of density operator $\rho,$ $W\left(\alpha\right)=\text{Tr}\left[\Delta\left(\alpha\right)\rho\right],$ (7) where $\Delta\left(\alpha\right)$ is the single-mode Wigner operator 13 , whose explicit form is $\Delta\left(\alpha\right)=\frac{1}{\pi}\colon e^{-2\left(a^{\dagger}-\alpha^{\ast}\right)\left(a-\alpha\right)}\colon=\frac{1}{\pi}D\left(2\alpha\right)(-1)^{a^{\dagger}a}.$ (8) By using $\left\langle\tilde{n}\right|\left.\tilde{m}\right\rangle=\delta_{n,m}$ and introducing $\left|\rho\right\rangle\equiv\rho\left|I\right\rangle$ we can reform Eq.(7) as $\displaystyle W\left(\alpha\right)$ $\displaystyle=\sum_{m,n}^{\infty}\left\langle n,\tilde{n}\right|\Delta\left(\alpha\right)\rho\left|m,\tilde{m}\right\rangle$ $\displaystyle=\frac{1}{\pi}\left\langle\eta=0\right|D\left(2\alpha\right)(-1)^{a^{\dagger}a}\left|\rho\right\rangle$ $\displaystyle=\frac{1}{\pi}\left\langle\eta=-2\alpha\right|(-1)^{a^{\dagger}a}\left|\rho\right\rangle$ $\displaystyle=\frac{1}{\pi}\left\langle\xi=2\alpha\right|\left.\rho\right\rangle,$ (9) where $\left|\xi\right\rangle$ is defined as $\displaystyle\left|\xi\right\rangle_{\xi=\eta}$ $\displaystyle=(-1)^{a^{\dagger}a}\left|\eta=-\xi\right\rangle$ $\displaystyle=\exp\left(-\frac{1}{2}|\xi|^{2}+\xi a^{\dagger}+\xi^{\ast}\tilde{a}^{\dagger}-a^{\dagger}\tilde{a}^{\dagger}\right)\left|0,\tilde{0}\right\rangle$ $\displaystyle=D\left(\xi\right)e^{-a^{\dagger}\tilde{a}^{\dagger}}\left|0,\tilde{0}\right\rangle.$ (10) It can be proved that $\left\langle\eta\right|\left.\xi\right\rangle=\frac{1}{2}\exp\left(\frac{\xi\eta^{\ast}-\xi^{\ast}\eta}{2}\right),$ (11) a Fourier transformation kernel, so $\left|\xi\right\rangle$ can be considered the conjugate state of $\left|\eta\right\rangle,$ which also possess orthonormal and complete properties $\int\frac{d^{2}\xi}{\pi}\left|\xi\right\rangle\left\langle\xi\right|=1,\text{ }\left\langle\xi^{\prime}\right.\left|\xi\right\rangle=\pi\delta\left(\xi^{\prime}-\xi\right)\delta\left(\xi^{\prime\ast}-\xi^{\ast}\right).$ (12) Eq.(9) is just a new formula for evaluating the Wigner function of quantum states: by calculating the overlap between two “pure states” in enlarged Fock space rather than using the ensemble average in real mode space. For example, for number state $\left|n\right\rangle\left\langle n\right|,$ noticing $\left|n\right\rangle\left\langle n\right|\left.I\right\rangle=\left|n,\tilde{n}\right\rangle$, and the generating function of two-variable Hermite polynomial 15 ; 16 $H_{m,n}\left(x,y\right)$, $\sum_{m,n}^{\infty}\frac{t^{m}t^{\prime n}}{m!n!}H_{m,n}\left(x,y\right)=\exp\left[-tt^{\prime}+tx+t^{\prime}y\right],$ (13) we see $\displaystyle W_{\left|n\right\rangle\left\langle n\right|}\left(\alpha\right)$ $\displaystyle=\frac{1}{\pi}\left\langle n,\tilde{n}\right|\left.\xi_{=2\alpha}\right\rangle=\frac{1}{n!\pi}e^{-\frac{1}{2}|\xi|^{2}}H_{n,n}\left(\xi,\xi^{\ast}\right)$ $\displaystyle=\frac{\left(-1\right)^{n}}{\pi}e^{-2|\alpha|^{2}}L_{n}\left(4|\alpha|^{2}\right),$ (14) in the last step in Eq.(14) we have used the relation between $H_{m,n}\left(x,y\right)$ and Laguerre polynomial $L_{m}\left(x\right)$ 17 , $L_{n}\left(xy\right)=\frac{\left(-1\right)^{n}}{n!}H_{n,n}\left(x,y\right).$ (15) Similarly, for coherent state $\left|z\right\rangle\left\langle z\right|$ ($\left|z\right\rangle=\exp(-\left|z\right|^{2}/2+za^{\dagger})\left|0\right\rangle$) 18 ; 19 , due to $\left|z\right\rangle\left\langle z\right|\left.I\right\rangle=D\left(z\right)\tilde{D}\left(z^{\ast}\right)\left|0\tilde{0}\right\rangle=\left|z,\tilde{z}^{\ast}\right\rangle,$ we have $\displaystyle W_{\left|z\right\rangle\left\langle z\right|}\left(\alpha\right)$ $\displaystyle=\frac{1}{\pi}\left\langle 0,\tilde{0}\right|\exp\left(-2|\alpha|^{2}+2\alpha^{\ast}a^{\dagger}+2\alpha\tilde{a}-a\tilde{a}\right)\left|z,\tilde{z}^{\ast}\right\rangle$ $\displaystyle=\frac{1}{\pi}\exp\left[-2\left|\alpha-z\right|^{2}\right].$ (16) Further, using Eq.(11) and the completeness of $\left\langle\eta\right|$ in Eq.(4), we can reform Eq.(9) as $W\left(\alpha\right)=\int\frac{d^{2}\eta}{\pi^{2}}\left\langle\xi=2\alpha\right|\left.\eta\right\rangle\left\langle\eta\right|\left.\rho\right\rangle=\int\frac{d^{2}\eta}{2\pi^{2}}e^{\alpha^{\ast}\eta-\alpha\eta^{\ast}}\left\langle\eta\right|\left.\rho\right\rangle.$ (17) Once $\left\langle\eta\right|\left.\rho\right\rangle$ is known, one can calculate the Wigner function by taking the Fourier transform of $\left\langle\eta\right|\left.\rho\right\rangle$. Eqs. (9) and (13) are two ways accessing to Wigner function, we can use either one to derive Wigner functions. ## III Evolution formula of Wigner function for amplitude damping channel In this section, we consider Wigner function’s time evolution in the amplitude decay channel (dissipation in a lossy cavity) described by the following master equation 20 $\frac{d\rho}{dt}=\kappa\left(2a\rho a^{\dagger}-a^{\dagger}a\rho-\rho a^{\dagger}a\right),$ (18) where $\kappa$ is the rate of decay. In Ref. 21 we have reformed (18) as $\frac{d}{dt}\left|\rho\right\rangle=\kappa\left(2a\tilde{a}-a^{\dagger}a-\tilde{a}^{\dagger}\tilde{a}\right)\left|\rho\right\rangle,$ (19) thus the formal solution of Eq.(19) is $\left|\rho\left(t\right)\right\rangle=e^{\kappa t\left(a\tilde{a}-\tilde{a}^{\dagger}a^{\dagger}+1\right)}e^{\left(1-e^{2\kappa t}\right)\left(a^{\dagger}-\tilde{a}\right)\left(a-\tilde{a}^{\dagger}\right)/2}\left|\rho_{0}\right\rangle.$ (20) Then projecting Eq.(20) on $\left\langle\eta\right|$, and noticing $\exp\left[\kappa t\left(a\tilde{a}-\tilde{a}^{\dagger}a^{\dagger}\right)\right]$ being the two- mode squeezing operator, $\left\langle\eta\right|\exp\left[\kappa t\left(a\tilde{a}-\tilde{a}^{\dagger}a^{\dagger}\right)\right]=e^{-\kappa t}\left\langle\eta e^{-\kappa t}\right|,$ (21) as well as Eq.(3), we obtain $\left\langle\eta\right.\left|\rho\left(t\right)\right\rangle=e^{-\frac{1}{2}T\left|\eta\right|^{2}}\left\langle\eta e^{-\kappa t}\right|\left.\rho_{0}\right\rangle,$ (22) where $T=1-e^{-2\kappa t}.$ Substituting Eq.(22) into Eq.(17), we derive the Wigner function at time $t$ $W\left(\alpha,t\right)=\int\frac{d^{2}\eta}{2\pi^{2}}e^{\alpha^{\ast}\eta-\alpha\eta^{\ast}-\frac{1}{2}T\left|\eta\right|^{2}}\left\langle\eta e^{-\kappa t}\right|\left.\rho_{0}\right\rangle.$ (23) Inserting the completeness relation (12) into Eq.(23) and noticing Eqs.(9) as well as (11), we can reform Eq.(23) as $\displaystyle W\left(\alpha,t\right)$ $\displaystyle=\int\frac{d^{2}\xi^{\prime}}{\pi}\int\frac{d^{2}\eta}{2\pi^{2}}e^{-\frac{1}{2}T\left|\eta\right|^{2}}\left\langle\eta e^{-\kappa t}\right.\left|\xi^{\prime}\right\rangle\left\langle\xi^{\prime}\right|\left.\rho_{0}\right\rangle$ $\displaystyle=\int\frac{d^{2}\beta d^{2}\eta}{\pi^{2}}e^{-\frac{T}{2}\left|\eta\right|^{2}+\eta\left(\alpha^{\ast}-\beta^{\ast}e^{-\kappa t}\right)+\eta^{\ast}\left(\beta e^{-\kappa t}-\alpha\right)}W\left(\beta,0\right)$ $\displaystyle=\frac{2}{T}\int\frac{d^{2}\beta}{\pi}\exp\left[-\frac{2}{T}\left|\alpha-\beta e^{-\kappa t}\right|^{2}\right]W\left(\beta,0\right)$ (24) where $W\left(\beta,0\right)$ is the Wigner function at initial time, and we have used the following integral formula 17 $\int\frac{d^{2}z}{\pi}\exp\left(\zeta\left|z\right|^{2}+\xi z+\eta z^{\ast}\right)=-\frac{1}{\zeta}e^{-\frac{\xi\eta}{\zeta}},\text{Re}\left(\zeta\right)<0.$ (25) Eq.(24) is the expression of time evolution of Wigner function for amplitude damping channel. For example, for the photon-added coherent state $C_{m}a^{{\dagger}m}\left|z\right\rangle$, where $C_{m}=[m!L_{m}(-\left|z\right|^{2})]^{-1}$ is the normalization factor, the initial Wigner function $W\left(\beta,0\right)$ is given by 22 $W\left(\beta,0\right)=\frac{\left(-1\right)^{m}e^{-2\left|\beta-z\right|^{2}}}{\pi L_{m}(-\left|z\right|^{2})}L_{m}(\left|2\beta-z\right|^{2}).$ (26) Substituting Eq.(26) into Eq.(24) and using Eq.(15) as well as the another generating function of $H_{m,n}\left(x,y\right),$ $H_{m,n}\left(x,y\right)=\left.\frac{\partial^{m+n}}{\partial\tau^{m}\partial\tau^{\prime n}}\exp\left[-\tau\tau^{\prime}+\tau x+\tau^{\prime}y\right]\right|_{\tau=\tau^{\prime}=0},$ (27) we have $\displaystyle W\left(\alpha,t\right)$ $\displaystyle=\frac{2}{T}\frac{e^{-2\left(\left|z\right|^{2}+\frac{1}{T}\left|\alpha\right|^{2}\right)}}{\pi m!L_{m}(-\left|z\right|^{2})}\frac{\partial^{2m}}{\partial\tau^{m}\partial\tau^{\prime m}}e^{-\tau\tau^{\prime}-\tau z-z^{\ast}\tau^{\prime}}$ $\displaystyle\int\frac{d^{2}\beta}{\pi}\exp\left[-\frac{\allowbreak 2}{T}\left|\beta\right|^{2}+2\beta\left(z^{\ast}+\allowbreak\frac{\alpha^{\ast}}{T}e^{-t\kappa}+\tau\right)\right.$ $\displaystyle\left.+2\beta^{\ast}\left(z+\frac{\alpha}{T}e^{-t\kappa}+\tau^{\prime}\right)\right]_{\tau=\tau^{\prime}=0}$ $\displaystyle=\frac{e^{-2\allowbreak\left|\alpha-ze^{-\kappa t}\right|^{2}}}{\pi m!L_{m}(-\left|z\right|^{2})}\frac{\partial^{2m}}{\partial\tau^{m}\partial\tau^{\prime m}}\exp\left[\left(1-2e^{-2t\kappa}\right)\tau\tau^{\prime}\right.$ $\displaystyle+\left[\left(1-2e^{-2t\kappa}\right)z+2\alpha e^{-t\kappa}\right]\tau$ $\displaystyle+\left.\left[\allowbreak\left(1-2e^{-2t\kappa}\right)z^{\ast}+2\alpha^{\ast}e^{-t\kappa}\right]\tau^{\prime}\right]_{\tau=\tau^{\prime}=0}.$ (28) With use of a scaled transformation in the right-hand part of Eq.(28) we finally get $\displaystyle W\left(\alpha,t\right)$ $\displaystyle=\frac{\left(1-2e^{-2\kappa t}\right)^{m}}{\pi L_{m}(-\left|z\right|^{2})}e^{-2\allowbreak\left|\alpha-ze^{-\kappa t}\right|^{2}}$ $\displaystyle\times L_{m}\left[-\frac{\left|2\alpha e^{-\kappa t}+z\left(1-2e^{-2\kappa t}\right)\right|^{2}}{1-2e^{-2\kappa t}}\right],$ (29) which is the analytical expression of the time evolution of Wigner function for any number ($m$) photon-added coherent state in photon loss channel 23 . In particular, when $t=0,$ Eq.(29) just reduce to Eq.(26). ## IV Evolution formula of Wigner function for Laser process We now generalize the master equation to the case of Laser theory. The mechanism of laser is described by the following master equation $\displaystyle\frac{d\rho\left(t\right)}{dt}$ $\displaystyle=g\left[2a^{\dagger}\rho\left(t\right)a-aa^{\dagger}\rho\left(t\right)-\rho\left(t\right)aa^{\dagger}\right]$ $\displaystyle+\kappa\left[2a\rho\left(t\right)a^{\dagger}-a^{\dagger}a\rho\left(t\right)-\rho\left(t\right)a^{\dagger}a\right],$ (30) where $g$ and $\kappa$ are the cavity gain and the loss, respectively. Eq.(30) reduces to Eq.(18) when $g=0;$ while for $g\rightarrow\kappa\bar{n}$ and $\kappa\rightarrow\kappa\left(\bar{n}+1\right),$ Eq.(30) becomes $\displaystyle\frac{d\rho}{dt}$ $\displaystyle=\kappa\left(\bar{n}+1\right)\left(2a\rho a^{\dagger}-a^{\dagger}a\rho-\rho a^{\dagger}a\right)$ $\displaystyle+\kappa\bar{n}\left(2a^{\dagger}\rho a-aa^{\dagger}\rho-\rho aa^{\dagger}\right),$ (31) which corresponds to the master equation in thermal environment 20 . Similar to the way of deriving Eq.(22), we have derived in Ref. 21 $\displaystyle\left|\rho\left(t\right)\right\rangle$ $\displaystyle=\exp\left[\left(a\tilde{a}-\tilde{a}^{\dagger}a^{\dagger}+1\right)\left(\kappa-g\right)t\right]$ $\displaystyle\times\exp\left[\frac{\left(\kappa+g\right)\left(1-e^{2\left(\kappa-g\right)t}\right)}{2\left(\kappa-g\right)}\left(a^{\dagger}-\tilde{a}\right)\left(a-\tilde{a}^{\dagger}\right)\right]\left|\rho_{0}\right\rangle.$ (32) Thus the matrix element $\left\langle\eta\right|\left.\rho\left(t\right)\right\rangle$ is given by $\left\langle\eta\right|\left.\rho\left(t\right)\right\rangle=\exp\left[-\frac{A}{2}|\eta|^{2}\right]\left\langle\eta e^{-\left(\kappa-g\right)t}\right|\left.\rho_{0}\right\rangle,$ (33) where $A=\frac{\kappa+g}{\kappa-g}\left(1-e^{-2\left(\kappa-g\right)t}\right).$ (34) According to Eq.(13) the Wigner function’s evolution for Laser process is given by $\displaystyle W\left(\alpha,t\right)$ $\displaystyle=\int\frac{d^{2}\eta}{2\pi^{2}}e^{-\frac{A}{2}|\eta|^{2}+\alpha^{\ast}\eta-\alpha\eta^{\ast}}\left\langle\eta e^{-\left(\kappa-g\right)t}\right|\left.\rho_{0}\right\rangle$ $\displaystyle=\int\frac{d^{2}\xi d^{2}\eta}{2\pi^{2}}e^{-\frac{A}{2}|\eta|^{2}+\alpha^{\ast}\eta-\alpha\eta^{\ast}}\left\langle\eta e^{-\left(\kappa-g\right)t}\right.\left|\xi_{=2\beta}\right\rangle W\left(\beta,0\right)$ $\displaystyle=\int\frac{d^{2}\xi d^{2}\eta}{\pi^{2}}e^{-\frac{A}{2}|\eta|^{2}+\eta\left(\alpha^{\ast}-\beta^{\ast}e^{-\left(\kappa-g\right)t}\right)+\eta^{\ast}\left(\beta e^{-\left(\kappa-g\right)t}-\alpha\right)}W\left(\beta,0\right)$ $\displaystyle=\frac{2}{A}\int\frac{d^{2}\beta}{\pi}\exp\left[-\frac{2}{A}\left|\alpha-\beta e^{-\left(\kappa-g\right)t}\right|^{2}\right]W\left(\beta,0\right),$ (35) where we have used Eq.(25). In particular, when $g=0,$ Eq.(35) reduces to Eq.(24). For $g\rightarrow\kappa\bar{n}$ and $\kappa\rightarrow\kappa\left(\bar{n}+1\right)$, leading to $A=\left(2\bar{n}+1\right)T,$ Eq.(35) becomes $W\left(\alpha,t\right)=\frac{2}{\left(2\bar{n}+1\right)T}\int\frac{d^{2}\beta}{\pi}W\left(\beta,0\right)e^{-2\frac{\allowbreak\left|\alpha-\beta e^{-\kappa t}\right|^{2}}{\left(2\allowbreak\bar{n}+1\right)T}},$ (36) or $W\left(\alpha,t\right)=2e^{2\kappa t}\int d^{2}\beta W_{T}\left(\beta\right)W\left(e^{\kappa t}(\alpha-\sqrt{T}\beta),0\right),$ (37) where $W_{T}\left(\beta\right)=\frac{1}{\pi\left(2\bar{n}+1\right)}e^{-\frac{2\allowbreak\left|\beta\right|^{2}}{2\allowbreak\bar{n}+1}}$ is the Wigner function of the thermal state with mean photon number $\bar{n}$. Similar to the way of deriving Eq.(29), when the initial state is $C_{m}a^{{\dagger}m}\left|z\right\rangle,$ substituting Eq.(26) into Eq.(35) we have $\displaystyle W\left(\beta,\beta^{\ast},t\right)$ $\displaystyle=\frac{e^{-C-2\left|\beta\right|^{2}}}{\pi L_{m}(-\left|z\right|^{2})}\frac{A^{m}}{\left(2\bar{n}T+1\right)}$ $\displaystyle\times\frac{\left[\left(\bar{n}+1\right)T\right]^{m}}{\left(\bar{n}T+1\right)^{m}}L_{m}\left(-\frac{\left|B\right|^{2}}{A}\right),$ (38) where $\displaystyle A$ $\displaystyle=1-\allowbreak\frac{e^{-2\kappa t}/T}{\left(2T\bar{n}+1\right)\left(\bar{n}+1\right)},$ $\displaystyle B$ $\displaystyle=\sqrt{\frac{\left(\bar{n}+1\right)T}{\bar{n}T+1}}z^{\ast}+\frac{\sqrt{\bar{n}T+1}e^{-\kappa t}\left(2\beta^{\ast}-\frac{z^{\ast}e^{-\kappa t}}{\bar{n}T+1}\right)}{\left(2\bar{n}T+1\right)\sqrt{\left(\bar{n}+1\right)T}},$ $\displaystyle C$ $\displaystyle=\allowbreak\frac{1}{2\bar{n}T+1}\left(\frac{3\bar{n}T+2}{T\bar{n}+1}\left|ze^{-\kappa t}\right|^{2}+4T^{2}\bar{n}^{2}\left|\beta\right|^{2}\right)$ $\displaystyle\text{ \ \ }-\allowbreak\frac{2e^{-\kappa t}\left(T\bar{n}+1\right)}{2\bar{n}T+1}\allowbreak\left(z\beta^{\ast}+\beta z^{\ast}\right).$ (39) In particular, when $\bar{n}=0,$ leading to $A=\allowbreak\frac{1-2e^{-2t\kappa}}{T},B=\frac{1}{\sqrt{T}}\left(\left(1-2e^{-2\kappa t}\right)z^{\ast}+2e^{-\kappa t}\beta^{\ast}\right),$ and $-C-2\left|\beta\right|^{2}=-2\left|\beta-ze^{-t\kappa}\right|^{2},$ thus Eq.(39) reduces to Eq.(29). Eq.(38) manifestly shows that the Wigner function of $C_{m}a^{{\dagger}m}\left|z\right\rangle$ in thermal environment is closely related to the Laguerre polynomials. In addition, due to $L_{m}\left(-\left|x\right|^{2}\right)>0,$ so $C_{m}>0,$ thus it is easily seen that when $A>0,$ which means the condition $\kappa t\geqslant\kappa t_{c}=\frac{1}{2}\ln\frac{2\left(\bar{n}+1\right)}{2\bar{n}+1},$ (40) the Wigner function (38) is always positive-definite. Thus we emphasize that for any values of $m$, when the condition (40) is satisfied, the Wigner function has no chance to be negative. ## V Time evolution of photon number for the laser process Next we consider the photon number (PN) of density operator $\rho$ for the laser process. According to the TFD, we can reform the PN $p\left(n\right)=\left\langle n\right|\rho\left|n\right\rangle$ as $\displaystyle p\left(n\right)$ $\displaystyle=\left\langle n\right|\rho\left|n\right\rangle=\sum_{m=0}^{\infty}\left\langle n,\tilde{n}\right|\rho\left|m,\tilde{m}\right\rangle$ $\displaystyle=\left\langle n,\tilde{n}\right|\rho\left|I\right\rangle=\left\langle n,\tilde{n}\right|\left.\rho\right\rangle,$ (41) thus the PN is converted to the matrix element $\left\langle n,\tilde{n}\right|\left.\rho\right\rangle$ in thermo dynamics frame. Then using the completeness of $\left\langle\xi\right|$ and Eq.(9) as well as Eq.(14), we see $\displaystyle p\left(n\right)$ $\displaystyle=\int\frac{d^{2}\xi}{\pi}\left\langle n,\tilde{n}\right|\left.\xi\right\rangle\left\langle\xi\right|\left.\rho\right\rangle$ $\displaystyle=\int d^{2}\xi\left\langle n,\tilde{n}\right|\left.\xi\right\rangle W\left(\alpha=\xi/2\right)$ $\displaystyle=4\pi\int d^{2}\alpha W_{\left|n\right\rangle\left\langle n\right|}\left(\alpha\right)W\left(\alpha\right),$ (42) one can see this formula also in 1 ; 24 . Thus one can calculate the PN by combining Eq.(35) and (42). Now we evaluate the PN of the above decoherence model in Eq.(30). Substituting Eq.(35) into Eq.(42), we see $p\left(n\right)=\frac{8}{A}\int d^{2}\beta W\left(\beta,0\right)G\left(\beta\right),$ (43) where $\displaystyle G\left(\beta\right)$ $\displaystyle\equiv\int d^{2}\alpha W_{\left|n\right\rangle\left\langle n\right|}\left(\alpha\right)e^{-\frac{2}{A}\left|\alpha-\beta e^{-\left(\kappa-g\right)t}\right|^{2}-2|\alpha|^{2}}$ $\displaystyle=(-1)^{n}\int\frac{d^{2}\alpha}{\pi}L_{n}\left(4\left|\alpha\right|^{2}\right)e^{-\frac{2}{A}\left|\alpha-\beta e^{-\left(\kappa-g\right)t}\right|^{2}-2|\alpha|^{2}}.$ (44) Using Eqs.(25) and (27) we can evaluate Eq.(44) as $\displaystyle G\left(\beta\right)$ $\displaystyle=\frac{1}{n!}\frac{\partial^{n+n}}{\partial\tau^{n}\partial\tau^{\prime n}}e^{-\tau\tau^{\prime}-\frac{2}{A}\left|\beta\right|^{2}e^{-2\left(\kappa-g\right)t}}\int\frac{d^{2}\alpha}{\pi}$ $\displaystyle\times\exp\left[-2\frac{A+1}{A}|\alpha|^{2}+2\alpha\left(\tau+\frac{\beta^{\ast}}{Ae^{\left(\kappa-g\right)t}}\right)\right.$ $\displaystyle\left.+2\alpha^{\ast}\left(\tau^{\prime}+\frac{\beta}{Ae^{\left(\kappa-g\right)t}}\right)\right]_{\tau=\tau^{\prime}=0}$ $\displaystyle=\frac{Ae^{-\frac{2e^{-2\left(\kappa-g\right)t}}{A+1}\left|\beta\right|^{2}}}{2\left(A+1\right)n!}\frac{\partial^{n+n}}{\partial\tau^{n}\partial\tau^{\prime n}}\exp\left[-\frac{1-A}{1+A}\tau^{\prime}\tau\right.$ $\displaystyle+\left.\frac{2\beta^{\ast}e^{-\left(\kappa-g\right)t}}{A+1}\tau^{\prime}+\tau\frac{2\beta e^{-\left(\kappa-g\right)t}}{A+1}\right]_{\tau=\tau^{\prime}=0}.$ (45) After making some scaled transformations, we finally obtain $\displaystyle G\left(\beta\right)$ $\displaystyle=\frac{A\left(A-1\right)^{n}}{2\left(1+A\right)^{n+1}n!}e^{-\frac{2e^{-2\left(\kappa-g\right)t}}{A+1}\left|\beta\right|^{2}}$ $\displaystyle\times\frac{\partial^{n+n}}{\partial\tau^{n}\partial\tau^{\prime n}}\left.e^{-\tau^{\prime}\tau+\frac{2\beta^{\ast}e^{-\left(\kappa-g\right)t}}{\sqrt{1-A^{2}}}\tau^{\prime}+\tau\frac{2\beta e^{-\left(\kappa-g\right)t}}{\sqrt{1-A^{2}}}}\right|_{\tau=\tau^{\prime}=0}$ $\displaystyle=\frac{A\left(A-1\right)^{n}}{2\left(1+A\right)^{n+1}}e^{-\frac{2e^{-2\left(\kappa-g\right)t}}{A+1}\left|\beta\right|^{2}}L_{n}\left(\frac{4\left|\beta\right|^{2}e^{-2\left(\kappa-g\right)t}}{1-A^{2}}\right).$ (46) Substituting Eq.(46) into Eq.(43) yields $\displaystyle p\left(n\right)$ $\displaystyle=\frac{4\left(A-1\right)^{n}}{\left(A+1\right)^{n+1}}\int d^{2}\beta e^{-\frac{2e^{-2\left(\kappa-g\right)t}}{A+1}\left|\beta\right|^{2}}$ $\displaystyle\times L_{n}\left\\{\frac{4e^{-2\left(\kappa-g\right)t}}{1-A^{2}}\left|\beta\right|^{2}\right\\}W\left(\beta,0\right),$ (47) which is a new formula for calculating the photon number distribution of the open system in enviornment. From Eq.(47) it is easily seen that once the Wigner function of initial state is known, one can obtain its photon number distribution by performing the integration in Eq.(47). In particular, when $g=0,$ $A=1-e^{-2\kappa t}=T,$ Eq.(47) reduces to $\displaystyle p\left(n\right)$ $\displaystyle=\frac{4(-1)^{n}e^{2\kappa t}}{\left(2e^{2\kappa t}-1\right)^{n+1}}\int d^{2}\beta e^{-\frac{2}{2e^{2\kappa t}-1}\left|\beta\right|^{2}}$ $\displaystyle\times L_{n}\left\\{\frac{4e^{2\kappa t}}{2e^{2\kappa t}-1}\left|\beta\right|^{2}\right\\}W\left(\beta,0\right),$ (48) which corresponds to the photon number of density operator in the amplitude damping quantum channel. While for $g\rightarrow\kappa\bar{n}$ and $\kappa\rightarrow\kappa\left(\bar{n}+1\right)$, , Eq.(47) becomes to $\displaystyle p\left(n\right)$ $\displaystyle=\frac{4\left(\mathcal{A}-1\right)^{n}}{\left(\mathcal{A}+1\right)^{n+1}}\int d^{2}\beta e^{-\frac{2e^{-2\kappa t}}{\mathcal{A}+1}\left|\beta\right|^{2}}$ $\displaystyle\times L_{n}\left\\{\frac{4e^{-2\kappa t}}{1-\mathcal{A}^{2}}\left|\beta\right|^{2}\right\\}W\left(\beta,0\right),$ (49) where $\mathcal{A}=\left(2\bar{n}+1\right)T=\left(2\bar{n}+1\right)\left(1-e^{-2\kappa t}\right).$ Eq.(49) corresponds to the photon number of system interacting with thermal bath. For example, we still consider the photon-added coherent state field. Substituting Eq.(26) into Eq.(47) and uisng Eqs.(25) and (27) yields $\displaystyle p\left(n\right)$ $\displaystyle=Ne^{-2\left|z\right|^{2}}\int\frac{d^{2}\beta}{\pi}L_{m}(\left|2\beta-z\right|^{2})L_{n}\left\\{\frac{4e^{-2\left(\kappa-g\right)t}}{1-A^{2}}\left|\beta\right|^{2}\right\\}$ $\displaystyle\times\exp\left[\allowbreak 2\left(z\beta^{\ast}+\beta z^{\ast}\right)-2\left(\allowbreak 1+\frac{e^{-2\left(\kappa-g\right)t}}{A+1}\right)\left|\beta\right|^{2}\right]$ $\displaystyle=\frac{Ne^{-2\left|z\right|^{2}}\left(-1\right)^{m+n}}{m!n!}\frac{\partial^{2m}}{\partial\upsilon^{m}\partial\upsilon^{\prime m}}\frac{\partial^{2n}}{\partial\tau^{n}\partial\tau^{\prime n}}e^{-\upsilon\upsilon^{\prime}-z^{\ast}\upsilon^{\prime}}$ $\displaystyle\times e^{-z\upsilon-\tau\tau^{\prime}}\int\frac{d^{2}\beta}{\pi}\exp\left[-2\mu\left|\beta\right|^{2}+2\left(\sigma\tau+z^{\ast}+\upsilon\right)\beta\right.$ $\displaystyle\left.+2\left(\sigma\tau^{\prime}+z+\upsilon^{\prime}\right)\beta^{\ast}\right]_{\upsilon=\upsilon^{\prime}=\tau=\tau^{\prime}=0}$ $\displaystyle=\frac{\allowbreak N\left(-1\right)^{m+n}}{2\mu m!n!}e^{\frac{2-2\mu}{\mu}\left|z\right|^{2}}\frac{\partial^{2m}}{\partial\upsilon^{m}\partial\upsilon^{\prime m}}\frac{\partial^{2n}}{\partial\tau^{n}\partial\tau^{\prime n}}$ $\displaystyle\times\exp\left[\omega\upsilon\upsilon^{\prime}+\allowbreak\left(\lambda\sigma-1\right)\allowbreak\tau\tau^{\prime}+\lambda\left(\tau\upsilon^{\prime}+\upsilon\tau^{\prime}\right)\right.$ $\displaystyle\left.+\omega\left(z^{\ast}\upsilon^{\prime}+z\upsilon\right)+\lambda\left(z\tau+z^{\ast}\tau^{\prime}\right)\right]_{\upsilon=\upsilon^{\prime}=\tau=\tau^{\prime}=0},$ (50) where we have set $\omega=\frac{2-\mu}{\mu},\lambda=\frac{2\sigma}{\mu},\text{ }\sigma=\frac{e^{-\left(\kappa-g\right)t}}{\sqrt{1-A^{2}}},$ (51) and $N=\frac{4\left(A-1\right)^{n}}{\left(A+1\right)^{n+1}}\frac{\left(-1\right)^{m}}{L_{m}(-\left|z\right|^{2})},\mu=\allowbreak 1+\frac{e^{-2\left(\kappa-g\right)t}}{A+1}.$ (52) Further expanding the exponential item $\exp\left[\omega\upsilon\upsilon^{\prime}+\allowbreak\left(\lambda\sigma-1\right)\tau\tau^{\prime}\right],$ we finally obtain $\displaystyle p\left(n\right)$ $\displaystyle=\frac{\allowbreak N\lambda^{2n}e^{\frac{2-2\mu}{\mu}\left|z\right|^{2}}}{2\mu\left(-\omega\right)^{n-m}}\sum_{l,k=0}^{m,n}\frac{m!n!\left[\omega\left(\lambda\sigma-1\right)/\lambda^{2}\right]^{k}}{l!k!\left[\left(m-l\right)!\left(n-k\right)!\right]^{2}}$ $\displaystyle\times\left|H_{m-l,n-k}\left(i\sqrt{\omega}z,i\sqrt{\omega}z^{\ast}\right)\right|^{2}.$ (53) In particular, when $g=0,$ leading to $A=\omega=T,\sigma=\frac{e^{-\kappa t}}{\sqrt{1-T^{2}}},\mu=\allowbreak\frac{2}{2-e^{-2\kappa t}},\lambda\sigma=1,$ and $\lambda=\sqrt{1+T}$, thus $\displaystyle p\left(n\right)$ $\displaystyle=\frac{m!}{n!}\frac{\left(1-\omega\right)^{n}}{L_{m}(-\left|z\right|^{2})}\sum_{l=0}^{m}\frac{\omega^{m-n}e^{-e^{-2t\kappa}\left|z\right|^{2}}}{l!\left[\left(m-l\right)!\right]^{2}}$ $\displaystyle\times\left|H_{m-l,n}\left(i\sqrt{\omega}z,i\sqrt{\omega}z^{\ast}\right)\right|^{2},$ (54) which concides with Eq.(43) with idea detection efficiency in Ref. 23 . In sum, by virtue of the thermo entangled state representation that has a fictitious mode as a counterpart mode of the system mode, we have derived the relation between the Wigner functions at $t$ time and the initial time when quantum system interacts with envoirnment, such as decoherence, damping and amplification. As another quantity describing quantum system, the formula of photon number distribution has also been derived, which can be evaluated by performing an integration for the initial Wigner function. Our deriviations seem more concise. ACKNOWLEDGEMENT: Work supported by the National Natural Science Foundation of China under grants: 10775097 and 10874174. ## References * (1) W. H. Louisell, Quantum Statistical Properties of Radiation (Wiley, New York, 1973). * (2) H. J. Carmichael, Statistical Methods in Quantum Optics 1: Master Equations and Fokker-Planck Equations, Springer-Verlag, Berlin, 1999; H. J. Carmichael, Statistical Methods in Quantum Optics 2: Non-Classical Fields, (Springer-Verlag, Berlin, 2008). * (3) Wolfgang P. Schleich, Quantum Optics in Phase Space, (Wiley-VCH, Birlin, 2001). * (4) M. Hillery, R. F. O’Connell, M. O. Scully and E. P. Wigner, Phys. Rep. 106, (1984) 121. * (5) Memorial Issue for H. Umezawa, Int. J. Mod. Phys. B 10, (1996) 1695 memorial issue and references therein. * (6) H. Umezawa, Advanced Field Theory – Micro, Macro, and Thermal Physics (AIP 1993) * (7) Y. Takahashi and H. Umezawa, Collecive Phenomena 2, (1975) 55. * (8) Hong-yi Fan and Yue Fan, Phys. Lett. A 246, (1998) 242; ibid, 282, (2001) 269. * (9) Hong-yi Fan and Yue Fan, J. Phys. A 35, (2002) 6873; Hong-yi Fan and Hai-liang Lu, Mod. Phys. Lett. B, 21, (2007) 183. * (10) Hong-yi Fan, Hai-liang Lu and Yue Fan, Ann. Phys _._ 321, (2006) 480. * (11) Hong-yi Fan, H. R. Zaidi and J. R. Klauder, Phys. Rev. D 35, (1987) 1831. * (12) A. Wünsche, J. Opt. B: Quantum Semiclass. Opt. 1, (1999) R11. * (13) E. P. Wigner, Phys. Rev. 40, (1932) 749 * (14) G. S. Agarwal and E. Wolf, Phys. Rev. D 2, (1970) 2161; R. F. O’Connell and E. P. Wigner, Phys. Lett. A 83, (1981) 145. * (15) A. Wünsche, J. Computational and Appl. Math. 133 (2001) 665. * (16) A. Wünsche, J . Phys. A: Math. and Gen. 33 (2000) 1603. * (17) R. R. Puri, Mathematical Methods of Quantum Optics (Springer-Verlag, Berlin, 2001), Appendix A. * (18) R. J. Glauber, Phys. Rev. 130, (1963) 2529; Phys. Rev. 131, (1963) 2766. * (19) J. R. Klauder and B. S. Skargerstam, Coherent States, (World Scientific, Singapore, 1985). * (20) C. Gardiner and P. Zoller, Quantum Noise (Springer Berlin, 2000). * (21) Hong-yi Fan and Li-yun Hu, Opt. Commun. 282, (2009) 932; 281, (2008) 5571. * (22) G. S. Agarwal and K. Tara, Phys. Rev. A 43, (1991) 492. * (23) Li-yun Hu and Hong-yi Fan, Phys. Scr. 79, (2009) 035004. * (24) Hong-yi Fan and Li-yun Hu, Opt. Lett. 33, (2008) 443.
arxiv-papers
2009-03-17T05:15:48
2024-09-04T02:49:01.197668
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Li-yun Hu and Hong-yi Fan", "submitter": "Liyun Hu", "url": "https://arxiv.org/abs/0903.2900" }
0903.2932
# Experimental investigation of electric field distributions in a chaotic 3D microwave rough billiard Oleg Tymoshchuk, Nazar Savytskyy, Oleh Hul, Szymon Bauch, and Leszek Sirko Institute of Physics, Polish Academy of Sciences, Aleja Lotników 32/46, 02-668 Warszawa, Poland (January 28, 2007) ###### Abstract We present the first experimental study of the electric field distributions $E_{N}$ of a three-dimensional (3D) microwave chaotic rough billiard with the translational symmetry. The translational symmetry means that the cross- section of the billiard is invariant under translation along $z$ direction. The 3D electric field distributions were measured up to the level number $N=489$. In this way the experimental spatial correlation functions $C_{N,p}({\bf x,s})\propto\langle E_{N,p}({\bf x}+\frac{1}{2}{\bf s})E_{N,p}^{\ast}({\bf x}-\frac{1}{2}{\bf s})\rangle$ were found and compared with the theoretical ones. The experimental results for higher two-dimensional level number $N_{\bot}$ appeared to be in good agreement with the theoretical predictions. ###### pacs: 05.45.Mt,05.45.Jn In this paper we present the first experimental investigation of electric field distributions of the chaotic 3D microwave rough billiard with the translational symmetry. Due to experimental difficulties there are very few experimental studies devoted to 3D chaotic microwave cavities Sirko1995 ; Alt1997 ; Dorr1998 ; Eckhardt1999 ; Dembowski2002 . In a pioneering experiment Deus et al. Sirko1995 have been measured eigenfrequencies of the 3D chaotic (irregular) microwave cavity in order to confirm that their distribution displays behavior characteristic for classically chaotic quantum systems, viz., the Wigner distribution. Three-dimensional chaotic cavities as well as properties of random electromagnetic vector field have been also scarcely studied theoretically Primack2000 ; Prosen1997 ; Arnaut2006 . In general, there is no analogy between quantum billiards and electromagnetic cavities in three dimensions. However, for 3D cavities with the translational symmetry the classification of the modes into transverse electric (TE) and transverse magnetic (TM) is possible. The TM modes are especially important because they allow for the simulation of 2D quantum billiards on cross- sectional planes of 3D cavities. Furthermore, we show in this paper that the distributions of the electric field of TM modes of the 3D chaotic rough cavity can be experimentally measured. Figure 1: Upper panel: Sketch of the chaotic half-circular 3D microwave rough billiard in the $xy$ plane. Dimensions are given in cm. The cavity sidewalls are marked by 1 and 2 (see text). Squared wave functions $|\psi_{N,p}(R_{c},\theta)|^{2}$ were evaluated on a half-circle of fixed radius $R_{c}=9.25$ cm. Billiard’s rough boundary $\Gamma$ is marked with the bold line. Lower panel: White circle marks the position of the hole drilled in the upper wall of the cavity. This hole was used to introduce the perturber inside the cavity in order to measure the $z$-component of the electric field distributions $E_{N,p}({\bf x})$. In the experiment we used 3D cavity with the translational symmetry in the shape of a rough half-circle (Fig. 1) with the height $h=60$ mm. The cavity was made of polished aluminium. We suppose that the direction of the translational symmetry of the cavity is along the $z$-axis. The boundary conditions at $z=0$ and $z=h$ demand that the $z$ dependence of the $z$-component of the electric and magnetic fields $E_{N,p}({\bf x})$ and $B_{N,p}({\bf x})$ of TM modes be in the form $E_{N,p}({\bf x})\equiv E_{N,p}(x,y,z)=A_{N,p}\psi_{N,p}(x,y)f_{p}(z)$, where $f_{p}(z)=\cos(p\pi z/h)$, $p=0,1,2\ldots$, $A_{N,p}$ is the normalization constant and $B_{N,p}({\bf x})=0$. The functional dependence of $E_{N,p}({\bf x})$ on the plane cross section coordinates is denoted by the amplitude $\psi_{N,p}(x,y)\equiv E_{N,p}(x,y)$. The amplitude $\psi_{N,p}(x,y)$ satisfies the Helmholtz equation $(\bigtriangleup_{\bot}+k_{N,p}^{2})\psi_{N,p}(x,y)=0,$ $None$ where $\bigtriangleup_{\bot}$ is two-dimensional Laplacian operator and $k_{N,p}=(k_{N}^{2}-(p\pi/h)^{2})^{1/2}$ is the effective wave vector. The wave vector $k_{N}=2\pi\nu_{N}/c$, where $\nu_{N}$ is the resonance frequency of the level $N$ and $c$ is the speed of light in the vacuum. The equation (1) is equivalent to the Schrödinger equation (in units $\hbar=1$) describing a particle of mass $m=1/2$ with the kinetic energy $k_{N}^{2}$ in an external potential $V=(p\pi/h)^{2}$ Kim2005 . Therefore, microwave 3D cavities with the translational symmetry simulate on the cross-sectional planes quantum billiards with the external potential $(p\pi/h)^{2}$. In this way microwave cavities can be effectively used beyond the standard 2D frequency limit (the case $p=0$) Hans in simulation of quantum systems. The amplitude $\psi_{N,p}(x,y)$ fulfills Dirichlet boundary conditions on the sidewalls of the billiard. Therefore, throughout the text the amplitudes $\psi_{N}(x,y)$ are also often called the wave functions $\psi_{N}(x,y)$. It is important to note that the full electric field $E_{N,p}({\bf x})$ satisfies additionally Neumann boundary conditions at the top and the bottom of the cavity. Because of the relatively low quality factor of the cavity ($Q\simeq 4000$) the value of the level number $N$ was evaluated from the Balian–Bloch formula Balian $N(k)=\frac{1}{3\pi^{2}}Vk^{3}-\frac{2}{3\pi^{2}}\int_{S}\frac{d\sigma_{\omega}}{R_{\omega}}k,$ $None$ where k is the wave vector, $V=(9.43\pm 0.01)\cdot 10^{-4}$ m3 is the volume of the cavity and $\int_{S}\frac{d\sigma_{\omega}}{R_{\omega}}=0.932$ m $\pm 0.005$ m is the surface curvature averaged over the surface of the cavity. The measurements allowed us for the first time to evaluate the spatial correlation function Kaufman88 $C_{N,p}({\bf x},{\bf s})=\frac{1}{\langle|E_{N,p}({\bf x})|^{2}\rangle}\langle E_{N,p}({\bf x}+\frac{1}{2}{\bf s})E_{N,p}^{\ast}({\bf x}-\frac{1}{2}{\bf s})\rangle,$ $None$ where the local average $\langle\cdots\rangle$ is defined as follows $\langle|E_{N,p}({\bf x})|^{2}\rangle=\frac{1}{\Delta^{n}}\int_{-\Delta/2}^{\Delta/2}|E_{N,p}({\bf x}+{\bf s})|^{2}d^{n}s.$ $None$ The 3D cavity sidewalls are made of 2 segments (see Fig. 1). The rough segment 1 is described on the cross-sectional planes by the radius function $R(\theta)=R_{0}+\sum_{m=2}^{M}{a_{m}\sin(m\theta+\phi_{m})}$, where the mean radius $R_{0}$=10.0 cm, $M=20$, $a_{m}$ and $\phi_{m}$ are uniformly distributed on [0.084,0.091] cm and [0,2$\pi$], respectively, and $0\leq\theta<{\pi}$. (Here, for the convenience, the polar coordinates $r$ and $\theta$ are used instead of the Cartesian ones $x$ and $y$.) The surface roughness of a billiard on the cross-sectional planes is characterized by the function $k(\theta)=(dR/d\theta)/R_{0}$. For our billiard we have the angle average $\tilde{k}=(\left<k^{2}(\theta)\right>_{\theta})^{1/2}\simeq 0.400$. In such a billiard the classical dynamics is diffusive in orbital momentum due to collisions with the rough boundary because $\tilde{k}$ is much above the chaos border $k_{c}=M^{-5/2}=0.00056$ Frahm97 . The roughness parameter $\tilde{k}$ determines also other properties of the billiard Frahm on the cross-sectional planes. The amplitudes $\psi_{N,p}(r,\theta)$ are localized for the two- dimensional level number $N_{\bot}<N_{e}=1/128\tilde{k}^{4}$, where $N_{\bot}=\frac{A}{4\pi}k_{N,p}^{2}-\frac{P}{4\pi}k_{N,p}$. $A=(1.572\pm 0.002)\cdot 10^{-2}$ m2 and $P=0.537$ m $\pm 0.001$ m are the cross-sectional plane area and its perimeter, respectively. Because of a large value of the roughness parameter $\tilde{k}$ the localization border lies very low, $N_{e}\simeq 1$. The border of Breit-Wigner regime is $N_{W}=M^{2}/48\tilde{k}^{2}\simeq 52$. It means that between $N_{e}<N_{\bot}<N_{W}$ Wigner ergodicity Frahm ought to be observed and for $N_{\bot}>N_{W}$ Shnirelman ergodicity should emerge. To measure the amplitudes $\psi_{N,p}(r,\theta)$ of the 3D electric field distributions we used a very effective method described in Savytskyy2003 . It is based on the perturbation technique Slater52 and preparation of the “trial functions” Savytskyy2004 ; Hul2005 ; Hul2006 . In the perturbation method a small perturber is introduced inside the cavity to alter its resonant frequencies and in this way to evaluate the squared wave functions $|\psi_{N,p}(R_{c},\theta)|^{2}$ (see Fig. 1). The perturber (4.0 mm in length and 0.3 mm in diameter, oriented in $z$-direction) was moved by the stepper motor via the Kevlar line hidden in the groove (0.4 mm wide, 1.0 mm deep) made in the cavity’s bottom wall along the half-circle $R_{c}$. The measurements were performed at 0.36 mm steps along a half-circle with fixed radius $R_{c}=9.25$ cm. In order to find the dependence of the electric field distributions $E_{N,p}({\bf x})$ on the $z$ coordinate and to estimate the wave vector $k_{3}=p\pi/h$ we measured the electric field inside the 3D cavity along the $z$-axis. Also in this case the perturber (4.5 mm in length and 0.3 mm in diameter) was attached to the Kevlar line and moved by the stepper motor. The perturber entered and exited the cavity by small holes (0.4 mm) drilled in the upper and the bottom walls of the cavity. The both holes were located at the position: $r=9.11$ cm, $\theta=0.47$ radians. Using the method of the “trial wave function” we were able to reconstruct 75 experimental wave functions $\psi_{N,p}(r,\theta)$, which belonged to TM modes of the rough half-circular 3D billiard with the level number $N$ between 2 and 489. The range of corresponding eigenfrequencies was from $\nu_{2}\simeq 2.47$ GHz to $\nu_{489}\simeq 11.99$ GHz. The remaining wave functions belonging to TM modes, from the range $N=2-489$, were not reconstructed because of near- degeneration of the neighboring eigenfrequencies or due to the problems with the measurements of $|\psi_{N,p}(R_{c},\theta)|^{2}$ along a half-circle coinciding for its significant part with one of the nodal lines of $\psi_{N,p}(r,\theta)$. Figure 2: The reconstructed wave function $\psi_{460,0}(r,\theta)$ of the chaotic half-circular microwave rough billiard. The amplitudes have been converted into a grey scale with white corresponding to large positive and black corresponding to large negative values, respectively. Dimensions of the billiard are given in cm. In the figure the $z$ dependence of the electric field distribution $E_{460,0}(r,\theta,z)|_{x=0}\propto\psi_{460,0}(r,\theta)|_{x=0}f_{0}(z)$ is also shown. In Fig. 2 and Fig. 3 we show two examples of reconstructed wave functions $\psi_{460,0}(r,\theta)$ and $\psi_{463,4}(r,\theta)$, respectively. The character of the wave functions predominantly depends on the effective wave vector $k_{N,p}$. It is seen that the wave function $\psi_{463,4}(r,\theta)$ in Fig. 3 is more regular than the one presented in Fig. 2 in spite of having the larger level number $N$. Figure 3: The reconstructed wave function $\psi_{463,4}(r,\theta)$ of the chaotic half-circular microwave rough billiard. The $z$ dependence of the electric field distribution $E_{463,4}(r,\theta,z)|_{x=0}\propto\psi_{463,4}(r,\theta)|_{x=0}f_{4}(z)$ is also shown. In order to check ergodicity of the billiard’s wave functions $\psi_{N,p}(R_{c},\theta)$, especially close to the ergodicity borders, one should use some additional measures such as e.g., calculation of the structures of their energy surfaces Frahm97 . For this reason we extracted wave function amplitudes $C^{(N,p)}_{nl}=\left<n,l|N,p\right>$ in the basis $n,l$ of a half-circular billiard with radius $r_{max}$, where $n=1,2,3\ldots$ enumerates the zeros of the Bessel functions and $l=1,2,3\ldots$ is the angular quantum number. As expected, close to the border of the regimes of Breit-Wigner and Shnirelman ergodicity the wave function $\psi_{460,0}(r,\theta)$ ($N_{\bot}=65$) was found to be extended homogeneously over the whole energy surface Hlushchuk01 (figure not shown here). In contrary, the wave function $\psi_{463,4}(r,\theta)$, $N_{\bot}=16$, which lies closer to the localization boarder, displays the tendency to localization in $n,l$ basis (figure not shown here). The measurement of 3D electric field distributions $E_{N,p}({\bf x})$ allowed us for the first time to find the experimental spatial correlation function $C_{N,p}({\bf x,s})$. It is easy to show Berry77 that for the 3D chaotic cavity with the translational symmetry the spatial correlation function should have the following form: $C_{N,p}({\bf x},|{\bf s}|)\equiv C_{N,p}(|{\bf s}|)=J_{0}(k_{N,p}s_{xy})\cos(p\pi s_{z}/h),$ $None$ where $|{\bf s}|=(s_{xy}^{2}+s_{z}^{2})^{1/2}$. For the cross-sectional planes $z=const$ the correlation function $C_{N,p}(|{\bf s}|)\sim J_{0}(k_{N,p}s_{xy})$ is reduced to the well known result of Berry Berry77 for chaotic 2D wave functions described by a random superposition of plane waves. Figure 4: Panels (a)-(c) show the experimental correlation function $C_{460,0}({\bf x},|{\bf s}|)$ calculated at ${\bf x}=$ (-2.75 cm, 4.35 cm, 0 cm) for the three projection angles $\phi=0$, $\pi/4$, and $\pi/2$, respectively. Experimental correlation function $C_{460,0}({\bf x},|{\bf s}|)$ (full line) is compared with the theoretical one (dashed line). In Fig. 4(a)-(c) we show a representative example of the experimental correlation function $C_{460,0}({\bf x},|{\bf s}|)$ ($N_{\bot}=65$) calculated at ${\bf x}=$ (-2.75 cm, 4.35 cm, 0 cm) for the three different projection angles $\phi=0$, $\pi/4$, and $\pi/2$, respectively, where $\phi=\arcsin(s_{z}/|{\bf s}|)$. The local average $\langle\cdots\rangle$ required for the evaluation of $C_{N,p}({\bf x},|{\bf s}|)$ (see the formulas (3) and (4)) was calculated on the cross-sectional plane $xy$ in the range $\Delta/2=2\pi/k_{N,p}$. The experimental correlation functions $C_{460,0}({\bf x},|{\bf s}|)$ are compared in Fig. 4 with the theoretical ones. In all cases we find good agreement with the theoretical predictions given by the formula (5). Small discrepancies observed in Fig. 4(a) for $|{\bf s}|>1$ can be connected with the finiteness of the system and were theoretically studied in Baecker02 . Figure 5: Panels (a)-(c) show the experimental correlation function $C_{463,4}({\bf x},|{\bf s}|)$ calculated at ${\bf x}=$ (-2.75 cm, 4.35 cm, 0 cm) for the three projection angles $\phi=0$, $\pi/4$, and $\pi/2$, respectively. Experimental correlation function $C_{463,4}({\bf x},|{\bf s}|)$ (full line) is compared with the theoretical one (dashed line). Fig. 5(a)-(c) shows the experimental correlation function $C_{463,4}({\bf x},|{\bf s}|)$ ($N_{\bot}=16$) calculated at ${\bf x}=$ (-2.75 cm, 4.35 cm, 0 cm) for the three different projection angles $\phi=0$, $\pi/4$, and $\pi/2$, respectively. The experimental correlation functions $C_{463,4}(|{\bf s}|)$ are compared in Fig. 5 with the theoretical ones. In Fig. 5 (a), even for small $|{\bf s}|$, we find a significant departure of the experimental correlation function from the theoretical prediction, which clearly suggests that the wave function $\psi_{463,4}(r,\theta)$ is not chaotic. Also in Fig. 5 (b)-(c) the experimental correlation functions $C_{463,4}(|{\bf s}|)$ show for larger $|{\bf s}|$ significant deviations from the theoretical ones. The discrepancies between the correlation function $C_{463,4}({\bf x},|{\bf s}|=z)$ for the $z$-component of the electric field distribution and the theoretical prediction in Fig. 5(c) arise mainly due to the procedure of averaging of the correlation function $C_{N,p}({\bf x},|{\bf s}|)$ in $z$-direction, which was taken over the period of the cosine function. In summary, we measured the wave functions of the chaotic 3D rough microwave billiard with the translational symmetry up to the level number $N=489$. For the first time the experimental correlation function $C_{N,p}({\bf x},{\bf s})$ was estimated and compared with the theoretical prediction. For the states with higher $N_{\bot}$ we find, especially for small values of the parameter $|{\bf s}|$, good agreement with the theoretical predictions, which show that the wave functions are chaotic. For the states with lower $N_{\bot}$ significant discrepancies between experimental and theoretical results are observed. Acknowledgments. This work was partially supported by the Ministry of Science and Higher Education grants No. N202 099 31/0746 and 2 P03B 047 24. ## References * (1) S. Deus, P.M. Koch, and L. Sirko, Phys. Rev. E 52, 1146 (1995). * (2) H. Alt, C. Dembowski, H.-D. Gräf, R. Hofferbert, H. Rehfeld, A. Richter, R. Schuhmann, and T. Weinland, Phys. Rev. Lett. 79, 1026 (1997). * (3) U. Dörr, H.-J. Stöckmann, M. Barth, and U. Kuhl, Phys. Rev. Lett. 80, 1030 (1998). * (4) B. Eckhardt, U. Dörr, U. Kuhl, and H.-J. Stöckmann, Europhys. Lett. 46, 134 (1999). * (5) C. Dembowski, B. Dietz, H.-D. Gräf, A. Heine, T. Papenbrock, A. Richter, and C. Richter, Phys. Rev. Lett. 89, 064101 (2002). * (6) H. Primack and U. Smilansky, Phys. Rev. Lett. 74, 4831 (1995). * (7) T. Prosen, Phys. Lett. A 233, 323 (1997). * (8) L. R. Arnaut, Phys. Rev. E 73, 036604 (2006). * (9) Y.-H. Kim, U. Kuhl, H.-J. Stöckmann, and J. P. Bird, J. Phys.: Condens. Matter 17, L191 (2005). * (10) H.-J. Stöckmann, J. Stein, Phys. Rev. Lett. 64, 2215 (1990). * (11) R. Balian and C. Bloch, Ann. Phys. (N.Y.) 84, 559 (1974); Ann. Phys. (N.Y.) 64, 271(E) (1971). * (12) S.W. McDonald and A.N. Kaufman, Phys. Rev A 37, 3067 (1988). * (13) Y. Hlushchuk, A. Błȩdowski, N. Savytskyy, and L. Sirko, Physica Scripta 64, 192 (2001). * (14) K.M. Frahm and D.L. Shepelyansky, Phys. Rev. Lett. 78, 1440 (1997). * (15) K.M. Frahm and D.L. Shepelyansky, Phys. Rev. Lett. 79, 1833 (1997). * (16) N. Savytskyy and L. Sirko, Phys. Rev. E 65, 066202-1 (2002). * (17) L.C. Maier and J.C. Slater, J. Appl. Phys. 23, 68 (1952). * (18) N. Savytskyy, O. Hul, and L. Sirko, Phys. Rev. E 70, 056209 (2004). * (19) O. Hul, N. Savytskyy, O. Tymoshchuk, S. Bauch, and L. Sirko, Phys. Rev. E 72, 066212 (2005). * (20) O. Hul, N. Savytskyy, O. Tymoshchuk, S. Bauch, and L. Sirko, Acta Phys. Pol. A 109, 73 (2006). * (21) M.V. Berry, J. Phys. A 10, 2083 (1977). * (22) A. Bäcker and R. Schubert, J. Phys. A 35, 539 (2002).
arxiv-papers
2009-03-17T09:54:32
2024-09-04T02:49:01.205757
{ "license": "Public Domain", "authors": "Oleg Tymoshchuk, Nazar Savytskyy, Oleh Hul, Szymon Bauch and Leszek\n Sirko", "submitter": "Oleh Hul", "url": "https://arxiv.org/abs/0903.2932" }
0903.2939
# Investigation of nodal domains in a chaotic three-dimensional microwave rough billiard with the translational symmetry Nazar Savytskyy, Oleg Tymoshchuk, Oleh Hul, Szymon Bauch and Leszek Sirko Institute of Physics, Polish Academy of Sciences, Aleja Lotników 32/46, 02-668 Warszawa, Poland (March 20, 2007) ###### Abstract We show that using the concept of the two-dimensional level number $N_{\bot}$ one can experimentally study of the nodal domains in a three-dimensional (3D) microwave chaotic rough billiard with the translational symmetry. Nodal domains are regions where a wave function has a definite sign. We found the dependence of the number of nodal domains $\aleph_{N_{\bot}}$ lying on the cross-sectional planes of the cavity on the two-dimensional level number $N_{\bot}$. We demonstrate that in the limit $N_{\bot}\rightarrow\infty$ the least squares fit of the experimental data reveals the asymptotic ratio $\aleph_{N_{\bot}}/N_{\bot}\simeq 0.059\pm 0.029$ that is close to the theoretical prediction $\aleph_{N_{\bot}}/N_{\bot}\simeq 0.062$. This result is in good agreement with the predictions of percolation theory. ###### pacs: 05.45.Mt,05.45.Df In this paper we show that measuring the distributions of the electric field of TM modes of a 3D chaotic rough cavity with the translational symmetry one can find the dependence of the number of nodal domains $\aleph_{N_{\bot}}$ lying on the cross-sectional planes of the cavity on the two-dimensional level number $N_{\bot}$. The translational symmetry means that the cross-section of the billiard is invariant under translation along $z$ direction. In the seminal papers Blum et al. Blum2002 and Bogomolny and Schmit Bogomolny2002 showed that the distributions of the number of nodal domains in two-dimensional (2D) systems can be used to distinguish between the systems with integrable and chaotic underlying classical dynamics. The theoretical findings have been tested in a series of experiments with chaotic microwave 2D rough billiards Savytskyy2004 ; Hul2005 ; Hul2006 . Due to severe experimental problems there are very few experimental studies devoted to 3D chaotic microwave cavities Sirko1995 ; Alt1997 ; Dorr1998 ; Eckhardt1999 ; Dembowski2002 . In a pioneering experiment Deus et al. Sirko1995 have been measured eigenfrequencies of the 3D chaotic (irregular) microwave cavity in order to confirm that their distribution displays behavior characteristic for classically chaotic quantum systems, viz., the Wigner distribution. In other important experiments the periodic orbits Alt1997 , the distributions and the correlation function of the frequency shifts caused by the external perturbation Dorr1998 ; Eckhardt1999 and a trace formula for chaotic 3D cavities Dembowski2002 have been respectively studied. Quite recently the spatial correlation functions of the 3D experimental microwave chaotic rough billiard with the translational symmetry have been studied by Tymoshchuk et al Tymoshchuk2007 . Three-dimensional chaotic cavities and properties of random electromagnetic vector field have been also studied in several theoretical papers Primack2000 ; Prosen1997 ; Arnaut2006 . The important feature of 3D cavities with the translational symmetry is connected with the fact that their modes can be classified into transverse electric (TE) and transverse magnetic (TM). Although, there is no analogy between quantum billiards and electromagnetic cavities in three dimensions, the TM modes are especially important because they allow for the simulation of 2D quantum billiards on cross-sectional planes of 3D cavities. Figure 1: Sketch of the chaotic half-circular 3D microwave rough billiard in the $xy$ plane. Dimensions are given in cm. The cavity sidewalls are marked by 1 and 2 (see text). Squared wave functions $|\psi_{N,p}(R_{c},\theta)|^{2}$ were evaluated on a half-circle of fixed radius $R_{c}=9.25$ cm. Billiard’s rough boundary $\Gamma$ is marked with the bold line. The white circle centered at $x=8.12$ cm and $y=4.13$ cm marks the position of the hole drilled in the upper wall of the cavity. The hole was used to introduce the perturber inside the cavity in order to measure the $z$-component of the electric field distributions $E_{N,p}({\bf x})$. In the experiment we used 3D cavity with the translational symmetry in the shape of a rough half-circle (Fig. 1) with the height $h=60$ mm. The cavity was made of polished aluminium. The upper and bottom walls of the cavity were attached to the sidewalls with 48 screws in order to make good electrical contact. Assuming that the direction of the translational symmetry of the cavity is along the $z$-axis the boundary conditions at $z=0$ and $z=h$ demand that the $z$ dependence of the $z$-component of the electric and magnetic fields $E_{N,p}({\bf x})$ and $B_{N,p}({\bf x})$ of TM modes be in the form $E_{N,p}({\bf x})\equiv E_{N,p}(x,y,z)=A_{N,p}\psi_{N,p}(x,y)f_{p}(z)$, where $f_{p}(z)=\cos(p\pi z/h)$, $p=0,1,2\ldots$, $A_{N,p}$ is the normalization constant and $B_{N,p}({\bf x})=0$. The dependence of $E_{N,p}({\bf x})$ on the plane cross section coordinates we denote by the amplitude $\psi_{N,p}(x,y)\equiv E_{N,p}(x,y)$. Then, the amplitude $\psi_{N,p}(x,y)$ satisfies the Helmholtz equation $(\bigtriangleup_{\bot}+k_{N,p}^{2})\psi_{N,p}(x,y)=0,$ $None$ where $\bigtriangleup_{\bot}$ is two-dimensional Laplacian operator and $k_{N,p}=(k_{N}^{2}-(p\pi/h)^{2})^{1/2}$ is the effective wave vector. The wave vector $k_{N}=2\pi\nu_{N}/c$, where $\nu_{N}$ is the resonance frequency of the level $N$ and $c$ is the speed of light in the vacuum. One can easily see that the equation (1) is equivalent to the Schrödinger equation (in units $\hbar=1$) describing a particle of mass $m=1/2$ with the kinetic energy $k_{N}^{2}$ in an external potential $V=(p\pi/h)^{2}$ Kim2005 . Therefore, 3D microwave cavities can be effectively used beyond the standard 2D frequency limit (the case $p=0$) Hans in simulation of quantum systems. The amplitude $\psi_{N,p}(x,y)$ fulfills Dirichlet boundary conditions on the sidewalls of the billiard and therefore, throughout the text it is also called the wave functions $\psi_{N}(x,y)$. It is worth noting that the full electric field $E_{N,p}({\bf x})$ satisfies Neumann boundary conditions at the top and the bottom of the cavity. The measurements of $E_{N,p}({\bf x})$ of a 3D microwave cavity allowed us to test experimentally an important finding of the papers by Blum et al. Blum2002 and Bogomolny and Schmit Bogomolny2002 which connects the number of nodal domains of 2D billiards with the level number $N$. We will show that for the 3D cavities with the translational symmetry the number of nodal domains $\aleph_{N_{\bot}}$ lying on the cross-sectional planes of the cavity is connected with the two-dimensional level number $N_{\bot}$. The condition $E_{N,p}({\bf x})|_{z=const}=0$ on the cross-sectional planes of the cavity determines a set of nodal lines which separate regions (nodal domains) with opposite signs of the electric field distribution $E_{N,p}({\bf x})|_{z=const}$. The value of the level number $N$ of the 3D cavity was evaluated from the Balian–Bloch formula Balian . $N(k)=\frac{1}{3\pi^{2}}Vk^{3}-\frac{2}{3\pi^{2}}\int_{S}\frac{d\sigma_{\omega}}{R_{\omega}}k,$ $None$ where k is the wave vector, $V=(9.43\pm 0.01)\cdot 10^{-4}$ m3 is the volume of the cavity and $\int_{S}\frac{d\sigma_{\omega}}{R_{\omega}}=0.932$ m $\pm 0.005$ m is the surface curvature averaged over the surface of the cavity. We used this formula because of the relatively low quality factor of the cavity ($Q\simeq 4000$) some resonances overlapped. The two-dimensional level number $N_{\bot}$ is defined by the standard Weyl–Bloch formula $N_{\bot}=\frac{A}{4\pi}k_{N,p}^{2}-\frac{P}{4\pi}k_{N,p}$, where $A=(1.572\pm 0.002)\cdot 10^{-2}$ m2 and $P=0.537$ m $\pm 0.001$ m are the cross-sectional plane area of the cavity and its perimeter, respectively. The cavity sidewalls consist of two segments (see Fig. 1). The rough segment 1 is described on the cross-sectional planes by the radius function $R(\theta)=R_{0}+\sum_{m=2}^{M}{a_{m}\sin(m\theta+\phi_{m})}$, where the mean radius $R_{0}$=10.0 cm, $M=20$, $a_{m}$ and $\phi_{m}$ are uniformly distributed on [0.084,0.091] cm and [0,2$\pi$], respectively, and $0\leq\theta<{\pi}$. (For convenience, the polar coordinates $r$ and $\theta$ are used instead of the Cartesian ones $x$ and $y$.) It is worth noting that following our earlier experience Hlushchuk01b ; Hlushchuk01 we decided to use a rough desymmetrized half-circular cavity instead of a rough circular cavity, because the first one lowers the number of nearly degenerated eigenfrequencies. Additionally, a half-circular geometry of the cavity was suitable in the procedure of accurate measurements of the electric field distributions inside the billiard. The roughness of a billiard on the cross-sectional planes can be characterized by the function $k(\theta)=(dR/d\theta)/R_{0}$. For our microwave billiard we have the angle average $\tilde{k}=(\left<k^{2}(\theta)\right>_{\theta})^{1/2}\simeq 0.400$. The value of $\tilde{k}$ is much above the chaos border $k_{c}=M^{-5/2}=0.00056$ Frahm97 which indicates that in such a billiard the classical dynamics is diffusive in orbital momentum due to collisions with the rough boundary. The other properties of the billiard Frahm are also determined by the roughness parameter $\tilde{k}$. The amplitudes $\psi_{N,p}(r,\theta)$ are localized for the two-dimensional level number $N_{\bot}<N_{e}=1/128\tilde{k}^{4}$. Because of a large value of the roughness parameter $\tilde{k}$ the localization border lies very low, $N_{e}\simeq 1$. The border of Breit-Wigner regime is $N_{W}=M^{2}/48\tilde{k}^{2}\simeq 52$. It means that between $N_{e}<N_{\bot}<N_{W}$ Wigner ergodicity Frahm ought to be observed and for $N_{\bot}>N_{W}$ Shnirelman ergodicity should emerge. In order to measure the amplitudes $\psi_{N,p}(r,\theta)$ of the 3D electric field distributions we used an effective method described in Savytskyy2003 . It is based on the perturbation technique and preparation of the “trial functions”. In this method the amplitudes $\psi_{N}(r,\theta)$ (electric field distribution $E_{N}(r,\theta)$ inside the cavity) are determined from the form of electric field $E_{N,p}(R_{c},\theta)$ evaluated on a half-circle of fixed radius $R_{c}$ (see Fig. 1). The first step in evaluation of $E_{N,p}(R_{c},\theta)$ is measurement of $|E_{N,p}(R_{c},\theta)|^{2}$. The perturbation technique developed in Slater52 and used successfully in Slater52 ; Sridhar91 ; Richter00 ; Anlage98 was implemented for this purpose. In this method a small perturber is introduced inside the cavity to alter its resonant frequency. The perturber (4.0 mm in length and 0.3 mm in diameter, oriented in $z$-direction) was moved by the stepper motor via the Kevlar line hidden in the groove (0.4 mm wide, 1.0 mm deep) made in the cavity’s bottom wall along the half-circle $R_{c}$. Before closing the cavity we carefully inspected whether the pin moves smoothly, oriented in vertical position. Using such a perturber we had no positive frequency shifts that would exceed the uncertainty of frequency shift measurements (15 kHz). In order to determine the dependence of the electric field distributions $E_{N,p}({\bf x})$ on the $z$ coordinate and to estimate the wave vector $k_{3}=p\pi/h$ we measured the electric field inside the 3D cavity along the $z$-axis. The perturber (4.5 mm in length and 0.3 mm in diameter) was attached to the Kevlar line and moved by the stepper motor. It entered and exited the cavity by small holes (0.4 mm) drilled in the upper and the bottom walls of the cavity. The both holes were located at the position: $r=9.11$ cm, $\theta=0.47$ radians. To eliminate the variation of resonant frequencies connected with the thermal expansion of the aluminium cavity the temperature of the cavity was stabilized with the accuracy of 0.05 $\deg$. Using a field perturbation technique we were able to measure squared wave functions $|\psi_{N,p}(R_{c},\theta)|^{2}$ for 80 TM modes within the region $2\leq N\leq 489$. The range of corresponding eigenfrequencies was from $\nu_{2}\simeq 2.47$ GHz to $\nu_{489}\simeq 11.99$ GHz. The measurements were performed at 0.36 mm steps along a half-circle with fixed radius $R_{c}=9.25$ cm. This step was small enough to reveal in details the space structure of high-lying levels. Figure 2: Panel (a): Squared wave function $|\psi_{430,2}(R_{c},\theta)|^{2}$ (in arbitrary units) measured on a half-circle with radius $R_{c}=9.25$ cm ($\nu_{430}\simeq 11.50$ GHz). Panel (b): Squared $z$-component of the electric field distribution $|f_{2}(z)|^{2}$ measured at $r=9.11$ cm and $\theta=0.47$ radians. In Fig. 2 (a) and Fig. 2 (b) we show the examples of the squared amplitude $|\psi_{N,p}(R_{c},\theta)|^{2}$ and the squared $z$-component of the field, respectively, evaluated for the level number $N=430$. The perturbation method used in our measurements allows us to extract information about the modulus of the wave function amplitude $|\psi_{N,p}(R_{c},\theta)|$ at any given point of the cross-sectional plane $z=0$ but it doesn’t allow to determine the sign of $\psi_{N,p}(R_{c},\theta)$. In order to obtain information about the sign of $\psi_{N,p}(R_{c},\theta)$ we used the method of the “trial wave function” precisely described in Savytskyy2003 ; Savytskyy2004 ; Hul2005 . The amplitudes $\psi_{N,p}(r,\theta)$ of the electric field distributions of a rough half-circular 3D billiard may be expanded in terms of circular waves (here only odd states in expansion are considered) $\psi_{N,p}(r,\theta)=\sum_{s=1}^{L}a_{s}J_{s}(k_{N,p}r)\sin(s\theta),$ $None$ where $J_{s}$ is the Bessel function of order $s$. In Eq. (5) the number of basis functions is limited to $L=k_{N,p}r_{max}=l_{N}^{max}$, where $r_{max}=10.64$ cm is the maximum radius of the cavity. $l_{N}^{max}=k_{N,p}r_{max}$ is a semiclassical estimate for the maximum possible angular momentum for a given $k_{N}$. Circular waves with angular momentum $s>L$ correspond to evanescent waves and can be neglected. Coefficients $a_{s}$ may be extracted from the “trial wave function” $\psi_{N,p}(R_{c},\theta)$ via $a_{s}=[\frac{\pi}{2}J_{s}(k_{N,p}R_{c})]^{-1}\int_{0}^{\pi}\psi_{N,p}(R_{c},\theta)\sin(s\theta)d\theta.$ $None$ Due to experimental uncertainties and the finite step size in the measurements of $|\psi_{N,p}(R_{c},\theta)|^{2}$ the wave functions $\psi_{N,p}(r,\theta)$ are not exactly zero at the boundary $\Gamma$. As the quantitative measure of the sign assignment quality we chose the integral $I=\gamma\int_{\Gamma}|\psi_{N,p}(r,\theta)|^{2}dl$ calculated along the billiard’s rough boundary $\Gamma$, where $\gamma$ is length of $\Gamma$. For correctly reconstructed wave functions the integral $I$ was several times smaller than in the case of not correctly reconstructed ones. It is worth noting that since the pin is attached to the line it cannot be stuck. However, one may assume that during the movement the pin may be accidentally, from time to time, slightly slanted, adding small ”a noise-like component” to the measured electric field. The formula (5) shows that each wave function is expanded in terms of $L$ circular waves which filters out noise-like higher frequency Fourier components from the reconstructed wave function. The same filtering removes out the influence of the experimental uncertainties of frequency shifts on the reconstructed wave functions. Figure 3: The “trial wave function” $\psi_{430,2}(R_{c},\theta)$ (in arbitrary units) with the correctly assigned signs, which was used in the reconstruction of the wave function $E_{430,2}(r,\theta,z)$ of the billiard (see Fig. 4). In Fig. 3 we show the “trial wave function” $\psi_{430,2}(R_{c},\theta)$ with the correctly assigned signs, which was used in the reconstruction of the wave function $\psi_{430,2}(r,\theta)$ of the billiard (see Fig. 4). In Fig. 4 different nodal domains are separated by the bold full lines. Figure 4: The reconstructed wave function $\psi_{430,2}(r,\theta)$ of the chaotic half-circular microwave rough billiard. The amplitudes have been converted into a grey scale with white corresponding to large positive and black corresponding to large negative values, respectively. The structure of the nodal lines are shown by the bold full lines. Dimensions of the billiard are given in cm. In the figure the $z$ dependence of the electric field distribution $E_{430,2}(r,\theta,z)|_{x=0}\propto\psi_{430,2}(r,\theta)|_{x=0}f_{2}(z)$ is also shown. Using the method of the “trial wave function” we were able to reconstruct 75 experimental wave functions $\psi_{N,p}(r,\theta)$, which belonged to TM modes of the rough half-circular 3D billiard with the level number $N$ between 2 and 489. The remaining wave functions belonging to TM modes, from the range $N=2-489$, were not reconstructed because of near-degeneration of the neighboring eigenfrequencies or due to the problems with the measurements of $|\psi_{N,p}(R_{c},\theta)|^{2}$ along a half-circle coinciding for its significant part with one of the nodal lines of $\psi_{N,p}(r,\theta)$. Figure 5: Structure of the energy surface of the wave functions lying close to the boarder of the regimes of Breit-Wigner and Shnirelman ergodicity ($N_{W}=52$), panels (a) and (b), and for the low wave function in the regime of Breit-Wigner ergodicity, panel (c). Panel (a): The moduli of amplitudes $|C^{(460,0)}_{nl}|$ for the wave function $\psi_{460,0}(r,\theta)$, $N_{\bot}=65$, lying in the regime of Shnirelman ergodicity. Panel (b): The moduli of amplitudes $|C^{(430,2)}_{nl}|$ for the wave function $\psi_{430,2}(r,\theta)$, $N_{\bot}=50$, in the regime of Breit-Wigner ergodicity . Panel (c): The moduli of amplitudes $|C^{(463,4)}_{nl}|$ for the wave function $\psi_{463,4}(r,\theta)$ lying in the regime of Breit-Wigner ergodicity close to the localization boarder. Full lines show the semiclassical estimation of the energy surface (see text). The borders of Breit-Wigner and Shnirelman ergodicities are not sharp. Therefore, to check ergodicity of the billiard’s wave functions $\psi_{N,p}(r,\theta)$, especially close to the borders, one should use some additional measures such as e.g., calculation of the structures of their energy surfaces Frahm97 . For this reason we extracted wave function amplitudes $C^{(N,p)}_{nl}=\left<n,l|N,p\right>$ in the basis $n,l$ of a half- circular billiard with radius $r_{max}$, where $n=1,2,3\ldots$ enumerates the zeros of the Bessel functions and $l=1,2,3\ldots$ is the angular quantum number. The moduli of amplitudes $|C^{(N,p)}_{nl}|$ and their projections into the energy surface for the experimental wave functions $\psi_{460,0}(r,\theta)$, $\psi_{430,2}(r,\theta)$ and $\psi_{463,4}(r,\theta)$ are shown in Fig. 5(a-c). As expected, on the border of the regimes of Breit-Wigner and Shnirelman ergodicity the wave functions $\psi_{460,0}(r,\theta)$ ($N_{\bot}=65$) and $\psi_{430,2}(r,\theta)$ ($N_{\bot}=50$) are extended homogeneously over the whole energy surface Hlushchuk01 . The wave function $\psi_{463,4}(r,\theta)$, $N_{\bot}=16$, which lies closer to the localization boarder, is also extended along the energy surface, however it displays the tendency to localization in $n,l$ basis (see Fig. 5(c)). The full lines on the projection planes in Fig. 5(a-c) mark the energy surface of a half-circular billiard $H(n,l)=k^{2}_{N,p}$ estimated from the semiclassical formula Hlushchuk01b : $\sqrt{(l^{max}_{N})^{2}-l^{2}}-l\arctan(l^{-1}\sqrt{(l^{max}_{N})^{2}-l^{2}})+\pi/4=\pi n$. It is clearly visible that the peaks $|C^{(N,p)}_{nl}|$ are spread almost perfectly along the lines marking the energy surface. Figure 6: The number of nodal domains $\aleph_{N_{\bot}}$ (full circles) on the cross-section planes of the chaotic half-circular 3D microwave rough billiard. Full line shows the least squares fit $\aleph_{N_{\bot}}=a_{1}N_{\bot}+b_{1}\sqrt{N_{\bot}}$ to the experimental data (see text), where $a_{1}=0.059\pm 0.029$, $b_{1}=0.991\pm 0.190$. The prediction of the theory of Bogomolny and Schmit Bogomolny2002 $a_{1}=0.062$. The number of nodal domains $\aleph_{N_{\bot}}$ on the cross-sectional plane $z=0$ vs. the level number $N_{\bot}$ in the chaotic 3D microwave rough billiard is plotted in Fig. 6. The full line in Fig. 6 shows the least squares fit $\aleph_{N_{\bot}}=a_{1}N_{\bot}+b_{1}\sqrt{N_{\bot}}$ of the experimental data, where $a_{1}=0.059\pm 0.029$, $b_{1}=0.991\pm 0.190$. The coefficient $a_{1}=0.059\pm 0.029$ coincides with the prediction of the percolation model of Bogomolny and Schmit Bogomolny2002 $\aleph_{N_{\bot}}/N_{\bot}\simeq 0.062$ within the error limits. The relatively large uncertainty of the coefficient $a_{1}$ is connected with the fact that in the least squares fit procedure we used only 27 higher states with $N_{\bot}>20$. The states with lower $N_{\bot}$ were not taken into account because they were not fully chaotic (see Fig. 5(c)). The second term in the least squares fit corresponds to a contribution of boundary domains, i.e. domains, which include the billiard boundary. Numerical calculations of Blum et al. Blum2002 performed for the Sinai and stadium billiards showed that the number of boundary domains scales as the number of the boundary intersections, that is as $\sqrt{N_{\bot}}$. Our results clearly suggest that in the rough billiard, at the level numbers $20<N_{\bot}\leq 65$, the boundary domains also significantly influence the scaling of the number of nodal domains $\aleph_{N_{\bot}}$, leading to the departure from the predicted scaling $\aleph_{N_{\bot}}\sim N_{\bot}$. In summary, we measured the wave functions of the chaotic 3D rough microwave billiard with the translational symmetry up to the level number $N=489$. We showed that for the two-dimensional level numbers $20<N_{\bot}\leq 65$ the scaling of the number of nodal domains $\aleph_{N_{\bot}}$ significantly departures from the predicted scaling $\aleph_{N_{\bot}}\sim N_{\bot}$, which suggests that the boundary domains influence the scaling Bogomolny2002 . In the limit $N_{\bot}\rightarrow\infty$ the least squares fit of the experimental data yields the asymptotic number of nodal domains $\aleph_{N_{\bot}}/N_{\bot}\simeq a_{1}=0.059\pm 0.029$ that is close to the theoretical prediction $\aleph_{N_{\bot}}/N_{\bot}\simeq 0.062$. Finally, our results show that 3D microwave cavities with the translational symmetry can be effectively used beyond the standard 2D frequency limit in simulation of quantum systems. Acknowledgments. This work was partially supported by the Ministry of Education and Science grant No. N202 099 31/0746. ## References * (1) G. Blum, S. Gnutzmann, and U. Smilansky, Phys. Rev. Lett. 88, 114101-1 (2002). * (2) E. Bogomolny and C. Schmit, Phys. Rev. Lett. 88, 114102-1 (2002). * (3) N. Savytskyy, O. Hul, and L. Sirko, Phys. Rev. E 70, 056209 (2004). * (4) O. Hul, N. Savytskyy, O. Tymoshchuk, S. Bauch, and L. Sirko, Phys. Rev. E 72, 066212 (2005). * (5) O. Hul, N. Savytskyy, O. Tymoshchuk, S. Bauch, and L. Sirko, Acta Phys. Pol. A 109, 73 (2006). * (6) S. Deus, P.M. Koch, and L. Sirko, Phys. Rev. E 52, 1146 (1995). * (7) H. Alt, C. Dembowski, H.-D. Gräf, R. Hofferbert, H. Rehfeld, A. Richter, R. Schuhmann, and T. Weinland, Phys. Rev. Lett. 79,1026 (1997). * (8) U. Dörr, H.-J. Stöckmann, M. Barth, and U. Kuhl, Phys. Rev. Lett. 80, 1030 (1998). * (9) B. Eckhardt, U. Dörr, U. Kuhl, and H.-J. Stöckmann, Europhys. Lett. 46, 134 (1999). * (10) C. Dembowski, B. Dietz, H.-D. Gräf, A. Heine, T. Papenbrock, A. Richter, and C. Richter, Phys. Rev. Lett. 89, 064101 (2002). * (11) O. Tymoshchuk, N. Savytskyy, O. Hul, S. Bauch, and L. Sirko, Phys. Rev. E accepted for publication (2007). * (12) H. Primack and U. Smilansky, Phys. Rev. Lett. 74, 4831 (1995). * (13) T. Prosen, Phys. Lett. A 233, 323 (1997). * (14) L. R. Arnaut, Phys. Rev. E 73, 036604 (2006). * (15) Y.-H. Kim, U. Kuhl, H.-J. Stöckmann, and J. P. Bird, J. Phys.: Condens. Matter 17, L191 (2005). * (16) H.-J. Stöckmann, J. Stein, Phys. Rev. Lett. 64, 2215 (1990). * (17) R. Balian and C. Bloch, Ann. Phys. (N.Y.) 84, 559 (1974); Ann. Phys. (N.Y.) 64, 271(E) (1971). * (18) Y. Hlushchuk, A. Błȩdowski, N. Savytskyy, and L. Sirko, Physica Scripta 64, 192 (2001). * (19) Y. Hlushchuk, L. Sirko, U. Kuhl, M. Barth, H.-J. Stöckmann, Phys. Rev. E 63, 046208-1 (2001). * (20) K.M. Frahm and D.L. Shepelyansky, Phys. Rev. Lett. 78, 1440 (1997). * (21) K.M. Frahm and D.L. Shepelyansky, Phys. Rev. Lett. 79, 1833 (1997). * (22) N. Savytskyy and L. Sirko, Phys. Rev. E 65, 066202-1 (2002). * (23) L.C. Maier and J.C. Slater, J. Appl. Phys. 23, 68 (1952). * (24) S. Sridhar, Phys. Rev. Lett. 67, 785 (1991). * (25) C. Dembowski, H.-D. Gräf, A. Heine, R. Hofferbert, H. Rehfeld, and A. Richter, Phys. Rev. Lett. 84, 867 (2000). * (26) D.H. Wu, J.S.A. Bridgewater, A. Gokirmak, and S.M. Anlage, Phys. Rev. Lett. 81, 2890 (1998).
arxiv-papers
2009-03-17T11:02:14
2024-09-04T02:49:01.210948
{ "license": "Public Domain", "authors": "Nazar Savytskyy, Oleg Tymoshchuk, Oleh Hul, Szymon Bauch and Leszek\n Sirko", "submitter": "Oleh Hul", "url": "https://arxiv.org/abs/0903.2939" }
0903.3024
# A Vector Generalization of Costa’s Entropy-Power Inequality with Applications Ruoheng Liu, Tie Liu, H. Vincent Poor, and Shlomo Shamai (Shitz) This research was supported by the United States National Science Foundation under Grants CNS-06-25637 and CCF-07-28208, the European Commission in the framework of the FP7 Network of Excellence in Wireless Communications NEWCOM++, and the Israel Science Foundation. The material in this paper was presented in part at the New Result Session of the 2008 IEEE International Symposium on Information Theory, Toronto, Ontario, Canada, July 2008.Ruoheng Liu and H. Vincent Poor are with the Department of Electrical Engineering, Princeton University, Princeton, NJ 08544, USA. Email: {rliu,poor}@princeton.eduTie Liu is with the Department of Electrical and Computer Engineering, Texas A&M University, College Station, TX 77843, USA. Email: tieliu@tamu.eduShlomo Shamai (Shitz) is with the Department of Electrical Engineering, Technion-Israel Institute of Technology, Technion City, Haifa 32000, Israel. Email: sshlomo@ee.technion.ac.il ###### Abstract This paper considers an entropy-power inequality (EPI) of Costa and presents a natural vector generalization with a real positive semidefinite matrix parameter. This new inequality is proved using a perturbation approach via a fundamental relationship between the derivative of mutual information and the minimum mean-square error (MMSE) estimate in linear vector Gaussian channels. As an application, a new extremal entropy inequality is derived from the generalized Costa EPI and then used to establish the secrecy capacity regions of the degraded vector Gaussian broadcast channel with layered confidential messages. ###### Index Terms: Entropy-power inequality (EPI), extremal entropy inequality, information- theoretic security, mutual information and minimum mean-square error (MMSE) estimate, vector Gaussian broadcast channel ## I Introduction In information theory, the entropy-power inequality (EPI) of Shannon [1] and Stam [2] has played key roles in the solution of several canonical network communication problems. Celebrated examples include Bergmans’s solution [3] to the Gaussian broadcast channel problem, Leung-Yan-Cheong and Hellman’s solution [4] to the Gaussian wire-tap channel problem, Ozarow’s solution [5] to the Gaussian two-description problem, Oohama’s solution [6] to the quadratic Gaussian CEO problem, and more recently Weingarten, Steinberg and Shamai’s solution [7] to the multiple-input multiple-output Gaussian broadcast channel problem. Let $\mathbf{X}$ and $\mathbf{Z}$ be two independent random $n$-vectors with densities in ${\mathbb{R}}^{n}$, where ${\mathbb{R}}$ denotes the set of real numbers. The classical EPI of Shannon [1] and Stam [2] can be written as $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z})\right]\geq\exp\left[\frac{2}{n}h(\mathbf{X})\right]+\exp\left[\frac{2}{n}h(\mathbf{Z})\right]$ (1) where $h(\mathbf{X})$ denotes the differential entropy of $\mathbf{X}$. The equality holds if and only if $\mathbf{X}$ and $\mathbf{Z}$ are Gaussian and with proportional covariance matrices. In network information theory, most applications focus on the special case of (1) where one of the random vectors is fixed to be Gaussian. In this setting, the classical EPI of Shannon and Stam can be further strengthened as shown by Costa [8]. Let $\mathbf{Z}$ be a Gaussian random $n$-vector with a positive definite covariance matrix, and let $a$ be a real scalar such that $a\in[0,1]$. Costa’s EPI [8] can be written as $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\sqrt{a}\mathbf{Z})\right]$ $\displaystyle\geq(1-a)\exp\left[\frac{2}{n}h(\mathbf{X})\right]+a\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z})\right]$ (2) for any random $n$-vector $\mathbf{X}$ independent of $\mathbf{Z}$. The equality holds if and only if $\mathbf{X}$ is also Gaussian and with a covariance matrix proportional to that of $\mathbf{Z}$’s. Though not as widely known as the classical EPI of Shannon and Stam, Costa’s EPI has found useful applications in deriving capacity bounds for the Gaussian interference channel [9] and the multiantenna flat-fading channel [10]. The original proof of Costa’s EPI provided in [8] was based on rather detailed calculations. Simplified proofs based on a Fisher information inequality [11] and a fundamental relationship between the derivative of mutual information and minimum mean-square error (MMSE) in linear Gaussian channels [12] can be found in [13] and [14], respectively. Note that Costa’s EPI (2) provides a strong relationship among the differential entropies of three random vectors: $\mathbf{X}$, $\mathbf{X}+\sqrt{a}\mathbf{Z}$ and $\mathbf{X}+\mathbf{Z}$. To apply, the increments of $\mathbf{X}+\sqrt{a}\mathbf{Z}$ and $\mathbf{X}+\mathbf{Z}$ over $\mathbf{X}$ need to be Gaussian and have _proportional_ covariance matrices. For some applications in network information theory (as we will see shortly), the proportionality requirement may turn out to be overly restrictive. A main contribution of this paper is to prove a natural generalization of Costa’s EPI (2) by replacing the real scalar $a$ with a positive semidefinite _matrix_ parameter. The result is summarized in the following theorem. ###### Theorem 1 (Generalized Costa’s EPI) Let $\mathbf{Z}$ be a Gaussian random $n$-vector with a positive definite covariance matrix $\mathbf{N}$, and let $\mathbf{A}$ be an $n\times n$ real symmetric matrix such that $0\preceq\mathbf{A}\preceq\mathbf{I}$. Here, $\mathbf{I}$ denotes the $n\times n$ identity matrix, and “$\preceq$” denotes “less or equal to” in the positive semidefinite partial ordering between real symmetric matrices. Then, $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})\right]$ $\displaystyle\geq|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X})\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z})\right]$ (3) for any random $n$-vector $\mathbf{X}$ independent of $\mathbf{Z}$. The equality holds if $\mathbf{Z}$ is Gaussian and with a covariance matrix $\mathbf{B}$ such that $\mathbf{B}-\mathbf{A}\mathbf{B}$ and $\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}$ are proportional. Note that when $\mathbf{A}=a\mathbf{I}$, the generalized Costa EPI (3) reduces to the original Costa EPI (2). On the other hand, when $\mathbf{A}$ is not a scaled identity, the covariance matrices of increments of $\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z}$ and $\mathbf{X}+\mathbf{Z}$ over $\mathbf{X}$ do not need to be proportional. As we will see, the ability to cope with a _general_ matrix parameter makes the generalized Costa EPI more flexible and powerful than the original Costa EPI. A different but related generalization of Costa’s EPI was considered by Payaró and Palomar [15], where they examined the concavity of the entropy-power $\exp\left[\frac{2}{n}h(\mathbf{A}^{\frac{1}{2}}\mathbf{X}+\mathbf{Z})\right]$ with respect to the matrix parameter $\mathbf{A}$. This line of research was motivated by the observation that the original Costa EPI (2) is equivalent to the concavity of the entropy power $\exp\left[\frac{2}{n}h(\sqrt{a}\mathbf{X}+\mathbf{Z})\right]$ with respect to the scalar parameter $a$. Unlike the scalar case, Payaró and Palomar [15] showed that the entropy-power $\exp\left[\frac{2}{n}h(\mathbf{A}^{\frac{1}{2}}\mathbf{X}+\mathbf{Z})\right]$ is in general _not_ concave with respect to the matrix parameter $\mathbf{A}$. However, the concavity does hold when $\mathbf{A}$ is restricted to be _diagonal_ [15]. In information theory, a main application of the EPI is to derive extremal entropy inequalities, which can then be used to solve network communication problems. In their work [16], Liu and Viswanath derived an extremal entropy inequality based on the classical EPI of Shannon [1] and Stam [2] and used it to establish the private message capacity region of the vector Gaussian broadcast channel via the Marton outer bound [17, Theorem 5]. In this paper, we will derive a new extremal entropy inequality based on the generalized Costa EPI and use it to characterize the secrecy capacity regions of the degraded vector Gaussian broadcast channel with layered confidential messages. The rest of the paper is organized as follows. In Section II, we summarize the main results of the paper, including a new extremal entropy inequality and its applications on the degraded vector Gaussian broadcast channel with layered confidential messages. In Section III, we prove the generalized Costa EPI, following a perturbation approach via a fundamental relationship between the derivative of mutual information and MMSE estimate in linear vector Gaussian channels [18, Theorem 2]. In Section IV, we derive the new extremal entropy inequality from the generalized Costa EPI. The coding theorems for the degraded vector Gaussian broadcast channel with layered confidential messages are proved in Section V and Section VI. Finally, in Section VII, we conclude the paper with some remarks. ## II Summary of Main Results The following notation will be used throughout the paper. A random vector is denoted with an upper-case letter (e.g., $\mathbf{X}$), its realization is denoted with the corresponding lower-case letter (e.g., $\mathbf{x}$), and its probability density function is denoted with $p(\mathbf{x})=p_{\mathbf{X}}(\mathbf{x})$. We use ${\sf E}[\mathbf{X}]$ to denote the expectation of $\mathbf{X}$. Thus, the covariance matrix of $\mathbf{X}$ is given by $\displaystyle{\sf Cov}(\mathbf{X})={\sf E}\left[(\mathbf{X}-{\sf E}[\mathbf{X}])(\mathbf{X}-{\sf E}[\mathbf{X}])^{\textsf{T}}\right].$ Given any jointly distributed random vectors $(\mathbf{X},\mathbf{Y})$, the MMSE estimate of $\mathbf{X}$ from the observation $\mathbf{Y}$ is the conditional mean ${\sf E}[\mathbf{X}|\mathbf{Y}]$. The MMSE (matrix) is given by: $\displaystyle{\sf Cov}(\mathbf{X}|\mathbf{Y})={\sf E}\left[(\mathbf{X}-{\sf E}[\mathbf{X}|\mathbf{Y}])(\mathbf{X}-{\sf E}[\mathbf{X}|\mathbf{Y}])^{\textsf{T}}\right].$ ### II-A A New Extremal Entropy Inequality The following extremal entropy inequality is a consequence of the generalized Costa EPI. ###### Theorem 2 Let $\mathbf{Z}_{k}$, $k=0,\ldots,K$, be a total of $K+1$ Gaussian random $n$-vectors with positive definite covariance matrices $\mathbf{N}_{k}$, respectively. Assume that $\mathbf{N}_{1}\preceq\ldots\preceq\mathbf{N}_{K}$. If there exists an $n\times n$ positive semidefinite matrix $\mathbf{B}^{*}$ such that $\displaystyle\sum_{k=1}^{K}\mu_{k}(\mathbf{B}^{*}+\mathbf{N}_{k})^{-1}+\mathbf{M}_{1}=(\mathbf{B}^{*}+\mathbf{N}_{0})^{-1}+\mathbf{M}_{2}$ (4) for some $n\times n$ positive semidefinite matrices $\mathbf{M}_{1}$, $\mathbf{M}_{2}$ and $\mathbf{S}$ with $\displaystyle\mathbf{B}^{*}\mathbf{M}_{1}$ $\displaystyle=0$ (5) $\displaystyle\mbox{and}\quad\quad(\mathbf{S}-\mathbf{B}^{*})\mathbf{M}_{2}$ $\displaystyle=0$ (6) and real scalars $\mu_{k}\geq 0$ with $\sum_{k=1}^{K}\mu_{k}=1$, then $\displaystyle\sum_{k=1}^{K}\mu_{k}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\mathbf{Z}_{0}|U)$ $\displaystyle\leq\sum_{k=1}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{0}|$ (7) for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{0},\ldots,\mathbf{Z}_{K})$ such that ${\sf E}[\mathbf{X}\mathbf{X}^{\textsf{T}}]\preceq\mathbf{S}$. Note that (4)–(6) are precisely the Karush-Kuhn-Tucker (KKT) conditions (see [7, Appendix IV] and [19, Section 5.2]) for the optimization program: $\displaystyle\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left[\sum_{k=1}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}+\mathbf{N}_{0}|\right].$ Therefore, (7) implies that a jointly _Gaussian_ $(U,\mathbf{X})$ such that for each $U=u$, $\mathbf{X}$ has the _same_ covariance matrix is an optimal solution to the optimization program: $\displaystyle\max_{(U,\mathbf{X})}\left[\sum_{k=1}^{K}\mu_{k}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\mathbf{Z}_{0}|U)\right]$ where the maximization is over all $(U,\mathbf{X})$ independent of $(\mathbf{Z}_{0},\ldots,\mathbf{Z}_{K})$ such that ${\sf E}[\mathbf{X}\mathbf{X}^{\textsf{T}}]\preceq\mathbf{S}$. Note that when $K=1$, this is a special case of [16, Theorem 8] with $\mu=1$. ### II-B Applications on the Degraded Vector Gaussian Broadcast Channel with Layered Confidential Messages (a) Communication scenario 1 (b) Communication scenario 2 Figure 1: Degraded vector Gaussian broadcast channel with layered confidential messages Consider the following vector Gaussian broadcast channel with three receivers: $\displaystyle\mathbf{Y}_{k}[t]=\mathbf{X}[t]+\mathbf{Z}_{k}[t],\quad k=1,2,3$ (8) where $\\{\mathbf{Z}_{k}[t]\\}_{t}$, $k=1,2,3$, are independent and identically distributed additive vector Gaussian noise processes with zero means and positive definite covariance matrices $\mathbf{N}_{k}$, respectively. The channel input $\\{\mathbf{X}[t]\\}_{t}$ is subject to a matrix constraint: $\frac{1}{n}\sum_{t=1}^{n}\mathbf{X}[t]\mathbf{X}^{\textsf{T}}[t]\preceq\mathbf{S}$ (9) where $\mathbf{S}$ is a positive semidefinite matrix, and $n$ is the block length. We assume that the noise covariance matrices are ordered as $\mathbf{N}_{1}\preceq\mathbf{N}_{2}\preceq\mathbf{N}_{3},$ (10) i.e., the received signal $\mathbf{Y}_{3}[t]$ is (stochastically) degraded with respect to $\mathbf{Y}_{2}[t]$, which is further degraded with respect to $\mathbf{Y}_{1}[t]$. We consider two different communication scenarios, both with two independent messages $W_{1}$ and $W_{2}$. In the first scenario (see Fig. 1-(a)), message $W_{1}$ is intended for receiver 1 but needs to be kept secret from receivers 2 and 3, and message $W_{2}$ is intended for receivers 1 and 2 but needs to be kept confidential from receiver 3. In the second scenario (see Fig. 1-(b)), message $W_{1}$ is intended for receivers 1 but needs to be kept secret from receiver receiver 3, and message $W_{2}$ is intended for receivers 1 but needs to be kept secret from receiver 3. The confidentiality of the messages at the unintended receivers is measured using the normalized information-theoretic criteria [20, 21]: $\displaystyle\frac{1}{n}I(W_{1};\mathbf{Y}_{2}^{n})\rightarrow 0,\quad\frac{1}{n}I(W_{1};\mathbf{Y}_{3}^{n})\rightarrow 0,\quad\text{and}\quad\frac{1}{n}I(W_{2};\mathbf{Y}_{3}^{n})\rightarrow 0$ (11) for the first scenario and $\displaystyle\frac{1}{n}I(W_{1};\mathbf{Y}_{3}^{n})\rightarrow 0,\quad\text{and}\quad\frac{1}{n}I(W_{2};\mathbf{Y}_{3}^{n})\rightarrow 0$ (12) for the second scenario. Here, the limits are taken as the block length $n\rightarrow\infty$. The goal is to characterize the entire secrecy rate region $\mathcal{C}_{s}=\\{(R_{1},R_{2})\\}$ that can be achieved by any coding scheme. To characterize the secrecy capacity regions, we will first consider the discrete memoryless version of the problem with transition probability $p(y_{1},y_{2},y_{3}|x)$ and degradedness order $X\rightarrow Y_{1}\rightarrow Y_{2}\rightarrow Y_{3}.$ (13) We have the following single-letter characterizations of the secrecy capacity regions. ###### Theorem 3 The secrecy capacity region of the discrete memoryless broadcast channel $p(y_{1},y_{2},y_{3}|x)$ with confidential messages $W_{1}$ (intended for receiver 1 but needs to be kept secret from receivers 2 and 3) and $W_{2}$ (intended for receivers 1 and 2 but needs to be kept secret from receiver 3) under the degradedness order (13) is given by the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}\leq$ $\displaystyle\;I(X;Y_{1}|U)-I(X;Y_{2}|U)$ and $\displaystyle R_{2}\leq$ $\displaystyle\;I(U;Y_{2})-I(U;Y_{3})$ (14) for some jointly distributed $(U,X)$ satisfying the Markov relation $U\rightarrow X\rightarrow(Y_{1},Y_{2},Y_{3}).$ ###### Theorem 4 ([22, Theorem 2]) The secrecy capacity region of the discrete memoryless broadcast channel $p(y_{1},y_{2},y_{3}|x)$ with confidential messages $W_{1}$ (intended for receiver 1 but needs to be kept secret from receiver 3) and $W_{2}$ (intended for receivers 1 and 2 but needs to be kept secret from receiver 3) under the degradedness order (13) is given by the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}\leq$ $\displaystyle\;I(X;Y_{1}|U)-I(X;Y_{3}|U)$ and $\displaystyle R_{2}\leq$ $\displaystyle\;I(U;Y_{2})-I(U;Y_{3})$ (15) for some jointly distributed $(U,X)$ satisfying the Markov relation $U\rightarrow X\rightarrow(Y_{1},Y_{2},Y_{3}).$ A proof of Theorem 4 can be found in [22]. Theorem 3 can be proved in a similar fashion; for completeness, a proof is included in Appendix A. For the vector Gaussian broadcast channel (8) under the degradedness order (10), the single-letter expressions (14) and (15) can be further evaluated using the extremal entropy inequality (7). The results are summarized in the following theorems. ###### Theorem 5 The secrecy capacity region of the vector Gaussian broadcast channel (8) with confidential messages $W_{1}$ (intended for receiver 1 but needs to be kept secret from receivers 2 and 3) and $W_{2}$ (intended for receivers 1 and 2 but needs to be kept secret from receiver 3) and degradedness order (10) under the matrix constraint (9) is given by the set of nonnegative secrecy rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\;\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{2}}{\mathbf{N}_{2}}\right|$ and $\displaystyle R_{2}$ $\displaystyle\leq\;\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}+\mathbf{N}_{3}}\right|$ (16) for some $0\preceq\mathbf{B}\preceq\mathbf{S}$. ###### Theorem 6 The secrecy capacity region of the vector Gaussian broadcast channel (8) with confidential messages $W_{1}$ (intended for receiver 1 but needs to be kept secret from receiver 3) and $W_{2}$ (intended for receivers 1 and 2 but needs to be kept secret from receiver 3) and degradedness order (10) under the matrix constraint (9) is given by the set of nonnegative secrecy rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\;\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{3}}{\mathbf{N}_{3}}\right|$ and $\displaystyle R_{2}$ $\displaystyle\leq\;\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}+\mathbf{N}_{3}}\right|$ (17) for some $0\preceq\mathbf{B}\preceq\mathbf{S}$. ## III Proof of Theorem 1 In this section, we prove the generalized Costa EPI (3) as stated in Theorem 1. We first examine the equality condition. Note that when $\mathbf{X}$ is Gaussian, the generalized Costa EPI (3) becomes the matrix inequality: $\displaystyle|\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}|^{\frac{1}{n}}$ $\displaystyle\geq|\mathbf{B}-\mathbf{A}\mathbf{B}|^{\frac{1}{n}}+|\mathbf{A}\mathbf{B}+\mathbf{A}\mathbf{N}|^{\frac{1}{n}}.$ Suppose that $\mathbf{B}-\mathbf{A}\mathbf{B}$ and $\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}$ are proportional, i.e., there exists a real scalar $c$ such that $\displaystyle\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}=c(\mathbf{B}-\mathbf{A}\mathbf{B}).$ Since both matrices $\mathbf{A}$ and $\mathbf{B}$ are symmetric, this implies that $\mathbf{A}\mathbf{B}$ is also symmetric, i.e., $\mathbf{A}\mathbf{B}=\mathbf{B}^{\textsf{T}}\mathbf{A}^{\textsf{T}}=\mathbf{B}\mathbf{A}.$ Therefore, $\mathbf{A}$ and $\mathbf{B}$ must have the _same_ eigenvector matrix [23] and hence $\displaystyle\mathbf{A}\mathbf{B}$ $\displaystyle=\mathbf{A}^{\frac{1}{2}}\mathbf{B}\mathbf{A}^{\frac{1}{2}}.$ It follows that $\displaystyle\mathbf{A}^{\frac{1}{2}}\mathbf{B}\mathbf{A}^{\frac{1}{2}}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}$ $\displaystyle=\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}-(\mathbf{B}-\mathbf{A}\mathbf{B})$ $\displaystyle=(c-1)(\mathbf{B}-\mathbf{A}\mathbf{B})$ i.e., $\mathbf{A}^{\frac{1}{2}}\mathbf{B}\mathbf{A}^{\frac{1}{2}}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}$ and $\mathbf{B}-\mathbf{A}\mathbf{B}$ are proportional. Therefore, $\displaystyle|\mathbf{B}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}|^{\frac{1}{n}}$ $\displaystyle=|\mathbf{B}-\mathbf{A}\mathbf{B}+(\mathbf{A}^{\frac{1}{2}}\mathbf{B}\mathbf{A}^{\frac{1}{2}}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}})|^{\frac{1}{n}}$ $\displaystyle=|\mathbf{B}-\mathbf{A}\mathbf{B}|^{\frac{1}{n}}+|\mathbf{A}^{\frac{1}{2}}\mathbf{B}\mathbf{A}^{\frac{1}{2}}+\mathbf{A}^{\frac{1}{2}}\mathbf{N}\mathbf{A}^{\frac{1}{2}}|^{\frac{1}{n}}$ $\displaystyle=|\mathbf{B}-\mathbf{A}\mathbf{B}|^{\frac{1}{n}}+|\mathbf{A}\mathbf{B}+\mathbf{A}\mathbf{N}|^{\frac{1}{n}}.$ This proved the desired equality condition. We now turn to the proof of the inequality. First consider the special case when $|\mathbf{A}|=0$. Since $\displaystyle h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})-h(\mathbf{X})=I(\mathbf{A}^{\frac{1}{2}}\mathbf{Z};\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})\geq 0,$ we have $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})\right]$ $\displaystyle\geq\exp\left[\frac{2}{n}h(\mathbf{X})\right]$ $\displaystyle\geq|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X})\right]$ where the last inequality follows from the assumption that $0\preceq\mathbf{A}\preceq\mathbf{I}$ and hence $0\leq|\mathbf{I}-\mathbf{A}|\leq 1$. Next, consider the general case when $|\mathbf{A}|>0$. The proof is rather long so we divide it into several steps. _Step 1–Constructing a monotone path._ To prove the generalized Costa EPI (3), we can equivalently show that $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z})\right]$ $\displaystyle\leq|\mathbf{A}|^{-\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})\right]-\left(\frac{|\mathbf{I}-\mathbf{A}|}{|\mathbf{A}|}\right)^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X})\right].$ (18) Since $\mathbf{X}$ and $\mathbf{Z}$ are independent, we have $\displaystyle h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z})-h(\mathbf{X})$ $\displaystyle=h(\mathbf{A}^{-\frac{1}{2}}\mathbf{X}+\mathbf{Z})-h(\mathbf{A}^{-\frac{1}{2}}\mathbf{X})$ $\displaystyle=h(\mathbf{A}^{-\frac{1}{2}}\mathbf{X}+\mathbf{Z})-h(\mathbf{A}^{-\frac{1}{2}}\mathbf{X}|\mathbf{Z})$ $\displaystyle=I(\mathbf{Z};\mathbf{A}^{-\frac{1}{2}}\mathbf{X}+\mathbf{Z})$ (19) and $h(\mathbf{X}+\mathbf{Z})-h(\mathbf{X})=I(\mathbf{Z};\mathbf{X}+\mathbf{Z}).$ (20) Divide both sides of (18) by $\exp\left[\frac{2}{n}h(\mathbf{X})\right]$ and use (19) and (20). Then, (18) can be equivalently written as $\displaystyle\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{X}+\mathbf{Z})\right]$ $\displaystyle\leq|\mathbf{A}|^{-\frac{1}{n}}\left\\{\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{A}^{-\frac{1}{2}}\mathbf{X}+\mathbf{Z})\right]-|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\right\\}.$ (21) Let $\displaystyle F(\mathbf{D})$ $\displaystyle:=|\mathbf{D}|^{\frac{2}{n}}\Biggl{\\{}\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\Biggr{\\}}.$ (22) With this definition, (21) can be equivalently written as $\displaystyle F(\mathbf{I})\leq F(\mathbf{A}^{-\frac{1}{2}}).$ (23) To show the inequality (23), it is sufficient to construct a family of $n\times n$ positive definite matrices $\\{\mathbf{D}(\gamma)\\}_{\gamma}$ connecting $\mathbf{I}$ and $\mathbf{A}^{-\frac{1}{2}}$ such that $F(\mathbf{D}(\gamma))$ is monotone along the path. Unlike the scalar case where there is only one path connecting $1$ to $1/\sqrt{a}$, in the matrix case there are infinitely many paths connecting $\mathbf{I}$ and $\mathbf{A}^{-\frac{1}{2}}$. Here, we consider the special choice $\mathbf{D}(\gamma):=\left[\mathbf{I}+\gamma(\mathbf{A}^{-1}-\mathbf{I})\right]^{\frac{1}{2}}$ (24) and show that $\frac{\partial F}{\partial\gamma}\geq 0,\quad\forall\gamma\in[0,1].$ (25) along this particular path. _Step 2–Calculating the derivative $\frac{\partial F}{\partial\gamma}$._ Following [14, Theorem 5], we have $I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})=I(\mathbf{X};\mathbf{D}\mathbf{X}+\mathbf{Z})+h(\mathbf{Z})-h(\mathbf{X})-\log|\mathbf{D}|$ and ${\sf Cov}(\mathbf{X}|\mathbf{D}\mathbf{X}+\mathbf{Z})=\mathbf{D}^{-1}\,{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})\mathbf{D}^{-\textsf{T}}.$ Let $\mathbf{N}:={\sf Cov}(\mathbf{Z})$ and note that $\mathbf{D}$ is symmetric. We have $\displaystyle\frac{\partial}{\partial\mathbf{D}}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})$ $\displaystyle=\frac{\partial}{\partial\mathbf{D}}I(\mathbf{X};\mathbf{D}\mathbf{X}+\mathbf{Z})-\mathbf{D}^{-1}$ $\displaystyle=\mathbf{N}^{-1}\mathbf{D}\,{\sf Cov}(\mathbf{X}|\mathbf{D}\mathbf{X}+\mathbf{Z})-\mathbf{D}^{-1}$ $\displaystyle=\left(\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})-\mathbf{I}\right)\mathbf{D}^{-1}$ (26) where the second equality follows from the fundamental relationship between the derivative of mutual information and MMSE estimate in linear vector Gaussian channels as stated in [18, Theorem 2]. From (26), the derivative $\frac{\partial F}{\partial\mathbf{D}}$ can be calculated as $\displaystyle\frac{\partial F}{\partial\mathbf{D}}=$ $\displaystyle\frac{2}{n}|\mathbf{D}|^{\frac{2}{n}}\mathbf{D}^{-1}\Biggl{\\{}\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\Bigg{\\}}+$ $\displaystyle|\mathbf{D}|^{\frac{2}{n}}\Biggl{\\{}\frac{2}{n}\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]\frac{\partial I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})}{\partial\mathbf{D}}-\frac{2}{n}|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}(\mathbf{I}-\mathbf{D}^{-2})^{-1}\mathbf{D}^{-3}\Biggr{\\}}$ $\displaystyle=$ $\displaystyle\frac{2}{n}|\mathbf{D}|^{\frac{2}{n}}\Biggl{\\{}\left\\{\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\right\\}\mathbf{I}+$ $\displaystyle\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right](\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})-\mathbf{I})-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}(\mathbf{D}^{2}-\mathbf{I})^{-1}\Biggr{\\}}\mathbf{D}^{-1}$ $\displaystyle=$ $\displaystyle\frac{2}{n}|\mathbf{D}|^{\frac{2}{n}}\Biggl{\\{}\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\left[\mathbf{I}+(\mathbf{D}^{2}-\mathbf{I})^{-1}\right]\Biggr{\\}}\mathbf{D}^{-1}.$ (27) The derivative $\frac{\partial\mathbf{D}}{\partial\gamma}$ can be calculated as $\displaystyle\frac{\partial\mathbf{D}}{\partial\gamma}$ $\displaystyle=\frac{1}{2}\left[\mathbf{I}+\gamma(\mathbf{A}^{-1}-\mathbf{I})\right]^{-\frac{1}{2}}(\mathbf{A}^{-1}-\mathbf{I})$ $\displaystyle=\frac{1}{2\gamma}\mathbf{D}^{-1}(\mathbf{D}^{2}-\mathbf{I})$ $\displaystyle=\frac{1}{2\gamma}\mathbf{D}(\mathbf{I}-\mathbf{D}^{-2}).$ (28) By (27), (28) and the chain rule of differentiation [24, Chapter 17.5], $\displaystyle\frac{\partial F}{\partial\gamma}$ $\displaystyle={\sf Tr}\left\\{\frac{\partial F}{\partial\mathbf{D}}\,\frac{\partial\mathbf{D}}{\partial\gamma}\right\\}$ $\displaystyle=\frac{|\mathbf{D}|^{\frac{2}{n}}}{n}{\sf Tr}\Biggl{\\{}\left[\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\left[\mathbf{I}+(\mathbf{D}^{2}-\mathbf{I})^{-1}\right]\right]\frac{\mathbf{I}-\mathbf{D}^{-2}}{\gamma}\Biggr{\\}}$ $\displaystyle=\frac{|\mathbf{D}|^{\frac{2}{n}}}{n\gamma}{\sf Tr}\left\\{\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})(\mathbf{I}-\mathbf{D}^{-2})-|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\mathbf{I}\right\\}$ $\displaystyle=\frac{|\mathbf{D}|^{\frac{2}{n}}}{n\gamma}\left\\{\exp\left[\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]{\sf Tr}\left\\{\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})(\mathbf{I}-\mathbf{D}^{-2})\right\\}-n|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\right\\}.$ (29) _Step 3–Proving $\frac{\partial F}{\partial\gamma}\geq 0$._ The mutual information $I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})$ can be bounded from below as follows: $\displaystyle I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})$ $\displaystyle\geq I(\mathbf{Z};{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}])$ $\displaystyle=h(\mathbf{Z})-h(\mathbf{Z}|{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}])$ $\displaystyle=\frac{1}{2}\log(2\pi e)^{n}|\mathbf{N}|-h(\mathbf{Z}-{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}]|{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}])$ $\displaystyle\geq\frac{1}{2}\log(2\pi e)^{n}|\mathbf{N}|-h(\mathbf{Z}-{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}])$ $\displaystyle\geq\frac{1}{2}\log(2\pi e)^{n}|\mathbf{N}|-\frac{1}{2}\log(2\pi e)^{n}\bigl{|}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})\bigr{|}$ $\displaystyle=\frac{1}{2}\log\frac{|\mathbf{N}|}{|{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})|}.$ (30) Here, the first inequality follows from the Markov relation $\mathbf{Z}\rightarrow\mathbf{D}\mathbf{X}+\mathbf{Z}\rightarrow{\sf E}[\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z}]$ and the chain rule of mutual information [25, Chapter 2.8]; the second inequality follows from the fact that conditioning reduces differential entropy [25, Chapter 9.6]; and the third inequality follows from the well- known fact that Gaussian maximizes differential entropy for a given covariance matrix [25, Chapter 9.6]. By (30), $\displaystyle|\mathbf{I}-\mathbf{D}^{-2}|^{\frac{1}{n}}\exp\left[-\frac{2}{n}I(\mathbf{Z};\mathbf{D}\mathbf{X}+\mathbf{Z})\right]$ $\displaystyle\leq\;|\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})(\mathbf{I}-\mathbf{D}^{-2})|^{\frac{1}{n}}$ $\displaystyle\leq\;\frac{1}{n}{\sf Tr}\left\\{\mathbf{N}^{-1}{\sf Cov}(\mathbf{Z}|\mathbf{D}\mathbf{X}+\mathbf{Z})(\mathbf{I}-\mathbf{D}^{-2})\right\\}$ (31) where the last inequality follows from the well-known inequality of arithmetic and geometric means [26, p. 136]. Finally, substituting (31) into (29) establishes the fact that $\frac{\partial F}{\partial\gamma}\geq 0$ for all $\gamma\in[0,1]$. In particular, we have $F(\mathbf{D}(1))\geq F(\mathbf{D}(0))$. This proved the desired inequality (21) and hence the generalized Costa EPI (3). ## IV Proof of Theorem 2 In this section, we prove the extremal entropy inequality (7) as stated in Theorem 2. We will first state a series of corollaries of Theorem 1, as intermediate results leading to Theorem 2. Based on the final corollary, we will prove Theorem 2 using an _enhancement_ argument. ###### Corollary 1 Let $\mathbf{Z}$ be a Gaussian random $n$-vector with a positive definite covariance matrix, and let $\mathbf{A}$ be an $n\times n$ positive real symmetric matrix such that $0\preceq\mathbf{A}\preceq\mathbf{I}$. Then $\displaystyle\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z}|U)\right]$ $\displaystyle\geq|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}|U)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z}|U)\right]$ (32) for any $(\mathbf{X},U)$ independent of $\mathbf{Z}$. ###### Corollary 2 Let $\mathbf{Z}_{1}$, $\mathbf{Z}_{2}$ and $\mathbf{Z}_{3}$ be Gaussian random $n$-vectors with positive definite covariance matrices $\mathbf{N}_{1}$, $\mathbf{N}_{2}$ and $\mathbf{N}_{3}$, respectively. Assume that $\mathbf{N}_{1}\preceq\mathbf{N}_{3}$. If there exists an $n\times n$ positive semidefinite matrix $\mathbf{B}^{*}$ such that $\displaystyle(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+\mu(\mathbf{B}^{*}+\mathbf{N}_{3})^{-1}=(1+\mu)(\mathbf{B}^{*}+\mathbf{N}_{2})^{-1}$ (33) for some real scalar $\mu\geq 0$, then $\displaystyle h(\mathbf{X}+\mathbf{Z}_{1}|U)+\mu h$ $\displaystyle(\mathbf{X}+\mathbf{Z}_{3}|U)-(1+\mu)h(\mathbf{X}+\mathbf{Z}_{2}|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{1}|+\frac{\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{3}|-\frac{1+\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{2}|$ (34) for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{1},\mathbf{Z}_{2},\mathbf{Z}_{3})$. ###### Corollary 3 Let $\mathbf{Z}_{k}$, $k=0,\ldots,K$, be a collection of $K+1$ Gaussian random $n$-vectors with respective positive definite covariance matrices $\mathbf{N}_{k}$. Assume that $\mathbf{N}_{1}\preceq\ldots\preceq\mathbf{N}_{K}$. If there exists an $n\times n$ positive semidefinite matrix $\mathbf{B}^{*}$ such that $\displaystyle\sum_{k=1}^{K}\mu_{k}(\mathbf{B}^{*}+\mathbf{N}_{k})^{-1}=(\mathbf{B}^{*}+\mathbf{N}_{0})^{-1}$ (35) for some $\mu_{k}\geq 0$ with $\sum_{k=1}^{K}\mu_{k}=1$, then $\displaystyle\sum_{k=1}^{K}\mu_{k}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\mathbf{Z}_{0}|U)$ $\displaystyle\leq\sum_{k=1}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{0}|$ (36) for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{0},\ldots,\mathbf{Z}_{K})$. A proof of Corollaries 1, 2 and 3 can be found in Appendices B, C and D, respectively. We are now ready to prove Theorem 2. Note that the special case with $\mathbf{M}_{1}=\mathbf{M}_{2}=0$ was proved in Corollary 3. To extend the result of Corollary 3 to nonzero $\mathbf{M}_{1}$ and $\mathbf{M}_{2}$, we will consider an enhancement argument, which was first introduced by Weingarten, Steinberg and Shamai in [7]. Let $\widetilde{\mathbf{N}}_{1}$ and $\widetilde{\mathbf{N}}_{0}$ be $n\times n$ real symmetric matrices such that: $\displaystyle\mu_{1}(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1})^{-1}$ $\displaystyle=\mu_{1}(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+\mathbf{M}_{1}$ (37) $\displaystyle\mbox{and}\quad\quad(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0})^{-1}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{0})^{-1}+\mathbf{M}_{2}.$ (38) As shown in [7, Lemma 11 and 12], $\widetilde{\mathbf{N}}_{1}$ and $\widetilde{\mathbf{N}}_{0}$ satisfy the following properties: $\displaystyle 0\prec\widetilde{\mathbf{N}}_{1}$ $\displaystyle=\left(\mathbf{N}_{1}^{-1}+\mu_{1}^{-1}\mathbf{M}_{1}\right)^{-1}\preceq\mathbf{N}_{1},$ (39) $\displaystyle\widetilde{\mathbf{N}}_{1}$ $\displaystyle\preceq\widetilde{\mathbf{N}}_{0}\preceq\mathbf{N}_{0},$ (40) $\displaystyle\left|\frac{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1}}{\widetilde{\mathbf{N}}_{1}}\right|$ $\displaystyle=\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|$ (41) and $\displaystyle\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{0}}{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0}}\right|$ $\displaystyle=\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|.$ (42) Let $\widetilde{\mathbf{Z}}_{0}$ and $\widetilde{\mathbf{Z}}_{1}$ be two Gaussian $n$-vectors with covariance matrices $\widetilde{\mathbf{N}}_{0}$ and $\widetilde{\mathbf{N}}_{1}$, respectively. Note from (39) that $\widetilde{\mathbf{N}}_{1}\preceq\mathbf{N}_{1}\preceq\mathbf{N}_{2}\preceq\ldots\preceq\mathbf{N}_{K}$. Moreover, substitute (37) and (38) into (4) and we have $\displaystyle\mu_{1}(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1})^{-1}+\sum_{k=2}^{K}\mu_{k}(\mathbf{B}^{*}+\mathbf{N}_{k})^{-1}$ $\displaystyle=(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0})^{-1}.$ (43) Thus, by Corollary 3 $\displaystyle\mu_{1}h(\mathbf{X}+\widetilde{\mathbf{Z}}_{1}|U)+$ $\displaystyle\sum_{k=2}^{K}\mu_{k}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}|U)$ $\displaystyle\leq\frac{\mu_{1}}{2}(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1})^{-1}+\sum_{k=2}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0}|$ (44) for any $(\mathbf{X},U)$ independent of $(\widetilde{\mathbf{Z}}_{0},\widetilde{\mathbf{Z}}_{1},\mathbf{Z}_{2},\ldots,\mathbf{Z}_{K})$. On the other hand, note from (39) that $\widetilde{\mathbf{N}}_{1}\preceq\mathbf{N}_{1}$. We have $\displaystyle I(\mathbf{X};\mathbf{X}+\mathbf{Z}_{1}|U)\leq I(\mathbf{X};\mathbf{X}+\widetilde{\mathbf{Z}}_{1}|U)$ for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{1},\widetilde{\mathbf{Z}}_{1})$. Thus, $\displaystyle h(\mathbf{X}+\widetilde{\mathbf{Z}}_{1}|U)-h(\mathbf{X}+\mathbf{Z}_{1}|U)$ $\displaystyle\geq h(\widetilde{\mathbf{Z}}_{1})-h(\mathbf{Z}_{1})$ $\displaystyle=\frac{1}{2}\log\left|\frac{\widetilde{\mathbf{N}}_{1}}{\mathbf{N}_{1}}\right|$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1}}{\mathbf{B}^{*}+\mathbf{N}_{1}}\right|$ (45) where the last equality follows from (41). Also note from (40) that $\widetilde{\mathbf{N}}_{0}\preceq\mathbf{N}_{0}$. Let $\hat{\mathbf{Z}}_{0}$ be a Gaussian $n$-vector with covariance matrix $\mathbf{N}_{0}-\widetilde{\mathbf{N}}_{0}$ and independent of $(\widetilde{\mathbf{Z}}_{0},\mathbf{X},U)$. We have $\displaystyle h(\mathbf{X}+\mathbf{Z}_{0}|U)-h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}|U)$ $\displaystyle=h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}+\hat{\mathbf{Z}}_{0}|U)-h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}|U)$ $\displaystyle=I(\hat{\mathbf{Z}}_{0};\mathbf{X}+\widetilde{\mathbf{Z}}_{0}+\hat{\mathbf{Z}}_{0}|U)$ $\displaystyle\geq I(\hat{\mathbf{Z}}_{0};\mathbf{X}+\widetilde{\mathbf{Z}}_{0}+\hat{\mathbf{Z}}_{0})$ $\displaystyle\geq\frac{1}{2}\log\left|\frac{{\sf Cov}(\mathbf{X})+\mathbf{N}_{0}}{{\sf Cov}(\mathbf{X})+\widetilde{\mathbf{N}}_{0}}\right|$ $\displaystyle\geq\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{0}}{\mathbf{S}+\widetilde{\mathbf{N}}_{0}}\right|$ (46) $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{0}}{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0}}\right|$ (47) for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{0},\widetilde{\mathbf{Z}}_{0})$ such that ${\sf E}[\mathbf{X}\mathbf{X}^{\textsf{T}}]\preceq\mathbf{S}$. Here, the first inequality follows from the independence of $\hat{\mathbf{Z}}_{0}$ and $U$; the second inequality follows from the worst noise result [27, Lemma II.2]; the third inequality follows from the fact that $\widetilde{\mathbf{N}}_{0}\preceq\mathbf{N}_{0}$ and ${\sf Cov}(\mathbf{X})\preceq{\sf E}[\mathbf{X}\mathbf{X}^{\textsf{T}}]\preceq\mathbf{S}$; and the last inequality follows from (42). Finally, put together (44), (45) and (47) and we may obtain $\displaystyle\sum_{k=1}^{K}\mu_{k}$ $\displaystyle h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\mathbf{Z}_{0}|U)$ $\displaystyle=\left[\mu_{1}h(\mathbf{X}+\widetilde{\mathbf{Z}}_{1}|U)+\sum_{k=2}^{K}\mu_{k}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}|U)\right]-$ $\displaystyle\hskip 16.0pt\mu_{1}\left[h(\mathbf{X}+\widetilde{\mathbf{Z}}_{1}|U)-h(\mathbf{X}+\mathbf{Z}_{1}|U)\right]-\left[h(\mathbf{X}+\mathbf{Z}_{0}|U)-h(\mathbf{X}+\widetilde{\mathbf{Z}}_{0}|U)\right]$ $\displaystyle\leq\left[\frac{\mu_{1}}{2}(\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1})^{-1}+\sum_{k=2}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0}|\right]-$ $\displaystyle\hskip 16.0pt\frac{\mu_{1}}{2}\log\left|\frac{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{1}}{\mathbf{B}^{*}+\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{0}}{\mathbf{B}^{*}+\widetilde{\mathbf{N}}_{0}}\right|$ $\displaystyle=\sum_{k=1}^{K}\frac{\mu_{k}}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{0}|$ for any $(\mathbf{X},U)$ independent of $(\mathbf{Z}_{0},\mathbf{Z}_{1},\ldots,\mathbf{Z}_{K})$ such that ${\sf E}[\mathbf{X}\mathbf{X}^{\textsf{T}}]\preceq\mathbf{S}$. This completes the proof of Theorem 2. ## V Proof of Theorem 5 In this section, we prove Theorem 5. Note that the achievability of the secrecy rate region (16) can be obtained from the secrecy rate region (14) by letting $\mathbf{U}$ and $\mathbf{V}$ be two independent Gaussian vectors with zero means and covariance matrices $\mathbf{S}-\mathbf{B}$ and $\mathbf{B}$, respectively and $\mathbf{X}=\mathbf{U}+\mathbf{V}$. We therefore concentrate on the converse part of the theorem. To show that (16) is indeed the secrecy capacity region of the vector Gaussian broadcast channel (8), we will consider proof by contradiction. Assume that $(R_{1}^{o},R_{2}^{o})$ is an achievable secrecy rate pair that lies _outside_ the secrecy rate region (16). Note that $\mathbf{N}_{1}\preceq\mathbf{N}_{2}$. From [28, Theorem 1], we can bound $R_{1}^{o}$ by $\displaystyle R_{1}^{o}\leq\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{N}_{2}}\right|=R_{1}^{max}.$ Note that when $R_{2}^{o}=0$, $R_{1}^{max}$ is achievable by letting $\mathbf{B}=\mathbf{S}$ in (14). Thus, we may assume that $R_{2}^{o}>0$ and write $R_{1}^{o}=R_{1}^{*}+\delta$ for some $\delta>0$ where $R_{1}^{*}$ is given by $\displaystyle\max_{\mathbf{B}}$ $\displaystyle\quad\left[\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{2}}{\mathbf{N}_{2}}\right|\right]$ subject to: $\displaystyle\quad 0\preceq\mathbf{B}\preceq\mathbf{S}$ $\displaystyle\quad\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}+\mathbf{N}_{3}}\right|\geq R_{2}^{o}.$ Let $\mathbf{B}^{*}$ be an optimal solution to the above optimization program. Then, $\mathbf{B}^{*}$ must satisfy the following KKT conditions111As this optimization program is not convex, a set of constraint qualifications (CQs) should be checked to make sure that the KKT conditions indeed hold. The CQs stated in Appendix IV of [7] hold in a trivial manner for this program.: $\displaystyle(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+\mu(\mathbf{B}^{*}+\mathbf{N}_{3})^{-1}+\mathbf{M}_{1}$ $\displaystyle=(1+\mu)(\mathbf{B}^{*}+\mathbf{N}_{2})^{-1}+\mathbf{M}_{2}$ (48) $\displaystyle\mathbf{B}^{*}\mathbf{M}_{1}$ $\displaystyle=0$ (49) $\displaystyle\mbox{and}\quad\quad(\mathbf{S}-\mathbf{B}^{*})\mathbf{M}_{2}$ $\displaystyle=0$ (50) where $\mathbf{M}_{1}$ and $\mathbf{M}_{2}$ are $n\times n$ positive semidefinite matrices, and $\mu$ is a nonnegative real scalar such that $\mu>0$ if and only if $\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|=R_{2}^{o}.$ Thus, $\displaystyle R_{1}^{o}+\mu R_{2}^{o}=\left[\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{2}}{\mathbf{N}_{2}}\right|\right]+\mu\left[\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|\right]+\delta.$ (51) On the other hand, by the converse part of Theorem 3 $\displaystyle R_{1}^{o}+\mu R_{2}^{o}\leq\;$ $\displaystyle[I(\mathbf{X};\mathbf{X}+\mathbf{Z}_{1}|U)-I(\mathbf{X};\mathbf{X}+\mathbf{Z}_{2}|U)]+\mu[I(U;\mathbf{X}+\mathbf{Z}_{2})-I(U;\mathbf{X}+\mathbf{Z}_{3})]$ $\displaystyle=\;$ $\displaystyle[h(\mathbf{Z}_{2})-h(\mathbf{Z}_{1})]-\mu[h(\mathbf{X}+\mathbf{Z}_{3})-h(\mathbf{X}+\mathbf{Z}_{2})]+$ $\displaystyle[h(\mathbf{X}+\mathbf{Z}_{1}|U)+\mu h(\mathbf{X}+\mathbf{Z}_{3}|U)-(1+\mu)h(\mathbf{X}+\mathbf{Z}_{2}|U)]$ $\displaystyle=\;$ $\displaystyle\frac{1}{2}\log\left|\frac{\mathbf{N}_{2}}{\mathbf{N}_{1}}\right|-\mu[h(\mathbf{X}+\mathbf{Z}_{3})-h(\mathbf{X}+\mathbf{Z}_{2})]+$ $\displaystyle[h(\mathbf{X}+\mathbf{Z}_{1}|U)+\mu h(\mathbf{X}+\mathbf{Z}_{3}|U)-(1+\mu)h(\mathbf{X}+\mathbf{Z}_{2}|U)]$ (52) for some jointly distributed $(U,\mathbf{X})$ independent of $(\mathbf{Z}_{1},\mathbf{Z}_{2},\mathbf{Z}_{3})$. Note that $\mathbf{N}_{2}\preceq\mathbf{N}_{3}$. Similar to (46), we may obtain $\displaystyle h(\mathbf{X}+\mathbf{Z}_{3})-h(\mathbf{X}+\mathbf{Z}_{2})$ $\displaystyle\geq\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{S}+\mathbf{N}_{2}}\right|.$ (53) Moreover, by letting $\displaystyle\mu_{1}=\frac{1}{1+\mu},\quad\mu_{3}=\frac{\mu}{1+\mu},\quad\tilde{\mathbf{M}}_{1}=\frac{\mathbf{M}_{1}}{1+\mu},\quad\mbox{and}\;\;\tilde{\mathbf{M}}_{2}=\frac{\mathbf{M}_{2}}{1+\mu}$ we can rewrite the KKT conditions (48)–(50) as $\displaystyle\mu_{1}(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+\mu_{3}(\mathbf{B}^{*}+\mathbf{N}_{3})^{-1}+\tilde{\mathbf{M}}_{1}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{2})^{-1}+\tilde{\mathbf{M}}_{2}$ $\displaystyle\mathbf{B}^{*}\tilde{\mathbf{M}}_{1}$ $\displaystyle=0$ $\displaystyle\mbox{and}\quad\quad(\mathbf{S}-\mathbf{B}^{*})\tilde{\mathbf{M}}_{2}$ $\displaystyle=0.$ Thus, by Theorem 2 $\displaystyle h(\mathbf{X}+\mathbf{Z}_{1}|U)+\mu h$ $\displaystyle(\mathbf{X}+\mathbf{Z}_{3}|U)-(1+\mu)h(\mathbf{X}+\mathbf{Z}_{2}|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{1}|+\frac{\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{3}|-\frac{1+\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{2}|.$ (54) Substituting (53) and (54) into (52), we have $\displaystyle R_{1}^{o}+\mu R_{2}^{o}\leq$ $\displaystyle\;\frac{1}{2}\log\left|\frac{\mathbf{N}_{2}}{\mathbf{N}_{1}}\right|-\frac{\mu}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{S}+\mathbf{N}_{2}}\right|+$ $\displaystyle\;\left[\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{1}|+\frac{\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{3}|-\frac{1+\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{2}|\right]$ $\displaystyle=$ $\displaystyle\;\left[\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{2}}{\mathbf{N}_{2}}\right|\right]+\mu\left[\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|\right].$ (55) Thus, we have obtained a contradiction between (51) and (55). As a result, all the achievable rate pairs must be inside the secrecy rate region (16). This completes the proof of the theorem. ## VI Proof of Theorem 6 In this section, we prove Theorem 6 following similar steps as those used in the proof for Theorem 5. The achievability of the secrecy rate region (17) can be obtained from the secrecy rate region (15) by letting $\mathbf{U}$ and $\mathbf{V}$ be two independent Gaussian vectors with zero means and covariance matrices $\mathbf{S}-\mathbf{B}$ and $\mathbf{B}$, respectively and $\mathbf{X}=\mathbf{U}+\mathbf{V}$. We therefore concentrate on the converse part of the theorem. To show that (17) is indeed the secrecy capacity region of the vector Gaussian broadcast channel (8), we will use proof by contradiction. Assume that $(R_{1}^{o},R_{2}^{o})$ is an achievable secrecy rate pair that lies _outside_ the secrecy rate region (17). Note that $\mathbf{N}_{1}\preceq\mathbf{N}_{3}$. From [28, Theorem 1], we can bound $R_{1}^{o}$ by $\displaystyle R_{1}^{o}\leq\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{N}_{3}}\right|=R_{1}^{max}.$ Note that when $R_{2}^{o}=0$, $R_{1}^{max}$ is achievable by letting $\mathbf{B}=\mathbf{S}$ in (15). Thus, we may assume that $R_{2}^{o}>0$ and write $R_{1}^{o}=R_{1}^{*}+\delta$ for some $\delta>0$ where $R_{1}^{*}$ is given by $\displaystyle\max_{\mathbf{B}}$ $\displaystyle\quad\left[\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}+\mathbf{N}_{3}}{\mathbf{N}_{3}}\right|\right]$ subject to: $\displaystyle\quad 0\preceq\mathbf{B}\preceq\mathbf{S}$ $\displaystyle\quad\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}+\mathbf{N}_{3}}\right|\geq R_{2}^{o}.$ Let $\mathbf{B}^{*}$ be an optimal solution to the above optimization program. Then, $\mathbf{B}^{*}$ must satisfy the following KKT conditions: $\displaystyle(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+(\mu-1)(\mathbf{B}^{*}+\mathbf{N}_{3})^{-1}+\mathbf{M}_{1}$ $\displaystyle=\mu(\mathbf{B}^{*}+\mathbf{N}_{2})^{-1}+\mathbf{M}_{2}$ (56) $\displaystyle\mathbf{B}^{*}\mathbf{M}_{1}$ $\displaystyle=0$ (57) $\displaystyle\mbox{and}\quad\quad(\mathbf{S}-\mathbf{B}^{*})\mathbf{M}_{2}$ $\displaystyle=0$ (58) where $\mathbf{M}_{1}$ and $\mathbf{M}_{2}$ are $n\times n$ positive semidefinite matrices, and $\mu$ is a nonnegative real scalar such that $\mu\geq 1$.222If $\mu<1$, it is easy to see that $\mathbf{B}^{*}=\mathbf{S}$ is an optimal solution and hence contradicts the assumption that $R_{2}^{o}>0$. Therefore, $R_{2}^{o}=\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|$ and $\displaystyle R_{1}^{o}+\mu R_{2}^{o}=\left[\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{3}}{\mathbf{N}_{3}}\right|\right]+\mu\left[\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|\right]+\delta.$ (59) On the other hand, by the converse part of Theorem 4 $\displaystyle R_{1}^{o}+\mu R_{2}^{o}\leq\;$ $\displaystyle[I(\mathbf{X};\mathbf{X}+\mathbf{Z}_{1}|U)-I(\mathbf{X};\mathbf{X}+\mathbf{Z}_{3}|U)]+\mu[I(U;\mathbf{X}+\mathbf{Z}_{2})-I(U;\mathbf{X}+\mathbf{Z}_{3})]$ $\displaystyle=\;$ $\displaystyle[h(\mathbf{Z}_{3})-h(\mathbf{Z}_{1})]-\mu[h(\mathbf{X}+\mathbf{Z}_{3})-h(\mathbf{X}+\mathbf{Z}_{2})]+$ $\displaystyle[h(\mathbf{X}+\mathbf{Z}_{1}|U)+(\mu-1)h(\mathbf{X}+\mathbf{Z}_{3}|U)-\mu h(\mathbf{X}+\mathbf{Z}_{2}|U)]$ $\displaystyle\leq\;$ $\displaystyle\frac{1}{2}\log\left|\frac{\mathbf{N}_{3}}{\mathbf{N}_{1}}\right|-\frac{\mu}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{S}+\mathbf{N}_{2}}\right|+$ $\displaystyle[h(\mathbf{X}+\mathbf{Z}_{1}|U)+(\mu-1)h(\mathbf{X}+\mathbf{Z}_{3}|U)-\mu h(\mathbf{X}+\mathbf{Z}_{2}|U)]$ (60) for some jointly distributed $(U,\mathbf{X})$ independent of $(\mathbf{Z}_{1},\mathbf{Z}_{2},\mathbf{Z}_{3})$, where the last inequality follows from (53). Since $\mu\geq 1$, by letting $\displaystyle\mu_{1}=\frac{1}{\mu},\quad\mu_{3}=\frac{\mu-1}{\mu},\quad\tilde{\mathbf{M}}_{1}=\frac{\mathbf{M}_{1}}{\mu},\quad\mbox{and}\;\;\tilde{\mathbf{M}}_{2}=\frac{\mathbf{M}_{2}}{\mu}$ we can rewrite the KKT conditions (56)–(58) as $\displaystyle\mu_{1}(\mathbf{B}^{*}+\mathbf{N}_{1})^{-1}+\mu_{3}(\mathbf{B}^{*}+\mathbf{N}_{3})^{-1}+\tilde{\mathbf{M}}_{1}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{2})^{-1}+\tilde{\mathbf{M}}_{2}$ $\displaystyle\mathbf{B}^{*}\tilde{\mathbf{M}}_{1}$ $\displaystyle=0$ $\displaystyle\mbox{and}\quad\quad(\mathbf{S}-\mathbf{B}^{*})\tilde{\mathbf{M}}_{2}$ $\displaystyle=0.$ Thus, by Theorem 2 $\displaystyle h(\mathbf{X}+\mathbf{Z}_{1}|U)+(\mu-1)h$ $\displaystyle(\mathbf{X}+\mathbf{Z}_{3}|U)-\mu h(\mathbf{X}+\mathbf{Z}_{2}|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{1}|+\frac{1-\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{3}|-\frac{\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{2}|.$ (61) Substituting (54) into (60), we have $\displaystyle R_{1}^{o}+\mu R_{2}^{o}\leq$ $\displaystyle\;\frac{1}{2}\log\left|\frac{\mathbf{N}_{3}}{\mathbf{N}_{1}}\right|-\frac{\mu}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{S}+\mathbf{N}_{2}}\right|+$ $\displaystyle\;\left[\frac{1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{1}|+\frac{\mu-1}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{3}|-\frac{\mu}{2}\log|\mathbf{B}^{*}+\mathbf{N}_{2}|\right]$ $\displaystyle=$ $\displaystyle\;\left[\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{B}^{*}+\mathbf{N}_{3}}{\mathbf{N}_{3}}\right|\right]+\mu\left[\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{*}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{3}}{\mathbf{B}^{*}+\mathbf{N}_{3}}\right|\right].$ (62) Thus, we have obtained a contradiction between (59) and (62). As a result, all the achievable rate pairs must be inside the secrecy rate region (17). This completes the proof of the theorem. ## VII Conclusions This paper has considered an EPI of Costa and has established a natural generalization by replacing the scalar parameter in the original Costa EPI with a matrix one. The generalized Costa EPI has been proven using a perturbation approach via a fundamental relationship between the derivative of mutual information and the MMSE in linear vector Gaussian channels. This is an example of how the connections between information theory and statistics can be explored to provide new mathematical tools for information theory. As an application, a new extremal entropy inequality has been derived from the generalized Costa EPI and then used to characterize the secrecy capacity regions of the degraded vector Gaussian broadcast channel problem with layered confidential messages. We expect that the generalized Costa EPI will also play important roles in solving some other Gaussian network communication problems. ## Appendix A Proof of Theorem 3 ### A-A Achievability We first show that the secrecy rate region (14) is achievable. Following the idea of superposition coding for the degraded broadcast channel [3], we introduce an auxiliary codebook which can be distinguished by both receiver 1 and receiver 2. The codebook is generated using random binning [20, 21]. Fix $p(u)$ and $p(x|u)$ and let $\displaystyle R^{\prime}_{1}$ $\displaystyle=I(X;Y_{2}|U)-\epsilon_{1}$ (63a) and $\displaystyle R^{\prime}_{2}$ $\displaystyle=I(U;Y_{3})-\epsilon_{1}$ (63b) for some $\epsilon_{1}>0$. Let $\displaystyle L_{k}$ $\displaystyle=2^{nR_{k}},\quad J_{k}=2^{nR^{\prime}_{k}}\quad\text{and},\quad T_{k}=L_{k}J_{k}\quad k=1,2.$ Without loss of generality, $L_{k}$, $L^{\prime}_{k}$ and $J_{k}$ are assumed to be integers. #### Codebook generation Generate $T_{2}$ independent codewords $u^{n}$ of length $n$ according to $\prod_{i=1}^{n}p(u_{i})$ and label them as $u^{n}(w_{2},j_{2}),\quad w_{2}\in\\{1,\dots,L_{2}\\},\quad j_{2}\in\\{1,\dots,J_{2}\\}.$ For each codeword $u^{n}(w_{2},j_{2})$, generate $T_{1}$ independent codewords $x^{n}$ according to $\prod_{i=1}^{n}p(x_{i}|u_{i})$ and label them as $x^{n}(w_{1},j_{1},w_{2},j_{2})=x^{n}\bigl{(}w_{1},j_{1},u^{n}(w_{2},j_{2})\bigr{)},\quad w_{k}\in\\{1,\dots,L_{k}\\}\quad\mbox{and}\quad j_{k}\in\\{1,\dots,J_{k}\\}.$ #### Encoding To send a message pair $(w_{1},w_{2})$, the transmitter randomly chooses a pair $(j_{1},j_{2})$ and sends the corresponding codeword $x^{n}(w_{1},j_{1},w_{2},j_{2})$ through the channel. #### Decoding Receiver 2 determines the unique $w_{2}$ such that $\bigl{(}u^{n}(w_{2},j_{2}),y_{2}^{n}\bigr{)}\in\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{2}})$ where $\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{2}})$ denotes the set of jointly typical sequences $u^{n}$ and $y_{2}^{n}$ with respect to $p(u,y_{2})$. If there are none such or more than one such, an error is declared. Receiver 1 looks for the unique $(w_{1},w_{2})$ such that $\bigl{(}u^{n}(w_{2},j_{2}),x^{n}(w_{1},j_{1},w_{2},j_{2}),y_{1}^{n}\bigr{)}\in\mathcal{A}_{\epsilon}^{(n)}(p_{U,X,Y_{1}})$ where $\mathcal{A}_{\epsilon}^{(n)}(p_{U,X,Y_{1}})$ denotes the set of jointly typical sequences $u^{n}$, $x^{n}$ and $y_{1}^{n}$ with respect to $p(u,x,y_{1})$. Otherwise, an error is declared. #### Error probability analysis By the symmetry of the codebook generation, the probability error does not depend on which codeword was sent. Hence, without loss of generality, we may assume that the transmitter sends the message pair $(w_{1},w_{2})=(1,1)$ associated with the codeword $x^{n}(1,1,1,1)$ and define the corresponding event $\mathcal{K}_{1}:=\\{x^{n}(1,1,1,1)\;\text{was sent}\\}.$ First consider the decoding at receiver 2, for which we will show that receiver 2 is able to decode $u^{n}(w_{2},j_{2})$ with small probability of error if $R_{2}+R^{\prime}_{2}<I(U;Y_{2})$. To prove this, define the event $\displaystyle\mathcal{E}_{2}(w_{2},j_{2}):=\left\\{\bigl{(}u^{n}(w_{2},j_{2}),y_{2}^{n}\bigr{)}\in\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{2}})\right\\}.$ Then, the probability of error at receiver 2 can be bounded from above as $\displaystyle P^{(n)}_{e,2}$ $\displaystyle\leq\Pr\left\\{\bigcap_{j_{2}}\mathcal{E}_{2}^{c}(1,j_{2})\Big{|}\mathcal{K}_{1}\right\\}+\sum_{w_{2}\neq 1,\,j_{2}}\Pr\\{\mathcal{E}_{2}(w_{2},j_{2})|\mathcal{K}_{1}\\}$ $\displaystyle\leq\Pr\\{\mathcal{E}_{2}^{c}(1,1)|\mathcal{K}_{1}\\}+\sum_{w_{2}\neq 1,\,j_{2}}\Pr\\{\mathcal{E}_{2}(w_{2},j_{2})|\mathcal{K}_{1}\\}$ where $\mathcal{E}_{2}^{c}(1,j_{2}):=\left\\{\bigl{(}u^{n}(1,j_{2}),y_{2}^{n}\bigr{)}\notin\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{2}})\right\\}.$ For large enough $n$ and $R_{2}+R_{2}^{\prime}<I(U;Y_{2})$, the joint asymptotic equipartition property (AEP) [25, Chapter 14.2] implies $\displaystyle P_{e,2}^{(n)}$ $\displaystyle\leq\epsilon+T_{2}2^{-n[I(U;Y_{2})-\epsilon]}$ $\displaystyle=\epsilon+2^{n(R_{2}+R^{\prime}_{2})}\,2^{-n[I(U;Y_{2})-\epsilon]}$ $\displaystyle\leq 2\epsilon.$ (64) Next, we will show that receiver 1 can successfully decode both $u^{n}$ and $x^{n}$ if $\displaystyle R_{1}+R^{\prime}_{1}$ $\displaystyle<I(X;Y_{1}|U)$ and $\displaystyle R_{2}+R^{\prime}_{2}$ $\displaystyle<I(U;Y_{2}).$ (65) Define the events $\displaystyle\mathcal{E}_{1,1}(w_{1},j_{1},w_{2},j_{2})$ $\displaystyle:=\left\\{\bigl{(}u^{n}(w_{2},j_{2}),x^{n}(w_{1},j_{1},w_{2},j_{2}),y_{1}^{n}\bigr{)}\in\mathcal{A}_{\epsilon}^{(n)}(p_{U,X,Y_{1}})\right\\}.$ and $\displaystyle\mathcal{E}_{1}(w_{2},j_{2})$ $\displaystyle:=\left\\{\bigl{(}u^{n}(w_{2},j_{2}),y_{1}^{n}\bigr{)}\in\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{1}})\right\\}$ where $\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{1}})$ denotes the set of jointly typical sequences $u^{n}$ and $y_{1}^{n}$ with respect to $p(u,y_{1})$. Then, the probability of error $\displaystyle P^{(n)}_{e,1}$ $\displaystyle\leq\Pr\\{\mathcal{E}_{1}^{c}(1,1)|\mathcal{K}_{1}\\}+\sum_{w_{2}\neq 1,\,j_{2}}\Pr\\{\mathcal{E}_{1}(w_{2},j_{2})|\mathcal{K}_{1}\\}+\sum_{w_{1}\neq 1,j_{1},}\Pr\\{\mathcal{E}_{1,1}(w_{1},j_{1},1,1)|\mathcal{K}_{1}\\}$ where $\mathcal{E}_{1}^{c}(1,1):=\left\\{\bigl{(}u^{n}(1,1),y_{1}^{n}\bigr{)}\notin\mathcal{A}_{\epsilon}^{(n)}(p_{U,Y_{1}})\right\\}.$ By the AEP [25, Chapter 14.2], $\displaystyle\Pr\\{\mathcal{E}_{1}^{c}(1,1)|\mathcal{K}_{1}\\}$ $\displaystyle\leq\epsilon,$ $\displaystyle\Pr\\{\mathcal{E}_{1}(w_{2},j_{2})|\mathcal{K}_{1}\\}$ $\displaystyle\leq 2^{-n[I(U;Y_{1})-\epsilon]},\quad\text{for}~{}w_{2}\neq 1,$ and $\displaystyle\Pr\\{\mathcal{E}_{1,1}(w_{1},j_{1},1,1)|\mathcal{K}_{1}\\}$ $\displaystyle\leq 2^{-n[I(X;Y_{1}|U)-\epsilon]},\quad\text{for}~{}w_{1}\neq 1.$ Since the channel is degraded, we have $I(U;Y_{1})\geq I(U;Y_{2})$. Hence, if $n$ is large enough and the condition (65) holds, the probability of error at receiver 1 can be bounded from above as $\displaystyle P_{e,1}^{(n)}$ $\displaystyle\leq\epsilon+T_{2}2^{-n[I(U;Y_{1})-\epsilon]}+T_{1}2^{-n[I(X;Y_{1}|U)-\epsilon]}$ $\displaystyle\leq\epsilon+2^{n(R_{2}+R^{\prime}_{2})}2^{-n[I(U;Y_{2})-\epsilon]}+2^{n(R_{1}+R^{\prime}_{1})}2^{-n[I(X;Y_{1}|U)-\epsilon]}$ $\displaystyle\leq 3\epsilon.$ (66) Together, (64) and (66) illustrate that messages $(w_{1},w_{2})$ can be decoded at receiver 1 with a total probability of error that goes to $0$ as long as the rate pair $(R_{1},R_{2})$ satisfies (14). #### Equivocation calculation To show that (11) holds, we consider the following lower bound on the equivocation: $\displaystyle H(W_{1}|Y_{2}^{n})$ $\displaystyle\geq H(W_{1}|Y_{2}^{n},U^{n})$ $\displaystyle=H(W_{1},Y_{2}^{n}|U^{n})-H(Y_{2}^{n}|U^{n})$ $\displaystyle=H(X^{n},Y_{2}^{n}|U^{n})-H(X^{n}|W_{1},Y_{2}^{n},U^{n})-H(Y_{2}^{n}|U^{n})$ $\displaystyle=H(X^{n}|U^{n})+H(Y_{2}^{n}|X^{n},U^{n})-H(X^{n}|W_{1},Y_{2}^{n},U^{n})-H(Y_{2}^{n}|U^{n})$ $\displaystyle=H(X^{n}|U^{n})-H(X^{n}|W_{1},Y_{2}^{n},U^{n})-I(X^{n};Y_{2}^{n}|U^{n})$ (67) where the second equality is due to the fact that $W_{1}$ is independent of everything else given $X^{n}$. According to the codebook generation, for a given $U^{n}=u^{n}$, $X^{n}$ has $T_{1}$ possible values with equal probabilities. Hence, $\displaystyle H(X^{n}|U^{n})$ $\displaystyle=n(R_{1}+R^{\prime}_{1})$ $\displaystyle=n[R_{1}+I(X;Y_{2}|U)-\epsilon_{1}]$ (68) where (68) follows from the definition of $R^{\prime}_{1}$ in (63a). Next, we show that for any given $\epsilon_{2}>0$, $H(X^{n}|W_{1},Y_{2}^{n},U^{n})\leq n\epsilon_{2}$ for large enough $n$. To calculate $H(X^{n}|W_{1},Y_{2}^{n},U^{n})$, consider the following hypothetical scenario. Fix $W_{1}=w_{1}$, and assume that the transmitter sends a codeword $x^{n}\bigl{(}w_{1},j_{1},u^{n}(w_{2},j_{2})\bigr{)}$, $j_{1}\in\\{1,\dots,J_{1}\\}$. Assume that receiver 2 knows the sequence $U^{n}=u^{n}(w_{2},j_{2})$. Given index $W_{1}=w_{1}$, receiver 2 decodes the codeword $x^{n}(w_{1},j_{1},u^{n})$ (i.e., looks for the index $j_{1}$) based on the received sequence $y_{2}$. Let $\lambda(w_{1})$ denote the average probability of error of decoding the index $j_{1}$ at receiver 2. By the AEP [25, Chapter 14.2], we have $\lambda(w_{1})\leq\epsilon$ for sufficiently large $n$. By Fano’s inequality [25, Chapter 2.11], $\displaystyle\frac{1}{n}H(X^{n}|W_{1}=w_{1},Y_{2}^{n},U^{n})$ $\displaystyle\leq\frac{1}{n}+\lambda(w_{1})\frac{\log_{2}J_{1}}{n}$ $\displaystyle\leq\frac{1}{n}+\epsilon R^{\prime}_{1}$ $\displaystyle:=\epsilon_{2}.$ Consequently, $\displaystyle\frac{1}{n}H(X^{n}|W_{1},Y_{2}^{n},U^{n})$ $\displaystyle=\frac{1}{n}\sum_{w_{1}=1}^{L_{1}}\Pr(W_{1}=w_{1})H(X^{n}|W_{1}=w_{1},Y_{2}^{n},U^{n})$ $\displaystyle\leq\epsilon_{2}.$ (69) By the AEP [25, Chapter 14.2], for any $\epsilon_{3}$ $\displaystyle I(X^{n};Y_{2}^{n}|U^{n})\leq nI(X;Y_{2}|U)+n\epsilon_{3}$ (70) for sufficiently large $n$. Substituting (68), (69) and (70) into (67), we have $\displaystyle\frac{1}{n}H(W_{1}|Y_{2}^{n})$ $\displaystyle\geq R_{1}-(\epsilon_{1}+\epsilon_{2}+\epsilon_{3}).$ Similarly, we can show that $\displaystyle H(W_{2}|Y_{3}^{n})\geq H(U^{n})-H(U^{n}|W_{2},Y_{3}^{n})-I(U^{n};Y_{3}^{n})$ where $\displaystyle H(U^{n})=n[R_{2}+I(U;Y_{3})-\epsilon_{1}]$ $\displaystyle H(U^{n}|W_{2},Y_{3}^{n})\leq n\epsilon^{\prime}_{2}$ and $\displaystyle I(U^{n};Y_{3}^{n})\leq n[I(U;Y_{3})+\epsilon^{\prime}_{3}],$ where $\epsilon^{\prime}_{2}$ and $\epsilon^{\prime}_{3}$ vanishes in the limit as $n\rightarrow\infty$. Hence, $\displaystyle\frac{1}{n}H(W_{2}|Y_{3}^{n})\geq R_{2}-(\epsilon_{1}+\epsilon^{\prime}_{2}+\epsilon^{\prime}_{3}).$ Note that $Y_{3}$ is degraded with respect to $Y_{2}$. Therefore, $\displaystyle H(W_{1}|Y_{3}^{n})$ $\displaystyle\geq$ $\displaystyle H(W_{1}|Y_{2}^{n},Y_{3}^{n})$ $\displaystyle=$ $\displaystyle H(W_{1}|Y_{2}^{n})$ $\displaystyle\geq$ $\displaystyle R_{1}-(\epsilon_{1}+\epsilon_{2}+\epsilon_{3}).$ This proves the security condition (11) and hence the achievability part of the theorem. ### A-B The Converse We first bound from above the secrecy rate $R_{1}$. The perfect secrecy condition (11) implies that for all $\epsilon>0$, $\displaystyle H(W_{1}|Y_{2}^{n})$ $\displaystyle\geq H(W_{1})-n\epsilon$ (71a) and $\displaystyle H(W_{2}|Y_{3}^{n})$ $\displaystyle\geq H(W_{2})-n\epsilon.$ (71b) On the other hand, Fano’s inequality [25, Chapter 2.11] implies that for any $\epsilon_{0}>0$, $\displaystyle H(W_{1}|Y_{1}^{n})$ $\displaystyle\leq\epsilon_{0}\log\left(2^{nR_{1}}-1\right)+h(\epsilon_{0}):=n\delta_{1}$ (72a) and $\displaystyle H(W_{2}|Y_{2}^{n})$ $\displaystyle\leq\epsilon_{0}\log\left(2^{nR_{2}}-1\right)+h(\epsilon_{0}):=n\delta_{2}.$ (72b) Thus, $\displaystyle nR_{1}$ $\displaystyle=H(W_{1})$ $\displaystyle\leq\bigl{[}H(W_{1}|Y_{2}^{n})+n\epsilon\bigr{]}+\bigl{[}n\delta_{1}-H(W_{1}|Y_{1}^{n})\bigr{]}$ $\displaystyle\leq H(W_{1},W_{2}|Y_{2}^{n})-H(W_{1}|Y_{1}^{n},W_{2})+n(\epsilon+\delta_{1})$ $\displaystyle\leq H(W_{1}|Y_{2}^{n},W_{2})-H(W_{1}|Y_{1}^{n},W_{2})+n(\epsilon+\delta_{1}+\delta_{2})$ (73) where the first inequality follows from (71a) and (72a), and the last inequality follows from (72b). Let $\delta=\epsilon+\delta_{1}+\delta_{2}$. By the chain rule of the mutual information [25, Chapter 2.5], $\displaystyle n(R_{1}-\delta)$ $\displaystyle\leq I(W_{1};Y_{1}^{n}|W_{2})-I(W_{1};Y_{2}^{n}|W_{2})$ $\displaystyle=\sum_{i=1}^{n}\left[I(W_{1};Y_{1,i}|W_{2},Y_{1,i+1}^{n})-I(W_{1};Y_{2,i}|W_{2},Y_{2}^{i-1})\right]$ $\displaystyle=\sum_{i=1}^{n}\left[I(W_{1};Y_{1,i}|W_{2},Y_{1,i+1}^{n},Y_{2}^{i-1})-I(W_{1};Y_{2,i}|W_{2},Y_{1,i+1}^{n},Y_{2}^{i-1})\right]$ (74) where the last equality follows from [21, Lemma 7]. Let $\displaystyle V_{i}:=\left(Y_{1,i+1}^{n},Y_{2}^{i-1}\right).$ (75) We can further bound (74) from above as $\displaystyle n(R_{1}-\delta)$ $\displaystyle\leq\sum_{i=1}^{n}\left[I(W_{1},X_{i};Y_{1,i}|W_{2},V_{i})-I(W_{1},X_{i};Y_{2,i}|W_{2},V_{i})\right]$ $\displaystyle\qquad-\sum_{i=1}^{n}\left[I(X_{i};Y_{1,i}|W_{1},W_{2},V_{i})-I(X_{i};Y_{2,i}|W_{1},W_{2},V_{i})\right]$ $\displaystyle\leq\sum_{i=1}^{n}\left[I(W_{1},X_{i};Y_{1,i}|W_{2},V_{i})-I(W_{1},X_{i};Y_{2,i}|W_{2},V_{i})\right]$ $\displaystyle=\sum_{i=1}^{n}\left[I(X_{i};Y_{1,i}|W_{2},V_{i})-I(X_{i};Y_{2,i}|W_{2},V_{i})\right]$ (76) where the second inequality follows from the Markov relation $(W_{1},W_{2},V_{i})\rightarrow X_{i}\rightarrow Y_{1,i}\rightarrow Y_{2,i},$ and the last equality is due to the fact that $Y_{1,i}$ and $Y_{2,i}$ are conditionally independent of everything else given $X_{i}$. Next, we bound from above the secrecy rate $R_{2}$. By (71b) and (72b), $\displaystyle nR_{2}$ $\displaystyle=H(W_{2})$ $\displaystyle\leq\bigl{[}H(W_{2}|Y_{3}^{n})+n\epsilon\bigr{]}+\bigl{[}n\delta_{2}-H(W_{2}|Y_{2}^{n})\bigr{]}$ $\displaystyle=I(W_{2};Y_{2}^{n})-I(W_{2};Y_{3}^{n})+n(\epsilon+\delta_{2})$ $\displaystyle=\sum_{i=1}^{n}\left[I(W_{2};Y_{2,i}|Y_{2,i+1}^{n})-I(W_{2};Y_{3,i}|Y_{3}^{i-1})\right]+n(\epsilon+\delta_{2}).$ (77) Let $\delta^{\prime}:=\epsilon+\delta_{2}$ and $\displaystyle V^{\prime}_{i}$ $\displaystyle:=\left(Y_{2,i+1}^{n},Y_{3}^{i-1}\right).$ (78) Applying [21, Lemma 7] again, we may obtain $\displaystyle n(R_{2}-\delta^{\prime})$ $\displaystyle\leq\sum_{i=1}^{n}\left[I(W_{2};Y_{2,i}|V^{\prime}_{i})-I(W_{2};Y_{3,i}|V^{\prime}_{i})\right]$ $\displaystyle=\sum_{i=1}^{n}\left[I(W_{2},V^{\prime}_{i};Y_{2,i})-I(W_{2},V^{\prime}_{i};Y_{3,i})\right]-\sum_{i=1}^{n}\left[I(V^{\prime}_{i};Y_{2,i})-I(V^{\prime}_{i};Y_{3,i})\right]$ $\displaystyle\leq\sum_{i=1}^{n}\left[I(W_{2},V^{\prime}_{i};Y_{2,i})-I(W_{2},V^{\prime}_{i};Y_{3,i})\right]$ (79) where the last inequality follows from the Markov relation $V^{\prime}_{i}\rightarrow Y_{1,i}\rightarrow Y_{2,i}$. Furthermore, by the definitions of $V_{i}$ and $V_{i}^{\prime}$ in (75) and (78) respectively, $\displaystyle V^{\prime}_{i}\rightarrow(W_{2},V_{i})\rightarrow(Y_{2,i},Y_{3,i}).$ (80) By (79) and (80), $\displaystyle n(R_{2}-\delta^{\prime})$ $\displaystyle\leq\sum_{i=1}^{n}\left[I(W_{2},V^{\prime}_{i},V_{i};Y_{2,i})-I(W_{2},V^{\prime}_{i},V_{i};Y_{3,i})\right]-\sum_{i=1}^{n}\left[I(V_{i};Y_{2,i}|W_{2},V^{\prime}_{i})-I(V_{i};Y_{3,i}|W_{2},V^{\prime}_{i})\right]$ $\displaystyle=\sum_{i=1}^{n}\left[I(W_{2},V_{i};Y_{2,i})-I(W_{2},V_{i};Y_{3,i})\right]-\sum_{i=1}^{n}\left[I(V_{i};Y_{2,i}|W_{2},V^{\prime}_{i})-I(V_{i};Y_{3,i}|W_{2},V^{\prime}_{i})\right].$ (81) Note that $Y_{3,i}$ is conditionally independent of everything else given $Y_{2,i}$. Hence, $\displaystyle I(V_{i};Y_{3,i}|W_{2},V^{\prime}_{i})$ $\displaystyle\leq I(V_{i};Y_{2,i},Y_{3,i}|W_{2},V^{\prime}_{i})$ $\displaystyle=I(V_{i};Y_{2,i}|W_{2},V^{\prime}_{i})+I(V_{i};Y_{3,i}|Y_{2,i},W_{2},V^{\prime}_{i})$ $\displaystyle=I(V_{i};Y_{2,i}|W_{2},V^{\prime}_{i}).$ (82) Substituting (82) into (81), we have $\displaystyle R_{2}$ $\displaystyle\leq\frac{1}{n}\sum_{i=1}^{n}\left[I(W_{2},V_{i};Y_{2,i})-I(W_{2},V_{i};Y_{3,i})\right]+\delta^{\prime}.$ (83) Finally, let $\displaystyle U_{i}:=(W_{2},V_{i}).$ (84) With this definition, (76) and (83) can be rewritten as $\displaystyle R_{1}$ $\displaystyle\leq\frac{1}{n}\sum_{i=1}^{n}\left[I(X_{i};Y_{1,i}|U_{i})-I(X_{i};Y_{2,i}|U_{i})\right]+\delta.$ $\displaystyle\mbox{and}\quad\quad R_{2}$ $\displaystyle\leq\frac{1}{n}\sum_{i=1}^{n}\left[I(U_{i};Y_{2,i})-I(U_{i};Y_{3,i})\right]+\delta^{\prime}.$ (85) Following the standard single-letterization process (e.g., see [25, Chapter 14.3]), we have the desired converse result. ## Appendix B Proof of Corollary 1 Fix $U=u$. By the generalized Costa EPI (3), we have $\displaystyle h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z}|U=u)$ $\displaystyle\geq\frac{n}{2}\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}|U=u)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z}|U=u)\right]\right\\}.$ (86) Taking expectation over $U$ on both sides of (86), we may obtain $\displaystyle h(\mathbf{X}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z}|U)$ $\displaystyle\geq\frac{n}{2}{\sf E}\left[\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}|U=u)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z}|U=u)\right]\right\\}\right]$ $\displaystyle\geq\frac{n}{2}\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}{\sf E}\left[h(\mathbf{X}|U=u)\right]\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}{\sf E}\left[h(\mathbf{X}+\mathbf{Z}|U=u)\right]\right]\right\\}$ $\displaystyle=\frac{n}{2}\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}|U)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{X}+\mathbf{Z}|U)\right]\right\\}$ (87) where the second inequality follows from Jensen’s inequality [25, Chapter 2.6] and the convexity of $\log\left(a_{1}e^{x_{1}}+a_{2}e^{x_{2}}\right)$ in $(x_{1},x_{2})$ for $a_{1},a_{2}\geq 0$. Taking logarithm on both sides of (87) proves the desired inequality (32). ## Appendix C Proof of Corollary 2 Note that when $\mu=0$, (33) implies that $\mathbf{N}_{1}=\mathbf{N}_{2}$. Thus, both sides of (34) are equal to zero and the inequality holds trivially with an equality. For the rest of the proof, we will assume that $\mu>0$. The proof is rather long so we divide it into several steps. _Step 1–Generalized eigenvalue decomposition._ We start by applying generalized eigenvalue decomposition [23] to the positive define matrices $\mathbf{B}^{*}+\mathbf{N}_{1}$ and $\mathbf{B}^{*}+\mathbf{N}_{2}$. There exists an _invertible_ generalized eigenvector matrix $\mathbf{V}$ such that $\displaystyle\mathbf{V}^{\textsf{T}}(\mathbf{B}^{*}+\mathbf{N}_{1})\mathbf{V}=\mathbf{\Lambda}_{1}$ (88) and $\displaystyle\mathbf{V}^{\textsf{T}}(\mathbf{B}^{*}+\mathbf{N}_{2})\mathbf{V}=\mathbf{\Lambda}_{2}$ (89) where $\mathbf{\Lambda}_{1}$ and $\mathbf{\Lambda}_{2}$ are positive definite _diagonal_ matrices. Let $\displaystyle\mathbf{\Lambda}_{3}:=\mathbf{V}^{\textsf{T}}(\mathbf{B}^{*}+\mathbf{N}_{3})\mathbf{V}$ (90) be an $n\times n$ positive definite matrix. By (33), $\displaystyle\mathbf{\Lambda}_{1}^{-1}+\mu\mathbf{\Lambda}_{3}^{-1}=(1+\mu)\mathbf{\Lambda}_{2}^{-1}.$ (91) Thus, $\mathbf{\Lambda}_{3}$ is also diagonal. Moreover, since $\mathbf{N}_{1}\preceq\mathbf{N}_{3}$, $\displaystyle\mathbf{\Lambda}_{1}-\mathbf{\Lambda}_{3}=\mathbf{V}^{\textsf{T}}(\mathbf{N}_{1}-\mathbf{N}_{3})\mathbf{V}\preceq 0.$ and hence $\displaystyle\mathbf{\Lambda}_{1}\preceq\mathbf{\Lambda}_{3}.$ (92) _Step 2–Choosing matrix parameter $\mathbf{A}$._ Let $\tilde{\mathbf{\Lambda}}_{3}=\mathbf{\Lambda}_{3}+\epsilon\mathbf{I}$ for some $\epsilon>0$, and let $\tilde{\mathbf{\Lambda}}_{2}$ be an $n\times n$ matrix such that $\displaystyle\mathbf{\Lambda}_{1}^{-1}+\mu\tilde{\mathbf{\Lambda}}_{3}^{-1}=(1+\mu)\tilde{\mathbf{\Lambda}}_{2}^{-1}.$ (93) Clearly, $\tilde{\mathbf{\Lambda}}_{2}$ is diagonal. Moreover, by (92) $\displaystyle\mathbf{\Lambda}_{1}\prec\tilde{\mathbf{\Lambda}}_{3}.$ (94) Note that $\mu>0$ so by (93) and (94) $\displaystyle\mathbf{\Lambda}_{1}\prec\tilde{\mathbf{\Lambda}}_{2}\prec\tilde{\mathbf{\Lambda}}_{3}.$ (95) Comparing (91) and (93) and using the fact that $\mathbf{\Lambda}_{3}\prec\tilde{\mathbf{\Lambda}}_{3}$, we have $\displaystyle\mathbf{\Lambda}_{2}\prec\tilde{\mathbf{\Lambda}}_{2}.$ (96) Now let $\displaystyle\mathbf{Y}_{1}:=\mathbf{V}^{\textsf{T}}(\mathbf{X}+\mathbf{Z}_{1})$ $\displaystyle\mathbf{Y}_{2}:=\mathbf{V}^{\textsf{T}}(\mathbf{X}+\widetilde{\mathbf{Z}}_{2})$ and $\displaystyle\mathbf{Y}_{3}:=\mathbf{V}^{\textsf{T}}(\mathbf{X}+\widetilde{\mathbf{Z}}_{3})$ where $\widetilde{\mathbf{Z}}_{2}$ and $\widetilde{\mathbf{Z}}_{3}$ are Gaussian $n$-vectors with covariance matrices $\displaystyle\widetilde{\mathbf{N}}_{2}$ $\displaystyle=\mathbf{V}^{-\textsf{T}}\tilde{\mathbf{\Lambda}}_{2}\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle\succ\mathbf{V}^{-\textsf{T}}\mathbf{\Lambda}_{2}\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{2})-\mathbf{B}^{*}$ $\displaystyle=\mathbf{N}_{2}$ and $\displaystyle\widetilde{\mathbf{N}}_{3}$ $\displaystyle=\mathbf{V}^{-\textsf{T}}\tilde{\mathbf{\Lambda}}_{3}\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle=\mathbf{V}^{-\textsf{T}}(\mathbf{\Lambda}_{3}+\epsilon\mathbf{I})\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{3}+\epsilon\mathbf{V}^{-\textsf{T}}\mathbf{V}^{-1})-\mathbf{B}^{*}$ $\displaystyle=\mathbf{N}_{3}+\epsilon\mathbf{V}^{-\textsf{T}}\mathbf{V}^{-1}$ respectively and are independent of $\mathbf{X}$. The covariance matrices of $\mathbf{Y}_{k}$, $k=1,2,3$, can be calculated as $\mathbf{V}^{\textsf{T}}[{\sf Cov}(\mathbf{X})-\mathbf{B}^{*}]\mathbf{V}+\mathbf{\Lambda}_{1}$, $\mathbf{V}^{\textsf{T}}[{\sf Cov}(\mathbf{X})-\mathbf{B}^{*}]\mathbf{V}+\tilde{\mathbf{\Lambda}}_{2}$ and $\mathbf{V}^{\textsf{T}}[{\sf Cov}(\mathbf{X})-\mathbf{B}^{*}]\mathbf{V}+\tilde{\mathbf{\Lambda}}_{3}$, respectively. Thus, $\mathbf{Y}_{2}$ and $\mathbf{Y}_{3}$ can be equivalently written as $\displaystyle\mathbf{Y}_{3}=\mathbf{Y}_{1}+\mathbf{Z}$ and $\displaystyle\mathbf{Y}_{2}=\mathbf{Y}_{1}+\mathbf{A}^{\frac{1}{2}}\mathbf{Z}$ where $\mathbf{Z}$ is a Gaussian $n$-vector with covariance matrix $\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1}\succ 0$ and is independent of $\mathbf{Y}_{1}$, and $\displaystyle\mathbf{A}$ $\displaystyle:=(\tilde{\mathbf{\Lambda}}_{2}-\mathbf{\Lambda}_{1})(\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1})^{-1}.$ (97) Clearly, $\mathbf{A}$ is diagonal. Moreover, by (95) $0\prec\mathbf{A}\prec\mathbf{I}$. _Step 3–Applying generalized Costa’s EPI._ By the generalized Costa EPI (3), $\displaystyle h(\mathbf{Y}_{2}|U)\geq\frac{n}{2}\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{Y}_{1}|U)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{Y}_{3}|U)\right]\right\\}.$ Thus, $\displaystyle h($ $\displaystyle\mathbf{Y}_{1}|U)+\mu h(\mathbf{Y}_{3}|U)-(1+\mu)h(\mathbf{Y}_{2}|U)$ $\displaystyle\leq h(\mathbf{Y}_{1}|U)+\mu h(\mathbf{Y}_{3}|U)-\frac{(1+\mu)n}{2}\log\left\\{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{Y}_{1}|U)\right]+|\mathbf{A}|^{\frac{1}{n}}\exp\left[\frac{2}{n}h(\mathbf{Y}_{3}|U)\right]\right\\}.$ (98) Now we consider the function $\displaystyle f(b,c)=b+\mu c-\frac{(1+\mu)n}{2}\log\left[|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp\left(\frac{2b}{n}\right)+|\mathbf{A}|^{\frac{1}{n}}\exp\left(\frac{2c}{n}\right)\right].$ Note that $\displaystyle\nabla f(b,c)$ $\displaystyle=\left[\begin{matrix}\displaystyle{1-(1+\mu)\frac{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp(2b/n)}{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp(2b/n)+|\mathbf{A}|^{\frac{1}{n}}\exp(2c/n)}}\\\\[8.53581pt] \displaystyle{\mu-(1+\mu)\frac{|\mathbf{A}|^{\frac{1}{n}}\exp(2c/n)}{|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp(2b/n)+|\mathbf{A}|^{\frac{1}{n}}\exp(2c/n)}}\end{matrix}\right]$ and $\displaystyle\nabla^{2}f(b,c)=-\frac{2(1+\mu)}{n}\frac{|\mathbf{A}|^{\frac{1}{n}}|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp[(2b+2c)/n]}{\left[|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\exp(2b/n)+|\mathbf{A}|^{\frac{1}{n}}\exp(2c/n)\right]^{2}}\left[\begin{matrix}1&-1\\\ -1&1\end{matrix}\right]\preceq 0.$ So $f(b,c)$ is concave in $(b,c)$. By setting $\nabla f(b,c)=0$, the global maximum is achieved when $\displaystyle c=b+\frac{n}{2}\log\left[\mu\left(\frac{|\mathbf{I}-\mathbf{A}|}{|\mathbf{A}|}\right)^{\frac{1}{n}}\right]$ and the maximum is given by $\displaystyle\frac{\mu n}{2}\log\left[\mu\left(\frac{|\mathbf{I}-\mathbf{A}|}{|\mathbf{A}|}\right)^{\frac{1}{n}}\right]-\frac{(1+\mu)n}{2}\log\left[(1+\mu)|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\right].$ Hence, $\displaystyle h(\mathbf{Y}_{1}|U)+$ $\displaystyle\mu h(\mathbf{Y}_{3}|U)-(1+\mu)h(\mathbf{Y}_{2}|U)$ $\displaystyle\leq\frac{\mu n}{2}\log\left[\mu\left(\frac{|\mathbf{I}-\mathbf{A}|}{|\mathbf{A}|}\right)^{\frac{1}{n}}\right]-\frac{(1+\mu)n}{2}\log\left[(1+\mu)|\mathbf{I}-\mathbf{A}|^{\frac{1}{n}}\right].$ (99) _Step 4–Calculating $\log|\mathbf{A}|$ and $\log|\mathbf{I}-\mathbf{A}|$._ Note that (93) can be rewritten as $\displaystyle\mu(\mathbf{\Lambda}_{1}^{-1}-\tilde{\mathbf{\Lambda}}_{3}^{-1})=(1+\mu)(\mathbf{\Lambda}_{1}^{-1}-\tilde{\mathbf{\Lambda}}_{2}^{-1})$ which gives $\displaystyle\left|\frac{\tilde{\mathbf{\Lambda}}_{2}-\mathbf{\Lambda}_{1}}{\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1}}\right|$ $\displaystyle=\left(\frac{\mu}{1+\mu}\right)^{n}\left|\frac{\tilde{\mathbf{\Lambda}}_{2}}{\tilde{\mathbf{\Lambda}}_{3}}\right|.$ (100) Similarly, we have $\displaystyle(\mathbf{\Lambda}_{1}^{-1}-\tilde{\mathbf{\Lambda}}_{3}^{-1})=(1+\mu)(\tilde{\mathbf{\Lambda}}_{2}^{-1}-\tilde{\mathbf{\Lambda}}_{3}^{-1})$ and hence $\displaystyle\left|\frac{\tilde{\mathbf{\Lambda}}_{3}-\tilde{\mathbf{\Lambda}}_{2}}{\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1}}\right|$ $\displaystyle=\left(\frac{1}{1+\mu}\right)^{n}\left|\frac{\tilde{\mathbf{\Lambda}}_{2}}{\tilde{\mathbf{\Lambda}}_{1}}\right|.$ (101) According to the definition of $\mathbf{A}$ in (97), $\displaystyle\log|\mathbf{A}|$ $\displaystyle=\log\left|\frac{\tilde{\mathbf{\Lambda}}_{2}-\mathbf{\Lambda}_{1}}{\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1}}\right|$ $\displaystyle=\log\left[\left(\frac{\mu}{1+\mu}\right)^{n}\left|\frac{\tilde{\mathbf{\Lambda}}_{2}}{\tilde{\mathbf{\Lambda}}_{3}}\right|\right]$ (102) and $\displaystyle\log|\mathbf{I}-\mathbf{A}|$ $\displaystyle=\log\left|\frac{\tilde{\mathbf{\Lambda}}_{3}-\tilde{\mathbf{\Lambda}}_{2}}{\tilde{\mathbf{\Lambda}}_{3}-\mathbf{\Lambda}_{1}}\right|$ $\displaystyle=\log\left[\left(\frac{1}{1+\mu}\right)^{n}\left|\frac{\tilde{\mathbf{\Lambda}}_{2}}{\mathbf{\Lambda}_{1}}\right|\right]$ (103) where (102) and (103) follow (100) and (101), respectively. Substituting (102) and (103) into (99), we have $\displaystyle h(\mathbf{Y}_{1}|U)+\mu h(\mathbf{Y}_{3}|U)-(1+\mu)h(\mathbf{Y}_{2}|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{\Lambda}_{1}|+\frac{\mu}{2}\log|\tilde{\mathbf{\Lambda}}_{3}|-\frac{1+\mu}{2}\log|\tilde{\mathbf{\Lambda}}_{2}|.$ (104) _Step 5–Letting $\epsilon\downarrow 0$._ Note that $\tilde{\mathbf{\Lambda}}_{3}=\mathbf{\Lambda}_{3}+\epsilon\mathbf{I}\rightarrow\mathbf{\Lambda}_{3}$ and $\widetilde{\mathbf{N}}_{3}=\mathbf{N}_{3}+\epsilon\mathbf{V}^{-\textsf{T}}\mathbf{V}^{-1}\rightarrow\mathbf{N}_{3}$ in the limit as $\epsilon\downarrow 0$. Moreover, by (93) we have $\tilde{\mathbf{\Lambda}}_{2}\rightarrow\mathbf{\Lambda}_{2}$ and hence $\displaystyle\widetilde{\mathbf{N}}_{2}$ $\displaystyle=\mathbf{V}^{-\textsf{T}}\tilde{\mathbf{\Lambda}}_{2}\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle\rightarrow\mathbf{V}^{-\textsf{T}}\mathbf{\Lambda}_{2}\mathbf{V}^{-1}-\mathbf{B}^{*}$ $\displaystyle=(\mathbf{B}^{*}+\mathbf{N}_{2})-\mathbf{B}^{*}$ $\displaystyle=\mathbf{N}_{2}.$ Letting $\epsilon\downarrow 0$ on both sides of (104), we have $\displaystyle h(\mathbf{V}^{\textsf{T}}(\mathbf{X}+\mathbf{N}_{1})|U)+\mu h(\mathbf{V}^{\textsf{T}}(\mathbf{X}+\mathbf{N}_{3})|U)-$ $\displaystyle(1+\mu)h(\mathbf{V}^{\textsf{T}}(\mathbf{X}+\mathbf{N}_{2})|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{\Lambda}_{1}|+\frac{\mu}{2}\log|\mathbf{\Lambda}_{3}|-\frac{1+\mu}{2}\log|\mathbf{\Lambda}_{2}|.$ (105) Using the fact that $\displaystyle h(\mathbf{V}^{\textsf{T}}(\mathbf{X}+\mathbf{N}_{1})|U)=h(\mathbf{X}+\mathbf{N}_{1}|U)+\log|\mathbf{V}|$ and $\displaystyle\log|\mathbf{\Lambda}_{k}|$ $\displaystyle=\log|\mathbf{V}^{\textsf{T}}(\mathbf{B}^{*}+\mathbf{N}_{k})\mathbf{V}|$ $\displaystyle=\log|\mathbf{B}^{*}+\mathbf{N}_{k}|+2\log|\mathbf{V}|$ for $k=1,2,3$, the desired inequality (34) can be obtained from (105). This completes the proof of the corollary. ## Appendix D Proof of Corollary 3 Here, we prove Corollary 3 using mathematical induction. Note that when $K=1$, (35) implies that $\mathbf{N}_{1}=\mathbf{N}_{0}$. Thus, the inequality (36) holds trivially with equality for any $(U,\mathbf{X})$ independent of $(\mathbf{Z}_{0},\mathbf{Z}_{1})$. Assume that the inequality (36) holds for $K=Q-1$. Let $\mathbf{N}$ be an $n\times n$ symmetric matrix such that $\displaystyle(\mathbf{B}^{*}+\mathbf{N})^{-1}=\sum_{k=1}^{Q-1}\mu_{k}^{\prime}(\mathbf{B}^{*}+\mathbf{N}_{k})^{-1}$ (106) where $\displaystyle\mu_{k}^{\prime}:=\frac{\mu_{k}}{\sum_{j=1}^{Q-1}\mu_{j}},\quad j=1,\ldots,Q.$ By the assumption $\mathbf{N}_{1}\preceq\ldots\preceq\mathbf{N}_{Q-1}$, we have from (106) $\displaystyle\mathbf{N}_{1}\preceq\mathbf{N}\preceq\mathbf{N}_{Q-1}.$ (107) Let $\mathbf{Z}$ be a Gaussian random $n$-vector with covariance matrix $\mathbf{N}$ and independent of $(U,\mathbf{X})$. By the induction assumption and (106), $\displaystyle\sum_{k=1}^{Q-1}\mu_{k}^{\prime}h(\mathbf{X}+\mathbf{Z}_{k}|U)-h(\mathbf{X}+\mathbf{Z}|U)$ $\displaystyle\leq\sum_{k=1}^{Q-1}\frac{\mu_{k}^{\prime}}{2}\log|\mathbf{B}+\mathbf{N}_{k}|-\frac{1}{2}\log|\mathbf{B}+\mathbf{N}|.$ (108) On the other hand, substitute (106) into (35) and we have $\displaystyle(\mathbf{B}+\mathbf{N})^{-1}+\mu_{Q}^{\prime}(\mathbf{B}+\mathbf{N}_{Q})^{-1}=(1+\mu_{Q}^{\prime})(\mathbf{B}+\mathbf{N}_{0})^{-1}.$ Note from (107) that $\mathbf{N}\preceq\mathbf{N}_{Q-1}\preceq\mathbf{N}_{Q}$. Thus, by Corollary 2 $\displaystyle h(\mathbf{X}+\mathbf{Z}|U)+\mu_{Q}^{\prime}h$ $\displaystyle(\mathbf{X}+\mathbf{Z}_{Q}|U)-(1+\mu_{Q}^{\prime})h(\mathbf{X}+\mathbf{Z}_{0}|U)$ $\displaystyle\leq\frac{1}{2}\log|\mathbf{B}+\mathbf{N}|+\frac{\mu_{Q}^{\prime}}{2}\log|\mathbf{B}+\mathbf{N}_{Q}|-\frac{1+\mu_{Q}^{\prime}}{2}\log|\mathbf{B}+\mathbf{N}_{0}|.$ (109) Putting together (108) and (109), we have $\displaystyle\sum_{j=1}^{Q}\mu_{j}h(\mathbf{X}+\mathbf{Z}_{j}|U)-h(\mathbf{X}+\mathbf{Z}_{0}|U)$ $\displaystyle\leq\sum_{j=1}^{Q}\frac{\mu_{j}}{2}\log|\mathbf{B}+\mathbf{N}_{j}|-\frac{1}{2}\log|\mathbf{B}+\mathbf{N}_{0}|.$ This proved the induction step and hence the corollary. ## References * [1] C. E. Shannon, “A mathematical theory of communication,” _Bell Syst. Tech. J._ , vol. 27, pp. 379–423 and 623–656, Jul. and Oct. 1948. * [2] A. J. Stam, “Some inequalities satisfied by the quantities of information of Fisher and Shannon,” _Inform. Control_ , vol. 2, pp. 101–112, Jun. 1959\. * [3] P. P. Bergmans, “Random coding theorem for broadcast channels with degraded components,” _IEEE Trans. Inf. Theory_ , vol. 19, pp. 197–207, Mar. 1973\. * [4] S. K. Leung-Yan-Cheong and M. E. Hellman, “The Gaussian wire-tap channel,” _IEEE Trans. Inf. Theory_ , vol. 24, no. 4, pp. 51–456, Jul. 1978. * [5] L. Ozarow, “On a source coding problem with two channels and three receivers,” _Bell Syst. Tech. J._ , vol. 59, no. 10, pp. 1909–1921, Dec. 1980. * [6] Y. Oohama, “The rate-distortion function for the quadratic Gaussian CEO problem,” _IEEE Trans. Inf. Theory_ , vol. 44, no. 3, pp. 1057–1070, May 1998. * [7] H. Weingarten, Y. Steinberg, and S. Shamai (Shitz), “The capacity region of the Gaussian multiple-input multiple-output broadcast channel,” _IEEE Trans. Inf. Theory_ , vol. 52, pp. 3936–3964, Sep. 2006. * [8] M. H. M. Costa, “A new entropy power inequality,” _IEEE Trans. Inf. Theory_ , vol. 31, pp. 751–760, Nov. 1985. * [9] ——, “On the Gaussian interference channel,” _IEEE Trans. Inf. Theory_ , vol. 31, pp. 607–615, Sep. 1985. * [10] A. Lapidoth and S. M. Moser, “Capacity bounds via duality with applications to multiple-antenna systems on flat-fading channels,” _IEEE Trans. Inf. Theory_ , vol. 49, pp. 2426–2467, Oct. 2003. * [11] A. Dembo, T. M. Cover, and J. A. Thomas, “Information theoretic inequalities,” _IEEE Trans. Inf. Theory_ , vol. 37, pp. 1501–1518, Nov. 1991\. * [12] D. Guo, S. Shamai (Shitz), and S. Verdú, “Mutual information and minimum mean-square error in Gaussian channels,” _IEEE Trans. Inf. Theory_ , vol. 51, no. 4, pp. 1261–1282, Apr. 2005. * [13] A. Dembo, “Simple proof on the concavity of the entropy power with respect to added Gaussian noise,” _IEEE Trans. Inf. Theory_ , vol. 35, pp. 887–888, Jul. 1989. * [14] D. Guo, S. Shamai (Shitz), and S. Verdú, “Proof of entropy power inequalities via MMSE,” in _Proc. IEEE Int. Symp. Information Theory_ , Seattle, WA, July 9-14, 2006. * [15] M. Payaró and D. P. Palomar, “Hessian matrix and concavity properties of mutual information and entropy in linear vector Gaussian channels,” _IEEE Trans. Inf. Theory_ , submitted for publication. * [16] T. Liu and P. Viswanath, “An extremal inequality motivated by multiterminal information-theoretic problems,” _IEEE Trans. Inf. Theory_ , vol. 53, pp. 1839–1851, May 2007. * [17] K. Marton, “A coding theorem for the discrete memoryless broadcast channel,” _IEEE Trans. Inf. Theory_ , vol. 25, pp. 306–311, May 1979. * [18] D. P. Palomar and S. Verdú, “Gradient of mutual information in linear vector Gaussian channels,” _IEEE Trans. Inf. Theory_ , vol. 52, pp. 141–154, Jan. 2006. * [19] D. P. Bertsekas, A. Nedic, and A. E. Ozdaglar, _Convex Analysis and Optimization_. Belmont, MA: Athena Scientific, 2003. * [20] A. D. Wyner, “The wire-tap channel,” _Bell Syst. Tech. J._ , vol. 54, no. 8, pp. 1355–1387, Oct. 1975. * [21] I. Csiszár and J. Körner, “Broadcast channels with confidential messages,” _IEEE Trans. Inf. Theory_ , vol. 24, no. 3, pp. 339–348, May 1978\. * [22] G. Bagherikaram, A. S. Motahari, and A. K. Khandani, “Secure broadcasting: The secrecy rate region,” _IEEE Trans. Inf. Theory_ , submitted, Dec. 2008. * [23] G. Strang, _Linear Algebra and Its Applications_. Wellesley, MA: Wellesley-Cambridge Press, 1998. * [24] G. A. F. Seber, _A Matrix Handbook for Statisticians_. New York: John Wiley & Sons, Inc., 2008. * [25] T. Cover and J. Thomas, _Elements of Information Theory_. New York: John Wiley & Sons, Inc., 1991. * [26] I. M. Gel’fand and A. Shen, _Algebra_ , 3rd ed. Basel, Switzerland: Birkhauser Verlag, 1993. * [27] S. N. Diggavi and T. M. Cover, “The worst additive noise under a covariance constraint,” _IEEE Trans. Inf. Theory_ , vol. 47, pp. 3072–3081, Nov. 2001\. * [28] T. Liu and S. Shamai (Shitz), “A note on the secrecy capacity of the multiantenna wiretap channel,” _IEEE Trans. Inf. Theory_ , to appear.
arxiv-papers
2009-03-17T19:05:55
2024-09-04T02:49:01.219248
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Ruoheng Liu, Tie Liu, H. Vincent Poor and Shlomo Shamai (Shitz)", "submitter": "Ruoheng Liu", "url": "https://arxiv.org/abs/0903.3024" }
0903.3119
11institutetext: Department of Astronomy, Nanjing University, Nanjing 210093, China # On the afterglow from the receding jet of gamma-ray burst Xin Wang Y. F. Huang hyf@nju.edu.cn S. W. Kong (Received month day 2009 / Accepted month day 2009) According to popular progenitor models of gamma-ray bursts, twin jets should be launched by the central engine, with a forward jet moving toward the observer and a receding jet (or the counter jet) moving backwardly. However, in calculating the afterglows, usually only the emission from the forward jet is considered. Here we present a detailed numerical study on the afterglow from the receding jet. Our calculation is based on a generic dynamical description, and includes some delicate ingredients such as the effect of the equal arrival time surface. It is found that the emission from the receding jet is generally rather weak. In radio bands, it usually peaks at a time of $t\geq 1000$ d, with the peak flux nearly 4 orders of magnitude lower than the peak flux of the forward jet. Also, it usually manifests as a short plateau in the total afterglow light curve, but not as an obvious rebrightening as once expected. In optical bands, the contribution from the receding jet is even weaker, with the peak flux being $\sim 23$ magnitudes lower than the peak flux of the forward jet. We thus argue that the emission from the receding jet is very difficult to detect. However, in some special cases, i.e., when the circum-burst medium density is very high, or if the parameters of the receding jet is quite different from those of the forward jet, the emission from the receding jet can be significantly enhanced and may still emerge as a marked rebrightening. We suggest that the search for receding jet emission should mostly concentrate on nearby gamma-ray bursts, and the observation campaign should last for at least several hundred days for each event. ###### Key Words.: gamma rays: bursts — ISM: jets and outflows — stars: neutron ## 1 Introduction Thanks to the discovery of X-ray, optical and radio afterglows of gamma-ray bursts (GRBs), it is now clear that most GRBs are situated at cosmological distances (Costa et al. 1997; van Paradijs et al. 1997; Frail et al. 1997). A lot of progresses have been achieved during the past decade (Piran 2004; Mészáros 2006). Especially, through the detection of GRB 030329, the association of long GRBs with supernovae is firmly established (Hjorth et al. 2003), which strongly supports the collapsar model as the energy mechanism for long GRBs (Woosley 1993; MacFadyen & Woosley 1999). Theoretically, the collapse of a massive star will most likely give birth to a black hole, surrounded by a temporal accretion disk. It is a common sense that the accretion system will produce double-sided jets (MacFadyen & Woosley 1999; Aloy et al. 2000; Rhoads 1999; Mészáros 2002). The GRB can be observed only when our line of sight is right on one of the two jets. The collimation of GRB ejecta can be tested observationally, through various beaming effects, such as the achromatic break in GRB afterglow light curves (Sari et al. 1999; Liang et al. 2008), the polarization in both the main burst phase and the afterglow phase (Lazzati 2006), the predicted existence of orphan afterglows (Rhoads 1997; Huang et al. 2002; Granot & Loeb 2003), and the energy crisis already noted in some GRBs (Frail et al. 2001). In fact, more and more observational evidences have been accumulated today, supporting the idea that many GRB ejecta might be highly collimated. Current studies on the beaming effects are mostly concentrated on the emission from the forward jet, i.e., the jet moving toward the observer. The emission from the receding jet (or the counter jet) is generally omitted. It is interesting to note that this ingredient recently has been studied by a few authors (Granot & Loeb 2003; Li & Song 2004). By some simple analytical derivations, Li & Song (2004) argued that the emission from the receding jet can be detected in a few cases in the non-relativistic phase of GRB afterglows. However, previous studies did not consider some important effects, such as the action of the equal arrival time surface (EATS). Recently, Zhang & MacFadyen (2009) presented a two-dimensional simulation of GRB outflow. The emission from the receding jet has also been included in their calculations, but they did not investigate the effects of various parameters on the receding jet component. In this paper, we will present our detailed numerical investigation on the emission from the receding jet of GRB in the deep Newtonian stage. Although the GRB jet may be complicatedly structured (Mészáros et al. 1998; Kumar & Granot 2003; Huang et al. 2004), and the circum-burst environment may be wind medium and even associated with some complex density variations (Mészáros et al. 1998; Chevalier & Li 2000; Gou et al. 2001; Wu et al. 2004), here we will only consider the simplest situation, i.e, the homogeneous double-sided jets expanding into a homogeneous interstellar medium, which is favored by some recent fits (Huang et al. 2000a; Yost et al. 2003). The structure of our paper is organized as follows. §2 is mainly a review of the dynamics and radiation model we used in our calculations. In §3 we present the numerical results, together with our tentative explanations. §4 is our conclusion and discussion. ## 2 Model Description In the afterglow phase, the GRB ejecta expands into the interstellar medium (ISM) and is decelerated continuously, giving rise to a strong external shock. The swept-up electrons are accelerated by the blastwave, producing the afterglow mainly through synchrotron radiation. In radio bands, the shell is no longer optically thin, so that the synchrotron self-absorption should be considered. In our study, we will use the simplified dynamical equations suggested by Huang et al. (1999, 2000b), which is consistent with the self- similar solution of Blandford & McKee (1976) in the ultra-relativistic phase, and is consistent with the Sedov solution (Sedov 1969) in the non-relativistic phase. The beaming effects (Rhoads 1997, 1999) can also be conveniently simulated in this way. Here, for completeness, we first describe the dynamics and the radiation process briefly. ### 2.1 Hydrodynamical Evolution In our description, $t$ is the photon arrival time measured in the lab frame; $R$ is the radial coordinate measured in the burst frame relative to the initiation point; $m$ is the rest mass of the swept-up medium; $\theta$ is the half-opening angle of the ejecta; $\gamma$ is the bulk Lorentz factor of the moving material; $p$ is the electron distribution index which is typically between 2 and 3; $n$ is the number density of ISM; $\xi_{\rm e}$ and $\xi^{2}_{\rm B}$ are the energy equipartition factors for electrons and the comoving magnetic field. We further denote the initial values of the rest mass, the isotropic equivalent energy, the Lorentz factor and the half-opening angle of the ejecta as $M_{\rm ej},E_{\rm 0,iso},\gamma_{0},\theta_{\rm j}$, respectively. The overall dynamical evolution of the GRB ejecta can be depicted by $\displaystyle\frac{\mathrm{d}R}{\mathrm{d}t}$ $\displaystyle=$ $\displaystyle\beta c\gamma\left({\gamma+\sqrt{\gamma^{2}-1}}\right),$ (1) $\displaystyle\frac{\mathrm{d}m}{\mathrm{d}R}$ $\displaystyle=$ $\displaystyle 2\pi\left({1-\cos\theta}\right)R^{2}nm_{\rm p},$ (2) $\displaystyle\frac{\mathrm{d}\theta}{\mathrm{d}t}$ $\displaystyle=$ $\displaystyle\frac{c_{\rm s}}{R}\left({\gamma+\sqrt{\gamma^{2}-1}}\right),$ (3) $\displaystyle\frac{\mathrm{d}\gamma}{\mathrm{d}m}$ $\displaystyle=$ $\displaystyle-\frac{\gamma^{2}-1}{M_{\rm ej}+\varepsilon m+2(1-\varepsilon)\gamma m},$ (4) where $\beta=\sqrt{1-1/\gamma^{2}}$, $c$ is the speed of light, and $c_{\rm s}$ is the comoving sound speed, which can be calculated by $c_{\rm s}^{2}=\hat{\gamma}(\hat{\gamma}-1)(\gamma-1)c^{2}/\left[1+\hat{\gamma}(\gamma-1)\right]$ with $\hat{\gamma}\approx(4\gamma+1)/({3\gamma})$ being a reasonable approximation for the adiabatic index. In Equation (4), $\varepsilon$ is the radiative efficiency. In the extreme case, $\varepsilon=0$ means adiabatic condition and $\varepsilon=1$ refers to highly radiative situation. Note that in realistic case, $\varepsilon$ should evolve gradually from 1 to 0, in about several hours. Equations (1) — (4) is a convenient description of GRB afterglow dynamics that is applicable in both the initial ultra-relativistic phase and the late Newtonian phase. ### 2.2 Radiation Process Basically, we assume that the shock-accelerated electrons follow a power-law distribution according to their energies, $\mathrm{d}N^{\prime}_{\rm e}/{\mathrm{d}\gamma_{\rm e}}\propto\gamma_{\rm e}^{-p}$, However, to ensure that the calculation in the deep Newtonian phase is correct, we need to modify the basic distribution function as $\mathrm{d}N^{\prime}_{\rm e}/{\mathrm{d}\gamma_{\rm e}}\propto\left(\gamma_{\rm e}-1\right)^{-p}$ (Huang & Cheng 2003). The minimum and maximum Lorentz factors of electrons can be calculated as $\gamma_{\rm e,\min}=\xi_{e}(\gamma-1)m_{\rm p}(p-2)/[m_{\rm e}(p-1)]+1$ and $\gamma_{\rm e,\max}=\sqrt{6\pi e/\left(\sigma_{\rm T}B^{\prime}\right)}\approx 10^{8}(B^{\prime}/1{\rm G})^{-1/2}$, where $B^{\prime}$ is the comoving magnetic field strength, $m_{\rm p}$ and $m_{\rm e}$ are masses of proton and electron, respectively. As usual, we assume that the energy ratio of magnetic field with respect to internal energy is $\xi^{2}_{\rm B}$, so that the energy density of magnetic field is $B^{\prime 2}/(8\pi)=\xi^{2}_{\rm B}\left(\hat{\gamma}-1\right)^{-1}(\hat{\gamma}\gamma+1)(\gamma-1)nm_{\rm p}c^{2}$. The cooling of electrons due to synchrotron radiation will lead to a steep distribution function above a critical Lorentz factor, $\gamma_{\rm c}$. The expression for $\gamma_{\rm c}$ can be derived as $\gamma_{\rm c}=6\pi m_{\rm e}c/\left(\sigma_{\rm T}\gamma B^{\prime 2}t\right)$, where $\sigma_{\rm T}$ is the Thompson scattering cross section (Sari et al. 1998). Considering all the above ingredients, we finally use the following electron distribution function in our calculations (Huang & Cheng 2003): 1\. $\gamma_{\rm c}\leq\gamma_{\rm e,\min}$, $\frac{\mathrm{d}N^{\prime}_{\rm e}}{\mathrm{d}\gamma_{\rm e}}\propto\left\\{\begin{array}[]{l}\left(\gamma_{\rm e}-1\right)^{-2}\hskip 22.76228pt(\gamma_{\rm c}\leq\gamma_{\rm e}<\gamma_{\rm e,\min}),\\\ \left(\gamma_{\rm e}-1\right)^{-(p+1)}\hskip 9.53186pt(\gamma_{\rm e,\min}\leq\gamma_{\rm e}\leq\gamma_{\rm e,\max});\\\ \end{array}\right.$ (5) 2\. $\gamma_{\rm e,\min}<\gamma_{\rm c}\leq\gamma_{\rm e,\max}$, $\frac{\mathrm{d}N^{\prime}_{\rm e}}{\mathrm{d}\gamma_{\rm e}}\propto\left\\{\begin{array}[]{l}\left(\gamma_{\rm e}-1\right)^{-p}\hskip 22.1931pt(\gamma_{\rm e,\min}\leq\gamma_{\rm e}\leq\gamma_{\rm c}),\\\ \left(\gamma_{\rm e}-1\right)^{-(p+1)}\hskip 9.67383pt(\gamma_{\rm c}<\gamma_{\rm e}\leq\gamma_{\rm e,\max});\\\ \end{array}\right.$ (6) 3\. $\gamma_{\rm c}>\gamma_{\rm e,\max}$, $\frac{\mathrm{d}N^{\prime}_{\rm e}}{\mathrm{d}\gamma_{\rm e}}\propto\left(\gamma_{\rm e}-1\right)^{-p}\hskip 15.6491pt(\gamma_{\rm e,\min}\leq\gamma_{\rm e}\leq\gamma_{\rm e,\max}).$ (7) In the comoving frame, the synchrotron radiation power at $\nu^{\prime}$ is (Rybicki & Lightman 1979) $P^{\prime}(\nu^{\prime})=\frac{\sqrt{3}e^{3}B^{\prime}}{m_{\rm e}c^{2}}\int_{\min\left(\gamma_{\rm e,\min}\ ,\ \gamma_{\rm c}\right)}^{\gamma_{\rm e,\max}}{\left(\frac{\mathrm{d}N^{\prime}_{\rm e}}{\mathrm{d}\gamma_{\rm e}}\right)}\ F\left(\frac{\nu^{\prime}}{\nu^{\prime}_{\rm e}}\right)d\gamma_{\rm e},$ (8) with $F(x)=x\int_{x}^{+\infty}{K_{5/3}(k)\,\mathrm{d}k}$ being the Bessel function and $\nu^{\prime}_{\rm e}=3\gamma^{2}_{\rm e}eB^{\prime}/\left(4\pi m_{\rm e}c\right)$ being the characteristic emission frequency (Shu 1991; Longair 1992). To calculate the radio afterglows, we must consider the synchrotron self-absorption. The optical depth of synchrotron self-absorption can be obtained as $\tau_{\nu^{\prime}}=\frac{\sqrt{3}e^{3}B^{\prime}}{8\pi m^{2}_{\rm e}c^{2}\nu^{\prime 2}}\int_{\min\left(\gamma_{\rm e,\min}\ ,\ \gamma_{\rm c}\right)}^{\gamma_{\rm e,\max}}{(q+2)\left(\frac{\mathrm{d}n^{\prime}_{\rm e}}{\mathrm{d}\gamma_{\rm e}}\right)\frac{1}{\gamma_{\rm e}}}\ F\left(\frac{\nu^{\prime}}{\nu^{\prime}_{\rm e}}\right)d\gamma_{\rm e},$ (9) where $\mathrm{d}n^{\prime}_{\rm e}/\mathrm{d}\gamma_{\rm e}$ denotes the column density distribution of electrons measured in the comoving frame on the line of sight; $q$ is the electron power-law distribution index which varies from $2$ to $p+1$ for fast-cooling and from $p$ to $p+1$ for slow-cooling. The synchrotron self-absorption will affect the radiation by a reduction-factor (Waxman et al. 1998) $f(\tau)=\frac{1-e^{-\tau_{\nu^{\prime}}}}{\tau_{\nu^{\prime}}}.$ (10) Let us define the Doppler-factor as $D=\left[\gamma\left(1-\beta\mu\right)\right]^{-1}$ (Mészáros 2006), where $\mu=\cos\Theta$ and $\Theta$ is the angle between the velocity of the emitting material and the line of sight. Also we denote the viewing angle as $\theta_{\rm obs}$. Then the observed frequency is $\nu=D\nu^{\prime}/(1+z)$, and the observed flux density from a point-like source is $F_{\nu}=\frac{(1+z)D^{3}}{4\pi d_{\rm L}^{2}}f(\tau)P^{\prime}\left[(1+z)D^{-1}\nu\right],$ (11) where $d_{\rm L}$ is the luminosity distance. Finally, we can integrate the flux density over the EATS (Waxman 1997; Sari 1998) determined by $t_{\rm obs}=(1+z)\int\frac{\mathrm{d}R}{\beta\gamma cD}\equiv\rm{const}.$ (12) ## 3 Numerical Results In this section, we present our numerical results concerning the emission from the receding jet. First of all, for simplicity, we assume that the twin jets have the same characteristics, i.e., the same initial energy, opening angle, initial Lorentz factor, and the circum-burst ISM density. We also assume that the microphysics shock parameters ($p$, $\xi_{\rm e}$, $\xi^{2}_{\rm B}$) are the same for the receding and forward blastwaves. For convenience, we define a set of parameter values as the “standard” condition: $n=1/{\rm cm}^{3}$, $E_{\rm 0,iso}=10^{53}{\rm ergs}$, $\theta_{\rm j}=0.1$, $\varepsilon=0$, $\xi_{\rm e}=0.1$, $\xi^{2}_{\rm B}=0.01$, $p=2.5$, $\theta_{\rm obs}=0$, and $\gamma_{0}=300$. These values are typical in the study of GRB afterglows. For redshift, we adopt the value of $z=0.1$ (which corresponds to $d_{\rm L}=454$ Mpc according to the popular cosmology model, Wright 2006). Firstly we illustrate the evolution of the Lorentz factors of the twin jets in Fig. 1. Note that the X-axis is observers’ time. For the observer, the dynamical evolution of the receding jet is quite different from that of the forward jet, especially in the relativistic phase. We see that in a rather long time ($t\sim 50$ d), $\gamma$ of the receding jet remains almost constant. This is due to the time delay induced by the long distance between the twin jets. It also implies that the emission from the receding jet will be very weak in this period, since it is highly beamed backwardly. At the observers’ time of $t\sim 340$ d, the Lorentz factor of the receding jet is still more than 10, while the forward jet’s Lorentz factor has already decreased to less than 1.1 . In Fig. 2, we show some examples of the equal arrival time surfaces (EATSes) at three moments. As expected, at any particular moment, the typical radius of the surface is much larger for the forward jet branch as compared with that for the receding jet branch. Also, we notice that the curvature of the two branches is quite different. Generally, the EATS is much flatter on the receding jet. Another interesting feature is that the area of the EATS on the forward branch is much larger than that of the corresponding receding branch. Fig. 3 shows the radio and optical afterglow light curves under the “standard” condition (thick lines). Here, the thick dotted line corresponds to emission from the forward jet, the thick dashed line corresponds to emission from the receding jet, and the thick sold line is the total light curve. Under the “standard” condition, for the forward jet, the afterglow light curve (the dotted line) becomes slightly flattened in the non-relativistic phase. It is consistent with previous results in the deep Newtonian phase (Huang & Cheng 2003). Also it can be seen that the receding jet really can contribute a significant portion in the total emission at very late stage. The role played by the receding jet is reasonably more important in the radio band than in the optical band. However, the dashed component is generally not very strong, so that it can only lead to a plateau in the total light curve, but not an obvious rebrightening or a marked peak as expected by Li & Song (2004). Interestingly, our result is consistent with the simulation of Zhang & Macfadyen (2009). We believe that the discrepancy between our numerical result and Li & Song’s analytical result mainly comes from the effect of the EATS. Below, we will give some detailed analyses on this point. Additionally, it should be noted that in the radio band, the peak flux of the receding component is about 4 orders of magnitude weaker than that of the forward component. It essentially means that the receding component is very weak, and is very difficult to detect. In the optical band, the condition is even more awkward. The peak flux of the receding component is about 23 magnitudes dimmer than that of the forward component in R band. Even comparing with the flux of the forward jet at the jet break time, it is still 16 — 17 magnitudes weaker. So, in optical band, it is even much more difficult to observe the receding jet component. According to Li & Song (2004), the time when the receding jet becomes notably visible ($t_{\rm NR}^{\rm RJ}$) is relevant to the time when the forward jet enters the non-relativistic phase ($t_{\rm NR}$), i.e., $t_{\rm NR}^{\rm RJ}=t_{\rm NR}+\frac{2r_{\rm NR}}{c},$ (13) where $r_{\rm NR}$ is the radius of the forward jet at $t_{\rm NR}$. In the standard frame work (Blandford & Mckee 1976; Rhoads 1999), the sphere-like phase of a highly collimated GRB ejecta ends at the so called jet break time determined by $\gamma_{\rm j}=1/\theta_{\rm j}$, with the shock radius being $r_{\rm j}=\left(3E_{\rm 0,iso}\theta_{\rm j}^{2}/\left[{4\pi nm_{\rm p}c^{2}}\right]\right)^{1/3}$. After the sphere-like phase, the jet spreads laterally at the co-moving sound speed $c_{\rm s}$ so that we have $\gamma\propto t^{-1/2}$ and $r_{\rm NR}\approx r_{\rm j}$ (Rhoads 1999). Then finally we obtain $t_{\rm NR}=\frac{1}{2c}\left(\frac{3E_{\rm 0,iso}\theta_{\rm j}^{2}}{4\pi nm_{\rm p}c^{2}}\right)^{1/3},\\\ \qquad t_{\rm NR}^{\rm RJ}=5t_{\rm NR}.$ (14) Adopting the standard values of our parameters, Equation (14) yields $t_{\rm NR}\approx 104$ d and $t_{\rm NR}^{\rm RJ}\approx 520$ d. After correcting for the cosmological time dilation ($z=0.1$), we get the corresponding observers’ time of $t_{1}=(1+z)\ t_{\rm NR}\approx 114$ d and $t_{3}=(1+z)\ t_{\rm NR}^{\rm RJ}\approx 572$ d. In fact, in Fig. 2, the EATSes for these two moments have been displayed. So, according to Li & Song’s suggestion, the contribution from the receding jet should peak at $t_{3}\approx 572$ d. In our Fig. 3, for the “standard” condition, the peak is postponed to $t_{\rm peak}\sim 1140$ d for 8.46 GHz, and to $t_{\rm peak}\sim 1700$ d in R band. So, the EATS effect and the deceleration of the external shock can lead to some subtle difference between the analytical results and the numerical results. Actually, Zhang & MacFadyen’s numerical results have clearly shown that the observers’ time does not equal to the burst frame time at $t_{\rm NR}$ (Zhang & MacFadyen 2009). Unfortunately, in previous analysises it is usually assumed that these two times are equal. Another reason that suppresses the rebrightening of the receding jet is as follows. According to Li & Song’s analysis, at the observers’ time $t_{3}$, the receding jet should be at the radius of $r_{\rm NR}$. However, from our Fig. 2, we see that the typical radius of the EATS at $t_{3}$ on the receding jet is much smaller than the radius of the forward jet at $t_{1}$. The reason is again due to the EATS effect. It means that the receding jet still does not decelerate enough at $t_{3}$ (actually, the bulk Lorentz factor is still 3.95), and its emission is still mainly directed forwardly (not backwardly toward the observer). Additionally, Fig. 2 shows clearly that the area of the receding jet at $t_{3}$ (corresponding to $t_{\rm NR}^{\rm RJ}$ ) is much smaller than that of the forward jet at $t_{1}$ (corresponding to $t_{\rm NR}$). So, the number of electrons involved in the radiation process is typically much smaller on the receding jet at $t_{\rm NR}^{\rm RJ}$, as compared to that on the forward jet at $t_{\rm NR}$. Due to the above reasons, the contribution from the receding jet is naturally much weaker than that deduced from $L_{\rm\nu}^{\rm RJ}(t)\approx L_{\rm\nu}(t-4t_{\rm NR}),\ (t\geq t_{\rm NR}^{\rm RJ})$ (Equation (7) in Li & Song (2004) ). However, although the receding jet emission is generally very weak in our “standard” condition, we guess that in some special cases it still can be enhanced. Obviously, a denser environment will help to decelerate the jet more quickly, thus lead to a smaller $t_{\rm peak}$ and a higher intensity. In Fig. 3, we have also plotted in thin lines our numerical results for a double-sided jet that locates in a dense circum-burst medium ($n=1000/{\rm cm}^{3}$). Note that other parameters involved here are the same as the “standard” case. Encouragingly, in Fig. 3(a) we see that the peak time of the receding jet can be as early as $t_{\rm peak}\sim 150$ d, with the peak flux as large as a few mJy in radio band (i.e., only several times less than the peak level of the forward jet). In Fig. 3(b), the optical contribution from the receding jet is still very weak, with the peak flux being about 28m. In Fig. 4, we plot the afterglow light curves in more radio and optical/infrared bands. Generally speaking, $t_{\rm peak}$ is about 1140 d in radio bands and is about 1700 d in optical bands. Such a difference in the peak time is insignificant, considering that the frequency difference between radio and optical wavelengths is really huge. We notice that $t_{\rm peak}$ almost remains the same from radio to X-ray bands in Fig. 7 of Zhang & MacFadyen (2009). Thus our results are roughly consistent with Zhang & MacFadyen’s. Another interesting conclusion that can be drawn from our Figs. 3 and 4 is that at lower frequency, the relative intensity of the receding jet component (its peak flux), as compared with the peak of the forward jet component, becomes stronger. Such a tendency can also be roughly seen in Fig. 7 of Zhang & MacFadyen (2009). Fig. 5 illustrates the effects of some parameters ($n$, $E_{\rm 0,iso}$, $\theta_{\rm j}$, and $\varepsilon$) on the receding jet component in the afterglow light curve. Fig. 5(a) shows that the circum-burst medium density ($n$) affects the peak time ($t_{\rm peak}$) of receding jet dramatically. A larger number density usually leads to a smaller $t_{\rm peak}$. The strength of the receding jet component is also obviously enhanced. It again hints that the receding jet component is most likely detectable in a dense environment. Similarly, the initial kinetic energy ($E_{\rm 0,iso}$) also affects $t_{\rm peak}$ significantly, with larger $E_{\rm 0,iso}$ corresponding to a larger $t_{\rm peak}$ (Fig. 5(b)). The effect of the initial jet opening angle ($\theta_{\rm j}$) on $t_{\rm peak}$ can also be clearly seen in Fig. 5(c). It should be further noted that the receding jet component is more marked when the opening angle is smaller. In Fig. 5(d), we can observe an obvious rebrightening when the radiation efficiency ($\varepsilon$) is large. However, in realistic case, $\varepsilon$ is unlikely to be so large. Actually, at such late stages, the external shock should be adiabatic, so that $\varepsilon$ should be nearly zero. In Fig. 5(d), we also plot the radio afterglow light curves for double-sided jets under some special physical assumptions. The dash-dotted line is plotted by assuming that both the forward jet and the receding jet do not experience any lateral expansion. Since the deceleration of the jets is much slower in this case, we see that the receding jet component emerges much later and is also much less obvious as compared with our “standard” case. The dotted line is plotted by assuming a much smaller initial Lorentz factor ($\gamma_{0}=30$), which may correspond to the so called failed GRBs (Huang et al. 2002). The receding jet component emerges slightly earlier as compared with the solid line, but its role becomes less significant correspondingly. Fig. 6 illustrates the effects of other four parameters ($\xi_{\rm e}$, $\xi_{\rm B}^{2}$, $p$, and $\theta_{\rm obs}$) on the receding jet component. Generally speaking, a larger $\xi_{\rm e}$ and/or $\xi_{\rm B}^{2}$ can enhance the receding jet component markedly. On the other hand, although $p$ has an important influence on the overall afterglow light curve, its impact on the relative strength of the receding jet component is not significant. Again, note that in all the cases, the contribution from the receding jet only emerges as a plateau, but not as any obvious rebrightening. In Fig. 6(d), when the observing angle ($\theta_{\rm obs}$) increases, the forward jet component becomes weaker, while the receding jet component becomes stronger. It is in good accord with our expectation (also see Granot & Loeb 2003). However, the contribution from the receding jet still generally plays a minor role in the total afterglow light curve. Additionally, for off-axis twin jets, the GRB from the forward jet is un-observable, so that even the afterglow from the forward jet itself (i.e., the orphan afterglow) is difficult to observe. Note that in Fig. 6(d), when $\theta_{\rm obs}=\pi/2$ (i.e., the thick solid line), the contribution from the receding jet and the forward jet are actually equal. Equation (14) tells us that the peak time of the receding component should be relevant to the 3 parameters of $n$, $E_{\rm 0,iso}$, $\theta_{\rm j}$; on the other hand, other parameters such as $\xi_{\rm e}$, $\xi_{\rm B}^{2}$, $p$ do not affect the peak time. These tendency can be clearly seen in Figs. 5 and 6. In all the above calculations, we have assumed that the conditions and parameters of the twin jets are the same. However, this may not be the case for realistic GRBs. The circum-burst environment and the micro-physics parameters may actually be different for the twin jets, as that may happen in the two component jet structure (Huang et al. 2004; Jin et al. 2007; Racusin et al. 2008). In Fig. 7, we have plotted the overall afterglow light curves by assuming different parameters for the forward jet and the receding jet. In each panel of Fig. 7, we first plot a common light curve (the solid line) by adopting the standard parameter set, but change $\xi_{\rm e}$ to 0.01 and change $\xi^{2}_{\rm B}$ to $10^{-4}$. We then increase the values of $\xi_{\rm e}$, $\xi_{\rm B}^{2}$, and $n$ for the receding jet to see their effects on the afterglow light curve. It is encouraging to see that the emission from the receding jet really can be greatly enhanced, so that it can manifest as an obvious rebrightening in the overall light curve. In Fig. 7(a), 7(b) and 7(d), the peak flux of the rebrightening can be nearly 100 times larger than the “background” level in the best cases. It is imaginable that in the most favorable cases, when all $\xi_{\rm e}$, $\xi_{\rm B}^{2}$ and $n$ are larger for the receding jet at the same time, the rebrightening will be even more remarkable. However, note that the contrary condition may also exist in realistic GRBs, i.e., these parameters may also be smaller for the receding jet. Then the emission from the receding jet will be completely unnoticeable. ## 4 Conclusion and Discussion We have studied the emission of the receding jet numerically. The effect of the EATS is included in our calculations. Clearly, this effect plays an important role in the process. It is found that the contribution from the receding jet is generally quite weak. In most cases, it only manifests as a short plateau in the overall afterglow light curve, but not a marked rebrightening. The flux density of the plateau is usually much less than 100 $\mu$Jy in radio bands even at a small redshift of $z=0.1$ . If we place the GRB at a more typical redshift of $z=1$, then the flux density of the plateau will be less than 0.1 $\mu$Jy at 8.46 GHz. We noticed that the observed radio afterglow emission is generally on the level of 0.1 — 1 mJy at about the peak time. After several months, the radio afterglow usually decreases to a very low level, and is submersed by the emission from the host galaxy, whose strength can be 40 — 70 $\mu$Jy (Berger et al. 2001). Additionally, the error bar of radio observations is usually $\sim$ 30 — 50 $\mu$Jy at very late stages (Frail et al. 2003). Thus the contribution from the receding jet, i.e. the plateau, is actually very difficult to detect currently, especially for those GRBs at $z\sim 1$. Our results are consistent with a recent observational report by van der Horst et al. (2008), who failed to detect any clear clues of the receding jet emission. However, as shown in our Fig. 7, if the micro-physics parameters of the receding jet were different from the forward jet, or if the receding jet were in a much denser environment, then it is still possible that the contribution from the receding jet can be greatly enhanced. For example, if $\xi_{\rm e}$ and/or $\xi_{\rm B}^{2}$ of the receding jet is much larger than that of the forward jet, then the receding jet can really manifest as an obvious rebrightening. Also, our Fig. 5(a) shows that a dense circum-burst environment can suppress the emission of the forward jet, and enhance the contribution from the receding jet. If the GRB occurs in a very dense molecular cloud with $n>10^{3}/{\rm cm}^{3}$ (Dai & Lu 1999), the contribution from the receding jet may be much easier to detect. Additionally, if the GRB is very near to us at the same time, then the possibility of successfully detecting the receding jet is very high (see the thin lines in Fig. 3(a)). In short, we believe that the effort of trying to search for the afterglow contribution from the receding jet is still meaningful. If observed, it would provide useful clues to study the circum-burst environment and the micro- physics of external shocks. We suggest that nearby GRBs (with redshift $z\leq 0.1$) should be good candidates for such studies. ###### Acknowledgements. We would like to thank the anonymous referee for constructive suggestions that lead to an overall improvement of this study. We also thank Z. Li for stimulating discussion. This research was supported by the National Natural Science Foundation of China (grant 10625313), and by the National Basic Research Program of China (grant 2009CB824800). Xin Wang is also supported by 2008’ National Undergraduate Innovation Program of China (grant 081028441). ## References * (1) Aloy, M. A., Müller, E., Ibáñez, J., Martí, J., & MacFadyen, A. 2000, ApJ, 531, L119 * (2) Berger, E., Kulkarni, S. R., & Frail, D. A. 2001, ApJ, 560, 652 * (3) Blandford, R. D., & McKee, C. F. 1976, Phys. Fluids, 19, 1130 * (4) Chevalier, R. A., & Li, Z. Y. 2000, ApJ, 536, 195 * (5) Costa, E., Frontera, F., Heise, J., et al. 1997, Nat, 387, 783 * (6) Dai, Z. G., & Lu, T. 1999, ApJ, 519, L155 * (7) Frail, D. A., Kulkarni, S. R., Berger, E., & Wieringa, M. H. 2003, AJ, 125, 2299 * (8) Frail, D. A., Kulkarni, S. R., Nicastro, S. R., Feroci, M., & Taylor, G. B. 1997, Nat, 389, 261 * (9) Frail, D. A., Kulkarni, S. R., Sari, R., et al. 2001, ApJ, 562, L55 * (10) Gou, L. J., Dai, Z. G., Huang, Y. F., & Lu, T. 2001, A&A, 368, 464 * (11) Granot, J., & Loeb, A. 2003, ApJ, 593, L81 * (12) Hjorth, J., Sollerman, J., Møller, P., et al. 2003, Nat, 423, 847 * (13) Huang, Y. F., & Cheng, K. S. 2003, MNRAS, 341, 263 * (14) Huang, Y. F., Dai, Z. G., & Lu, T. 1999, MNRAS, 309, 513 * (15) Huang, Y. F., Dai, Z. G., & Lu, T. 2000a, A&A, 355, L43 * (16) Huang, Y. F., Dai, Z. G., & Lu, T. 2000b, MNRAS, 316, 943 * (17) Huang, Y. F., Dai, Z. G., & Lu, T. 2002, MNRAS, 332, 735 * (18) Huang, Y. F., Wu, X. F., Dai, Z. G., Ma, H. T., Lu, T. 2004, ApJ, 605, 300 * (19) Jin, Z. P., Yan, T., Fan, Y. Z., Wei, D. M., 2007, ApJ, 656, L57 * (20) Kumar, P., & Granot, J. 2003, ApJ, 591, 1075 * (21) Lazzati, D. 2006, New J. Phys., 8, 131 * (22) Li, Z., & Song, L. M. 2004, ApJ, 614, L17 * (23) Liang, E. W., Racusin, J. L., Zhang, B., Zhang, B. B., & Burrows, D. N. 2008, ApJ, 675, 528 * (24) Longair, M. S. 1992, High Energy Astrophysics, Vol. 1, Cambridge University Press: Cambridge * (25) MacFadyen, A. I., & Woosley, S. E. 1999, ApJ, 524, 262 * (26) Mészáros, P. 2002, ARA&A, 40, 137 * (27) Mészáros, P. 2006, Rep. Prog. Phys., 69, 2259 * (28) Mészáros, P., Rees, M. J., & Wijers, R. A. M. J. 1998, ApJ, 499, 301 * (29) Piran, T. 2004, Rev. Mod. Phys., 76, 1143 * (30) Racusin, J. L., Karpov, S. V., Sokolowski, M., et al. 2008, Nature, 455, 183 * (31) Rhoads, J. E. 1997, ApJ, 487, L1 * (32) Rhoads, J. E. 1999, ApJ, 525, 737 * (33) Rybicki, G. B., & Lightman, A. P. 1979, Radiative Processes in Astrophysics, Wiley: New York * (34) Sari, R. 1998, ApJ, 494, L49 * (35) Sari, R., Piran, T., & Halpern, J. P. 1999, ApJ, 519, L17 * (36) Sari, R., Piran, T., & Narayan, R. 1998, ApJ, 497, L17 * (37) Sedov, L. 1969, Similarity and Dimensional Methods in Mechanics, Chap. 4, Academic: New York * (38) Shu, F. H. 1991, The Physics of Astrophysics, Vol. 1, University Science Books: Mill Valley, California * (39) van der Horst, A. J., Kamble, A., Resmi, L., et al. 2008, A&A, 480, 35 * (40) van Paradijs, J., Groot, P. J., Galama, T., et al. 1997, Nat, 386, 686 * (41) Waxman, E. 1997, ApJ, 491, L19 * (42) Waxman, E., Kulkarni, S. R., & Frail, D. A. 1998, ApJ, 497, 288 * (43) Woosley, S. E. 1993, ApJ, 405, 273 * (44) Wright, E. L. 2006, PASP, 118, 1711 * (45) Wu, X. F., Dai, Z. G., Huang, Y. F., & Ma, H. T. 2004, ChJAA, 4, 455 * (46) Yost, S. A., Harrison, F. A., Sari, R., & Frail, D. A. 2003, ApJ, 597, 459 * (47) Zhang, W. Q., & MacFadyen, A. 2009, ApJ accepted (arXiv:0902.2396) Figure 1: The evolution of the Lorentz factors of the twin jets. The solid line corresponds to the receding jet and the dashed line is plotted for the forward jet. The twin jets are in “standard” condition as defined in Sect. 3. The observers’ time has been corrected for the cosmological effect ($z=0.1$). Figure 2: Schematic illustration of the EATSes at three moments, $t_{1}\approx 114$ d, $t_{2}\approx 286$ d and $t_{3}\approx 572$ d. In this calculation, we have used the “standard” parameter set as defined in Sect. 3. “O” is the position of the central engine, and the observer is on the far right side with Y=0. The dotted lines indicate the jet boundary. For the receding jet, the EATSes are plotted in thick solid lines, while for the forward jet the surfaces are plotted in thin solid lines. Note that on the forward jet branches, the bulk Lorentz factors of the material at the peak of the EATSes are 1.17, 1.07, and 1.03 for $t_{1}$, $t_{2}$, and $t_{3}$, respectively. On the receding jet branches, the bulk Lorentz factors of the material at the peak of the EATSes are 56.07, 11.79, and 3.95 for $t_{1}$, $t_{2}$, and $t_{3}$, respectively. Figure 3: 8.46 GHz radio afterglow (a) and R-band optical afterglow (b) from the forward jet and the receding jet. The thick lines are plotted for a “standard” double-sided jet as defined in Sect. 3. The thin lines are plotted for the double-sided jet with only one parameter altered as compared with the “standard” condition, i.e. $n=1000/{\rm cm}^{3}$. In each group, the dotted line reflects the emission from the forward jet, the dashed line reflects the contribution from the receding jet, and the solid line is the total light curve. Figure 4: Multiwavelength afterglow light curves of a double-sided jet. Radio afterglows are illustrated in panel (a), and optical/IR afterglows are plotted in panel (b). In this calculation, we have used the “standard” parameter set as defined in Sect. 3. Figure 5: The effects of various parameters ($n$, $E_{\rm 0,iso}$, $\theta_{\rm j}$, and $\varepsilon$) on the 8.46 GHz radio afterglow light curves of double-sided jets. In each panel, “(s)” corresponds to the “standard” condition as defined in Sect. 3, and other lines are drawn with only one certain parameter altered or one condition changed. In panel (d), the dash-dotted line is plotted for a double-sided jet without lateral expansion; and the dotted line is plotted for a double-sided jet with a low initial Lorentz factor ($\gamma_{\rm 0}=30$), which may correspond to the so called failed GRBs. Figure 6: The effects of various parameters ($\xi_{\rm e}$, $\xi_{\rm B}^{2}$, $p$, and $\theta_{\rm obs}$) on the 8.46 GHz radio afterglow light curves of double-sided jets. In each panel, “(s)” corresponds to the “standard” condition as defined in Sect. 3, and other lines are drawn with only one certain parameter altered. Figure 7: 8.46 GHz radio afterglow light curves of double-sided jets. In this figure, we assume that the parameters of the receding jet can be different from those of the forward jet. In each panel, the solid line is plotted under the “standard” condition, i.e., the parameters are completely the same for the twin jets (but note that we have evaluated $\xi_{\rm e}$ as 0.01 and $\xi_{\rm B}^{2}$ as $10^{-4}$ here). For other light curves, one or two parameters are changed for the receding jet, to see its effect on the afterglows.
arxiv-papers
2009-03-18T10:00:18
2024-09-04T02:49:01.233691
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Xin Wang, Y. F. Huang, Si-Wei Kong", "submitter": "Y. F. Huang", "url": "https://arxiv.org/abs/0903.3119" }
0903.3136
# Experimental and numerical investigation of the reflection coefficient and the distributions of Wigner’s reaction matrix for irregular graphs with absorption Michał Ławniczak1, Oleh Hul1, Szymon Bauch1, Petr Šeba2,3, and Leszek Sirko1 1Institute of Physics, Polish Academy of Sciences, Aleja Lotników 32/46, 02-668 Warszawa, Poland 2University of Hradec Králové, Hradec Králové, Czech Republic 3Institute of Physics, Academy of Sciences of the Czech Republic, Cukrovarnická 10, 162 53 Praha, Czech Republic (April 16, 2008) ###### Abstract We present the results of experimental and numerical study of the distribution of the reflection coefficient $P(R)$ and the distributions of the imaginary $P(v)$ and the real $P(u)$ parts of the Wigner’s reaction $K$ matrix for irregular fully connected hexagon networks (graphs) in the presence of strong absorption. In the experiment we used microwave networks, which were built of coaxial cables and attenuators connected by joints. In the numerical calculations experimental networks were described by quantum fully connected hexagon graphs. The presence of absorption introduced by attenuators was modelled by optical potentials. The distribution of the reflection coefficient $P(R)$ and the distributions of the reaction $K$ matrix were obtained from the measurements and numerical calculations of the scattering matrix $S$ of the networks and graphs, respectively. We show that the experimental and numerical results are in good agreement with the exact analytic ones obtained within the framework of random matrix theory (RMT). ###### pacs: 05.45.Mt,03.65.Nk Quantum graphs of connected one-dimensional wires were introduced more than sixty years ago by Pauling Pauling . Next the same idea was used by Kuhn Kuhn to describe organic molecules by free electron models. Quantum graphs can be considered as idealizations of physical networks in the limit where the lengths of the wires are much bigger than their widths, i.e. assuming that the propagating waves remain in a single transversal mode. Among the systems modelled by quantum graphs one can find e.g., electromagnetic optical waveguides Flesia ; Mitra , mesoscopic systems Imry ; Kowal , quantum wires Ivchenko ; Sanchez and excitation of fractons in fractal structures Avishai ; Nakayama . Recently it has been shown that quantum graphs are excellent paradigms of quantum chaos Kottossmilansky ; Kottos ; Prlkottos ; Zyczkowski ; Kus ; Tanner ; Kottosphyse ; Kottosphysa ; Gaspard ; Blumel ; Hul2004 . More complicated and thus more realistic systems - microwave networks with moderate absorption strength $\gamma=2\pi\Gamma/\Delta\leq 7.1$, where $\Gamma$ is the absorption width and $\Delta$ is the mean level spacing, have been experimentally investigated in Hul2005 ; Hul2007 . Other interesting open objects - quantum graphs with leads - have been analyzed in details in Kottosphyse ; Kottosphysa . However, the properties of networks and graphs with strong absorption have not been studied experimentally neither numerically so far. Therefore, in this paper we study experimentally and numerically the distribution of the reflection coefficient $P(R)$ and the distributions of the Wigner’s reaction matrix Akguc2001 (in the literature often called $K$ matrix Fyodorov2004 ) for networks (graphs) with time reversal symmetry ($\beta=1$) in the presence of strong absorption. In the case of a single channel antenna experiment the $K$ matrix is related to the scattering matrix $S$ by the following relation $S=\frac{1-iK}{1+iK}.$ (1) Eq. (1) holds for the systems with absorption but without direct processes Fyodorov2004 . It is important to mention that the function $Z=iK$ has a direct physical meaning of the electric impedance that has been recently measured in the microwave cavity experiment Anlage2005 . In the one channel case the $S$ matrix can be parameterized as $S=\sqrt{R}e^{i\theta},$ (2) where $R$ is the reflection coefficient and $\theta$ the phase. Properties of the statistical distributions of the $S$ matrix with direct processes and imperfect coupling have been studied theoretically in several important papers Lopez1981 ; Doron1992 ; Brouwer1995 ; Savin2001 ; Fyodorov2003 ; Fyodorov2005 . Recently the distribution of the $S$ matrix has been also measured experimentally for chaotic microwave cavities with absorption Kuhl2005 . The distribution $P(R)$ of the reflection coefficient $R$ and the distributions of the imaginary $P(v)$ and the real $P(u)$ parts of the Wigner’s reaction $K$ matrix are theoretically known for any dimensionless absorption strength $\gamma$ Fyodorov2004 ; Savin2005 . In the case of time reversal systems (symmetry index $\beta=1$) $P(R)$ has been studied experimentally by Méndez-Sánchez et al. Sanchez2003 . The distributions $P(v)$ and $P(u)$ have been studied for chaotic microwave cavities in Anlage2005 ; Anlage2006 and for microwave networks for moderate absorption strength $\gamma\leq 7.1$ in Hul2005 ; Hul2007 . For systems without time reversal symmetry ($\beta=2$) and a single perfectly coupled channel $P(R)$ was calculated by Beenakker and Brouwer Beenakker2001 while the exact formulas for the distributions $P(v)$ and $P(u)$ were given by Fyodorov and Savin Fyodorov2004 . In the experiment quantum graphs can be simulated by microwave networks. The analogy between quantum graphs and microwave networks is based upon the equivalency of the Schrödinger equation describing the quantum system and the telegraph equation describing the microwave circuit Hul2004 . A general microwave network consists of $N$ vertices connected by bonds e.g., coaxial cables. A coaxial cable consists of an inner conductor of radius $r_{1}$ surrounded by a concentric conductor of inner radius $r_{2}$. The space between the inner and the outer conductors is filled with a homogeneous material having a dielectric constant $\varepsilon$. For a frequency $\nu$ below the onset of the next TE11 mode only the fundamental TEM mode can propagate inside a coaxial cable. (This mode is in the literature often called a Lecher wave.) The cut-off frequency of the TE11 mode is $\nu_{c}\simeq\frac{c}{\pi(r_{1}+r_{2})\sqrt{\varepsilon}}=32.9$ GHz Jones , where $r_{1}$ = 0.05 cm is the inner wire radius of the coaxial cable (SMA- RG402), while $r_{2}$ = 0.15 cm is the inner radius of the surrounding conductor, and $\varepsilon\simeq 2.08$ is the Teflon dielectric constant Breeden1967 ; Savytskyy2001 . From the experimental point of view absorption of the networks can be changed by the change of the bonds’ (cables’) lengths Hul2004 or more effectively by the application of microwave attenuators Hul2005 ; Hul2007 . In the numerical calculations weak absorption inside the cables can be described with the help of complex wave vector Hul2004 . We will show that strong absorption inside an attenuator can be described by a simple optical potential. The corresponding mathematical theory has been developed in Ex1 . The distribution $P(R)$ of the reflection coefficient $R$ and the distributions of the imaginary and real parts of the Wigner’s reaction matrix $K$ for microwave networks with absorption were found using the impedance approach Anlage2005 ; Anlage2006 ; Hul2007 . In this approach the real and imaginary parts of the normalized impedance $Z$ $Z=\frac{\textrm{Re }Z_{n}+i(\textrm{Im }Z_{n}-\textrm{Im }Z_{r})}{\textrm{Re }Z_{r}}$ (3) of a chaotic microwave system are measured, with $Z_{n(r)}=Z_{0}(1+S_{n(r)})/(1-S_{n(r)})$ being the network (radiation) impedance expressed by the network (radiation) scattering matrix $S_{n(r)}$ and $Z_{0}$ is the characteristic impedance of the transmission line. The radiation impedance $Z_{r}$ is the impedance seen at the output of the coupling structure for the same coupling geometry, but with the vertices of the network removed to infinity. The Wigner’s reaction matrix $K$ can be expressed by the normalized impedance as $K=-iZ$. The scattering matrix $S$ of a network for the perfect coupling case (no direct processes present) required for the calculation of the reflection coefficient $R$ (see Eq. (2)) can be finally extracted from the formula $S=(1-Z)/(1+Z)$. Figure 1: (a) The scheme of the experimental set-up for measurements of the scattering matrix $S_{n}$ of the microwave fully connected networks with absorption. Absorption in the networks was varied by the change of the attenuators. (b) The scheme of the setup used to measure the radiation scattering matrix $S_{r}$. Instead of a network five 50 $\Omega$ loads were connected to the 6-joint. Figure 1(a) shows the experimental setup for measuring the single-channel scattering matrix $S_{n}$ of fully connected hexagon microwave networks necessary for finding of the impedance $Z_{n}$. We used Hewlett-Packard 8720A microwave vector network analyzer to measure the scattering matrix $S_{n}$ of the networks in the frequency window: 7.5–11.5 GHz. The networks were connected to the vector network analyzer through a lead - a HP 85131-60012 flexible microwave cable - connected to a 6-joint vertex. The other five vertices of the networks were connected by 5-joints. Each bond of the network presented in Fig. 1(a) contains a microwave attenuator. The radiation impedance $Z_{r}$ was found experimentally by measuring the scattering matrix $S_{r}$ of the 6-joint connector with five joints terminated by 50 $\Omega$ loads (see Figure 1(b)). The experimentally measured fully connected hexagon networks were described in numerical calculations by quantum fully connected hexagon graphs with one lead attached to the 6-joint vertex. In the calculations attenuators (absorbers) were modelled by optical potentials Ex1 . To be explicit we suppose that the fully connected hexagon graph $\Upsilon$ with one coupled antenna is described in the Hilbert space $L^{2}(\Upsilon):=\bigoplus_{(j,n)}L^{2}(0,\ell_{jn})\bigoplus L^{2}(0,\infty)$, where $\ell_{jn}$ stays for the lengths of the bond connecting the vertices $j$ and $n$ and the halfline $(0,\infty)$ describes the attached antenna. We define the Schrödinger operator $H$ by $H{\psi_{jn}:=\,-\psi^{\prime\prime}_{jn}+U_{jn}\psi_{jn}},$ (4) with $\psi_{jn}\in L^{2}(0,\ell_{jn})$ for the bonds and $H{\psi_{0n}:=\,-\psi_{0n}^{\prime\prime}},$ (5) with $\psi_{0n}\in L^{2}(0,\infty)$ describing the wave function of the antenna connected to the vertex $n$ (note that the ”infinite” vertex of the antenna has index 0) . At the vertices the wave functions are linked together with the boundary values $\psi_{jn}(j):=\lim_{x\to 0+}\psi_{jn}(x)\,,\quad\psi^{\prime}_{jn}(j):\lim_{x\to 0+}\psi^{\prime}_{jn}(x)\,,$ (6) satisfying boundary conditions $\,\psi_{jn}(j)=\psi_{jm}(j)=:\psi_{j}$ for all $n,m$ describing connected vertices, and $\sum_{n\in\nu(j)}\psi^{\prime}_{jn}(j)=0.$ (7) The optical potentials $U_{jn}$ are purely imaginary and describe the absorber inserted between the vertices $(j,n)$. Since the graph $\Upsilon$ is infinite (due to the attached antenna) we can look for solutions of the equation $H\psi=k^{2}\psi,$ (8) referring to the continuous spectrum, where $k$ is the wave vector. For microwaves propagating inside a lossless bond with a dielectric constant $\varepsilon$ the wave vector $k=2\pi\varepsilon\nu/c$, where $\nu$ and $c$ denote the frequency of a microwave field and the speed of light in the vacuum, respectively. To solve this equation we used the graph duality principle Ex1 . According to this principle we need to solve the equation $-f^{\prime\prime}+U_{jn}f=k^{2}f$ on $[0,\ell_{jn}]$ satisfying the normalized Dirichlet boundary conditions $u_{jn}(\ell_{jn})=1\\!-\\!(u_{jn})^{\prime}(\ell_{jn})=0\,,\;\;v_{jn}(0)1\\!-\\!(v_{jn})^{\prime}(0)=0\,.$ (9) The Wronskian of this solution is naturally equal to $W_{jn}-v_{jn}(\ell_{jn})=u_{jn}(0)$. Then according to Ex1 the corresponding boundary values (6) satisfy the equation $\sum_{n}{\psi_{n}\over W_{jn}}\,-\,\left(\,\sum_{n\in\nu(j)}{(v_{jn})^{\prime}(\ell_{jn})\over W_{jn}}\,\right)\psi_{j}\,=\,0\,.$ (10) Conversely, any solution $\psi_{j}$ of the system (10) determines a solution of (8) by $\displaystyle\psi_{jn}(x)={\psi_{n}\over W_{jn}}\,u_{jn}(x)-\,{\psi_{j}\over W_{jn}}\,v_{jn}(x)\;\;$ $\displaystyle{\rm if}$ $\displaystyle n=1,..,6\,,$ (11) $\displaystyle\psi_{jn}(x)=-\,{\psi_{j}\over W_{jn}}\,v_{jn}(x)\;\;$ $\displaystyle{\rm if}$ $\displaystyle n=0\,.$ (12) As already mentioned the microwave attenuators are modelled by optical potentials localized inside the inserted component. It is well known that any smooth and localized potential can be easily approximated by a sequence of delta potentials inside the support of the potential - see demkov for details. We will use this fact and express the optical potential as a sum of $N$ delta-potentials with imaginary coupling constants: $U(x)=ib\sum_{r=1}^{N}\delta(x-(r-1)l_{b}/(N-1))$. The delta-potentials were equally spaced inside the length $l_{b}$ of the absorbing element (attenuator). By changing the number $N$ and the strength $b$ of delta- potentials we were able to vary absorbing properties as well as reflective properties of attenuators. We used $N=10$ delta-potentials with $b=0.028$ $m^{-1}$ for simulation of the 1 dB attenuators and $N=12$ delta-potentials with $b=0.045$ $m^{-1}$ for the 2 dB attenuators. In both cases the length of the attenuator was $l_{b}=2.65$ cm. Furthermore, in the numerical calculations of the scattering matrices $S_{n}$ of the graphs the weak absorption inside the microwave cables was taken into account by replacing the real wave vector $k$ by the complex vector $k+ia\sqrt{k}$ Goubau , where the absorption coefficient was assumed to be $a=0.009$ $m^{-1/2}$ Hul2004 . Figure 2: In the panels (a) and (b) the modulus $|S_{n}|$ and the phase $\theta$ of the scattering matrix $S$ measured for the network with $\gamma=19.9$ are plotted in the frequency range 7.5 - 9 GHz. In (c) and (d) $|S_{n}|$ and $\theta$ of the scattering matrix $S_{n}$ are plotted for the network with $\gamma=47.9$ in the same frequency range. The measurements have been done for the two networks which in each bond contained: 1 dB attenuator ((a) and (b)) and 2 dB attenuator ((c) and (d)), respectively. The total “optical” length of the microwave networks including joints and attenuators were 574 cm and 554 cm, respectively. In order to find the distribution $P(R)$ of the reflection coefficient $R$ and the distributions of the imaginary and real parts of the K matrix we measured the scattering matrix $S_{n}$ of $88$ and $74$ network configurations containing in each bond a single 1 dB and 2 dB microwave SMA attenuator, respectively. The total optical lengths of the microwave networks containing 1 dB attenuators, including joints and attenuators, varied from 574 cm to 656 cm. For the networks with 2 dB attenuators the optical lengths varied from 554 cm to 636 cm. To avoid degeneracy of eigenvalues of the networks the lengths of the bonds were chosen as incommensurable. In Figure 2 the modulus $|S_{n}|$ and the phase $\theta$ of the scattering matrix $S_{n}$ of the microwave networks with $\gamma=19.9\textrm{ and }47.9$, respectively, are presented in the frequency range 7.5 - 9 GHz. The measurements were done for two networks containing 1 dB and 2 dB attenuators, respectively. Their total “optical” lengths including joints and attenuators were 574 cm and 554 cm, respectively. For systems with time reversal symmetry ($\beta=1$), the explicit analytic expression for the distribution $P(R)$ of the reflection coefficient $R$ is given by Savin2005 $P(R)=\frac{2}{(1-R)^{2}}P_{0}\Bigl{(}\frac{1+R}{1-R}\Bigr{)}.$ (13) The probability distribution $P_{0}(x)$ is given by the expression $P_{0}(x)=-\frac{dW(x)}{dx},$ (14) where the integrated probability distribution $W(x)$ is expressed by the formula Savin2005 $W(x)=\frac{x+1}{4\pi}\Bigl{[}f_{1}(w)g_{2}(w)+f_{2}(w)g_{1}(w)+h_{1}(w)j_{2}(w)+h_{2}(w)j_{1}(w)\Bigr{]}_{w=(x-1)/2}.$ (15) The functions $f_{1},g_{1},h_{1},j_{1}$ are defined as follows $f_{1}(w)=\int_{w}^{\infty}dt\frac{\sqrt{t\mid t-w\mid}e^{-\gamma t/2}}{(1+t)^{3/2}}\Bigl{[}1-e^{-\gamma}+\frac{1}{t}\Bigr{]},$ (16) $g_{1}(w)=\int_{w}^{\infty}dt\frac{e^{-\gamma t/2}}{\sqrt{t\mid t-w\mid}(1+t)^{3/2}},$ (17) $h_{1}(w)=\int_{w}^{\infty}dt\frac{\sqrt{\mid t-w\mid}e^{-\gamma t/2}}{\sqrt{t(1+t)}}\Bigl{[}\gamma+(1-e^{-\gamma})(\gamma t-2)\Bigr{]},$ (18) $j_{1}(w)=\int_{w}^{\infty}dt\frac{e^{-\gamma t/2}}{\sqrt{t\mid t-w\mid}(1+t)^{1/2}}.$ (19) Their counterparts with the index 2 are given by the same expressions but the integration is performed in the interval $t\in[0,w]$ instead of $[w,\infty)$. Figure 3: Experimental distribution $P(R)$ of the reflection coefficient $R$ for the microwave fully connected hexagon networks at $\bar{\gamma}=19.3$ (open squares) and $\bar{\gamma}=47.7$ (full squares). The corresponding theoretical distribution $P(R)$ evaluated from the Eq. (13) is marked by the solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$), respectively. Figure 4: Numerical distribution $P(R)$ of the reflection coefficient $R$ for fully connected hexagon quantum graphs at $\bar{\gamma}=19.3$ (open circles) and $\bar{\gamma}=47.7$ (full circles). The corresponding theoretical distribution $P(R)$ evaluated from the Eq. (13) is marked by the solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$), respectively. The distributions of the imaginary and the real parts $P(v)$ and $P(u)$ of the $K$ matrix Fyodorov2004 can be also expressed by the probability distribution $P_{0}(x)$: $P(v)=\frac{\sqrt{2}}{\pi v^{3/2}}\int^{\infty}_{0}dqP_{0}\Bigl{[}q^{2}+\frac{1}{2}\Bigl{(}v+\frac{1}{v}\Bigr{)}\Bigr{]},$ (20) and $P(u)=\frac{1}{2\pi\sqrt{u^{2}+1}}\int^{\infty}_{0}dqP_{0}\Bigl{[}\frac{\sqrt{u^{2}+1}}{2}\Bigl{(}q+\frac{1}{q}\Bigr{)}\Bigr{]},$ (21) where $-v=\textrm{Im}\,K<0$ and $u=\textrm{Re}\,K$ are, respectively, the imaginary and real parts of the $K$ matrix. Figure 3 shows the experimental distributions $P(R)$ (squares) of the reflection coefficient $R$ for two mean values of the parameter $\bar{\gamma}$, viz., 19.3 and 47.7. The distribution for $\bar{\gamma}=19.3$ is obtained by averaging over 88 realizations of the microwave networks containing 1 dB attenuators. The distribution for $\bar{\gamma}=47.7$ is obtained by averaging over 74 realizations of the microwave networks containing 2 dB attenuators. The experimental values of the $\gamma$ parameter were estimated for each realization of the network by adjusting the theoretical mean reflection coefficient $\langle R\rangle_{th}$ to the experimental one $\langle R\rangle=\langle SS^{{\dagger}}\rangle$, where $\langle R\rangle_{th}=\int_{0}^{1}dRRP(R).$ (22) Figure 3 also presents the corresponding distributions $P(R)$ (solid and dashed lines, respectively) evaluated from Eq. (13). A good overall agreement of the experimental distributions $P(R)$ with their theoretical counterparts is seen. Figure 4 shows the numerically evaluated distributions $P(R)$ (circles) of the reflection coefficient $R$ for the graphs at $\bar{\gamma}=19.3\textrm{ and }47.7$ compared to the theoretical ones evaluated from the formula Eq. (13). The numerical distributions are the result of averaging over 162 and 214 realizations of the graphs with optical potentials simulating 1 dB and 2 dB attenuators, respectively. The numerical values of $\gamma$ parameter were also estimated by adjusting the theoretical mean reflection coefficient to the numerical one. The agreement between the numerical results for $\bar{\gamma}=47.7$ and the theoretical ones (dashed line) is good. However, for $\bar{\gamma}=19.3$ for $R<0.15$ some discrepancies between the numerical results and the theoretical ones (solid line) are visible. Figure 5: Experimental distribution $P(v)$ of the imaginary part of the $K$ matrix for the two values of the mean absorption parameter: $\bar{\gamma}=19.3$ (open squares) and $\bar{\gamma}=47.7$ (full squares), respectively. The corresponding theoretical distribution $P(v)$ evaluated from the Eq. (20) is marked by the solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$), respectively. Figure 6: Numerical distribution $P(v)$ of the imaginary part of the $K$ matrix for the two values of the mean absorption parameter: $\bar{\gamma}=19.3$ (open circles) and $\bar{\gamma}=47.7$ (full circles), respectively. The corresponding theoretical distribution $P(v)$ evaluated from the Eq. (20) is marked by the solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$), respectively. In Figure 5 the experimental distribution $P(v)$ of the imaginary part of the $K$ matrix is shown for the two mean values of the parameter $\bar{\gamma}=19.3\textrm{ and }47.7$, respectively. The distribution is the result of averaging over 88 and 74 realizations of the networks with the attenuators 1 dB and 2 dB, respectively. The experimental results in Figure 5 are in general in good agreement with the theoretical ones. However, both experimental distributions are slightly higher than the theoretical ones in the vicinity of their maxima. Figure 7: Experimental distribution $P(u)$ of the real part of the $K$ matrix for the two values of the mean absorption parameter: $\bar{\gamma}=19.3$ (open squares) and $\bar{\gamma}=47.7$ (full squares), respectively. The experiment is compared to the theoretical distribution $P(u)$ evaluated from the Eq. (21): solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$). Figure 8: Numerical distribution $P(u)$ of the real part of the $K$ matrix for the two values of the mean absorption parameter: $\bar{\gamma}=19.3$ (open circles) and $\bar{\gamma}=47.7$ (full circles), respectively. The numerical results are compared to the theoretical distributions $P(u)$ evaluated from the Eq. (21): solid line ($\gamma=19.3$) and dashed line ($\gamma=47.7$). Results of the numerical calculations of the distributions $P(v)$ are shown in Figure 6 for two mean values of the parameter $\bar{\gamma}=19.3\textrm{ and }47.7$, respectively. They are compared to the theoretical ones evaluated from the formula Eq. (20). Figure 6 shows also a good agreement between the numerical and theoretical results, which confirms usefulness of the optical potential approach in describing the microwave attenuators. Measurements of the distribution $P(u)$ of the real part of the Wigner’s reaction matrix give an additional test of the consistency of the $\gamma$ evaluation. In Figure 7 we show this distribution obtained for two values of $\bar{\gamma}=19.3\textrm{ and }47.7$, respectively, compared to the theoretical ones evaluated from the formula Eq. (21). Also here we observe good overall agreement between the experimental and theoretical results. However, Figure 7 shows that for the networks with 2 dB attenuators the theoretical distribution is in the middle ($-0.1<u<0.1$) slightly higher than the experimental one. According to the definition of the $K$ matrix (see Eq. (1)) such a behavior of the experimental distribution $P(u)$ suggests deficiency of small values of $|\textrm{Im}S|$, whose origin is not known. Moreover, the experimental distribution $P(u)$ obtained for the networks assembled with 1 dB attenuators is slightly asymmetric for $|u|>0.5$. In Figure 8 the comparison of the numerical distribution $P(u)$ obtained for two values of $\bar{\gamma}=19.3\textrm{ and }47.7$, respectively, to the theoretical one evaluated from the formula Eq. (21) is presented. In this case we see a good overall agreement between the numerical and theoretical results. In spite of the above mentioned discrepancies which appeared mainly in the case of the experimental distribution $P(u)$ the overall good agreement between the experimental and theoretical results justifies a posteriori the chosen procedure of calculating the experimental $\gamma$. The same is true also for the numerical simulations. In summary, we measured and calculated numerically the distribution of the reflection coefficient $P(R)$ and the distributions of the imaginary $P(v)$ and the real $P(u)$ parts of the Wigner’s reaction $K$ matrix for irregular fully connected hexagon networks and graphs in the presence of strong absorption. In the case of the microwave networks consisting of SMA cables and attenuators the application of attenuators allowed for effective change of absorption in the graphs. In the numerical calculations absorption in an attenuator was modelled by an optical potential. We showed that in the case of the time reversal symmetry ($\beta=1$) the experimental and numerical results for $P(R)$, $P(v)$ and $P(u)$ are in good overall agreement with the theoretical predictions. The agreement of the numerical and theoretical results strongly confirms the usefulness of the optical potential approach in the description of the microwave attenuators. Acknowledgments. This work was partially supported by Polish Ministry of Science and Higher Education grant No. N202 099 31/0746 and by the Ministry of Education, Youth and Sports of the Czech Republic within the project LC06002. ## References * (1) L. Pauling, J. Chem. Phys. 4, 673 (1936). * (2) H. Kuhn, Helv. Chim. Acta, 31, 1441 (1948). * (3) C. Flesia, R. Johnston, and H. Kunz, Europhys. Lett. 3 , 497 (1987). * (4) R. Mitra and S.W. Lee, Analytical techniques in the Theory of Guided Waves (Macmillan, New York, 1971). * (5) Y. Imry, Introduction to Mesoscopic Systems (Oxford, New York, 1996). * (6) D. Kowal, U. Sivan, O. Entin-Wohlman, Y. Imry, Phys. Rev. B 42, 9009 (1990). * (7) E.L. Ivchenko, A.A. Kiselev, JETP Lett. 67, 43 (1998). * (8) J.A. Sanchez-Gil, V. Freilikher, I. Yurkevich, and A. A. Maradudin, Phys. Rev. Lett. 80 , 948 (1998). * (9) Y. Avishai and J.M. Luck, Phys. Rev. B 45, 1074 (1992). * (10) T. Nakayama, K. Yakubo, and R.L. Orbach, Rev. Mod. Phys. 66, 381 (1994). * (11) T. Kottos and U. Smilansky, Phys. Rev. Lett. 79, 4794 (1997). * (12) T. Kottos and U. Smilansky, Annals of Physics 274, 76 (1999). * (13) T. Kottos and U. Smilansky, Phys. Rev. Lett. 85, 968 (2000). * (14) T. Kottos and H. Schanz, Physica E 9, 523 (2003). * (15) T. Kottos and U. Smilansky, J. Phys. A 36, 3501 (2003). * (16) F. Barra and P. Gaspard, Journal of Statistical Physics 101, 283 (2000). * (17) G. Tanner, J. Phys. A 33, 3567 (2000). * (18) P. Pakoński, K. Życzkowski and M. Kuś, J. Phys. A 34, 9303 (2001). * (19) P. Pakoński, G. Tanner and K. Życzkowski, J. Stat. Phys. 111, 1331 (2003). * (20) R. Blümel, Yu Dabaghian, and R.V. Jensen, Phys. Rev. Lett. 88, 044101 (2002). * (21) O. Hul, S. Bauch, P. Pakoński, N. Savytskyy, K. Życzkowski, and L. Sirko, Phys. Rev. E 69, 056205 (2004). * (22) O. Hul, O. Tymoshchuk, Sz. Bauch, P.M. Koch and L. Sirko, J. Phys. A 38, 10489 (2005). * (23) O. Hul, S. Bauch, M. Ławniczak, and L. Sirko, Acta Phys. Pol. A 112, 655 (2007). * (24) G. Akguc and L.E. Reichl, Phys. Rev. E 64, 056221 (2001). * (25) Y.V. Fyodorov and D.V. Savin, JETP Letters 80, 725 (2004). * (26) S. Hemmady, X.Zheng, E. Ott, T.M. Antonsen, and S.M. Anlage, Phys. Rev. Lett. 94, 014102 (2005). * (27) G. López, P.A. Mello, and T.H. Seligman, Z. Phys. A 302, 351 (1981). * (28) E. Doron and U. Smilansky, Nucl. Phys. A 545, 455 (1992). * (29) P.W. Brouwer, Phys. Rev. B 51, 16878 (1995). * (30) D.V. Savin, Y.V. Fyodorov, and H.-J. Sommers, Phys. Rev. E 63, 035202 (2001). * (31) Y.V. Fyodorov, JETP Letters 78, 250 (2003). * (32) Y.V. Fyodorov, D.V. Savin, and H.-J. Sommers, J. Phys. A 38, 10731 (2005). * (33) U. Kuhl, M. Martinez-Mares, R.A. Méndez-Sánchez, and H.-J. Stöckmann, Phys. Rev. Lett. 94, 144101 (2005). * (34) D.V. Savin, H.-J. Sommers, and Y.V. Fyodorov, JETP Letters 82, 544 (2005). * (35) R.A. Méndez-Sánchez, U. Kuhl, M. Barth, C.V. Lewenkopf, and H.-J. Stöckmann, Phys. Rev. Lett. 91, 174102-1 (2003). * (36) S. Hemmady, X. Zheng, T.M. Antonsen Jr., E. Ott, and S.M. Anlage, Acta Physica Polonica A 109, 65 (2006). * (37) C.W.J. Beenakker and P.W. Brouwer, Physica E 9, 463 (2001). * (38) D.S. Jones, Theory of Electromagnetism (Pergamon Press, Oxford, 1964), p. 254. * (39) K. H. Breeden and A. P. Sheppard, Microwave J. 10, 59 (1967); Radio Sci. 3, 205 (1968). * (40) N. Savytskyy, A. Kohler, S. Bauch, R. Blümel, and L. Sirko, Phys. Rev. E 64, 036211 (2001). * (41) P. Exner, _Ann. Inst. H. Poincaré: Phys. Théor._ 66, 359 (1997) * (42) Y.N. Demkov, Ostrovskij V.N.: Metod potencialov nulevovo radiusa v atomnoj fizike, Izd. Leningradskogo Universiteta 1975 * (43) G. Goubau, Electromagnetic Waveguides and Cavities (Pergamon Press, Oxford, 1961).
arxiv-papers
2009-03-18T11:21:06
2024-09-04T02:49:01.240936
{ "license": "Public Domain", "authors": "Michal Lawniczak, Oleh Hul, Szymon Bauch, Petr Seba and Leszek Sirko", "submitter": "Oleh Hul", "url": "https://arxiv.org/abs/0903.3136" }
0903.3355
# Two-Stream Instability Model With Electrons Trapped in Quadrupoles Paul J. Channell Los Alamos National Laboratory, Los Alamos, NM 87545 111This work was supported by the US Department of Energy under Contract Number DE-AC52-06NA25396. ###### Abstract We formulate the theory of the two-stream instability (e-cloud instability) with electrons trapped in quadrupole magnets. We show that a linear instability theory can be sensibly formulated and analyzed. The growth rates are considerably smaller than the linear growth rates for the two-stream instability in drift spaces and are close to those actually observed. ## 1 Introduction The Proton Storage Ring (PSR) at Los Alamos has been troubled for some time, [1], [2], [3], [4], [5], [6], [7], [8], [9], by an instability that is probably a two-stream instability of the proton beam with background electrons, i.e. an electron-cloud instability. We have previously considered the possibility that the instability for a bunched beam occurred because of electrons in drift regions that were renewed from turn to turn, [10]; in this case the phase memory of the coherent motion has to reside in the proton beam which excited the fresh electrons on each turn which then drove the tail of the proton bunch to larger amplitudes. In this note we will consider instead the possibility that the instability is due to electrons that survive from turn to turn. The most likely place in the ring where the electrons can survive with coherent phase information from turn to turn is in the quadrupoles, where they are trapped in the magnetic mirrors formed by the cusp-shaped fields and can drive the e-p instability in a similar way to free electrons. In this note we will present a simple model of this two-stream instability with electrons trapped in quadrupoles. ### 1.1 Electron Trapping and Dynamics A major assumption of this note is that there are abundant electrons in the PSR; experimentally this has been observed, though the source is not completely clear. It is likely that some form of beam induced multipactor gives rise to the electrons, perhaps initiated by a very small number of lost beam particles, though other explanations are possible. Normally, one would expect that with a bunched beam electrons would be expelled during the beam gap and that one could not have an e-p instability; however, the electrons, however they are produced, cannot be driven quickly to the walls in the quadrupoles which act in the transverse direction as very effective magnetic mirrors. It thus seems possible that electrons in the quadrupoles could drive the e-p instability. To investigate this possibility further in this section we will make simple estimates of the electron motion in quadrupoles to establish that electrons can be trapped there for multiple turns and thus carry coherent phase information to drive the instabillity. A more accurate investigation of the electron motion in the complex geometry can and should be done using computer codes, [11]. The dominant aspect of electron motion in the quads is the rapid rotation about the magnetic field lines; the cyclotron frequency is $f_{c}={eB\over 2\pi mc},$ (1) where $e$ is the charge, $B$ is the magnetic field, $m$ is the mass, and $c$ is the speed of light. For electrons we have $f_{c}=2.8{\cal B}\,\,{\rm GHz},$ (2) where ${\cal B}$ is the magnetic field measured in kilogauss. Thus, even very low fields near the axis give rise to cyclotron frequencies that are hundreds of MHz; most electrons will have cyclotron frequencies that are multiple GHz. The radius of this rotational motion is, for electrons, $\rho=3.37*10^{-3}{\sqrt{\cal E}\over{\cal B}}\,\,{\rm cm},$ (3) where ${\cal E}$ is the transverse electron energy in eV. Only very energetic electrons in low field regions will have gyroradii approaching $1$ cm; most will have gyroradii that are much less than $1$ mm. Electrons are thus confined transversely to the magnetic field on cyclotron orbits of small radii and many are confined longitudinally (for electrons) along the magnetic field by the increasing magnetic field with radius, i.e. by ‘mirror’ confinement. (Note that longitudinal for the electrons is transverse to the beam direction.) Of course, particles with large components of velocity parallel to the magnetic field, i.e. those in the ‘loss cone’, are not confined; presumably these give rise to the electron ‘tracking’ that has been observed in the quadrupoles. We will ignore the rapid electron cyclotron motion in the quads and concentrate on the longitudinal electron mirror motion and transverse drifts due to electric fields and to magnetic field non-uniformity, i.e. a ‘guiding center’ description of the trapped electrons. In the transverse direction (for electrons) there are three components of electron drift, that due to the gradient in the magnetic field, the so-called ${\nabla B\;}$drift, that due to the field line curvature, and that due to any electric fields that are present, the ${E\times B\;}$drift. These drifts give rise to electron velocities perpendicular to the magnetic field; in fact, in the quads, the drifts are along the direction of the beam axis and thus can lead to electron loss out the ends of the quads. The ${\nabla B\;}$drift and curvature velocities are given by $V_{\nabla B}={m(v_{\perp}^{2}+2v_{\parallel}^{2})\over 2eB}{\hat{b}\times\nabla B\over B}c,$ (4) where $\hat{b}$ is a unit vector in the direction of the magnetic field, the $v_{\perp}^{2}$ term is due to the gradient drift and the $v_{\parallel}^{2}$ term is due to the curvature. If we assume the parallel and perpendicular electron velocities to be roughly the same and adopt the usual model of quadrupole magnetic fields in which a component is linear in transverse displacement from the axis, i.e. $B=B^{\prime}r,$ (5) then, defining the ${\nabla B\;}$confinement time, $T_{\nabla B}$ to be the time for an electron to drift half the length of a quad, $L_{Q}$, we get $T_{\nabla B}={eB^{\prime}r^{2}L_{Q}\over 4Ec},$ (6) where $E$ is the thermal energy of the electron. This becomes $T_{\nabla B}={\bar{B}^{\prime}\bar{r}^{2}\bar{L}_{Q}\over 4{\cal E}}\,\,\mu{\rm sec},$ (7) where $\bar{B}^{\prime}$ is the field gradient in T/m, $\bar{r}$ is the radius in cm, ${\cal E}$ is the energy in eV, and $\bar{L}_{Q}$ is the quad length in cm. As an example typical of the PSR, if we take $\bar{B}^{\prime}=3.7$, $\bar{r}=2.5$, and $\bar{L}_{Q}=47$, then $T_{\nabla B}={272\over{\cal E}}\,\,\mu{\rm sec}.$ (8) Note that this is an overestimate of the drifts since the actual drift reverses sign as the electrons move out along the magnetic field lines toward the poles. If the electrons only have energies that are a few hundred eV then the confinement time is tens to hundreds of turns and is probably longer than the growth time for the e-p instability. The ${E\times B\;}$drift velocity is given by $V_{E\times\\!B}={E_{\perp}\times B\over|B|^{2}}c$ (9) The electric field is due to the proton beam and to any electrons that are present. The electric potential due to the proton beam alone is given by $e\phi={2eI\over\beta c},$ (10) where $\beta$ is the beam velocity scaled by the speed of light and $I$ is the (time-dependent) beam current. The beam current varies by $100\%$ in one revolution period (the beam is bunched), but we will estimate drifts using the average current and resulting field. Note that electrons spend a lot of time near the magnetic mirror points where we expect that the $E$ field will mostly be parallel to the $B$ field and will give rise to only small drifts. Nevertheless, the ${E\times B\;}$drift velocity due to this term alone, assuming it acts all the time, would give an electron confinement time of $T_{E\times B}=8.34{\beta\bar{B}^{\prime}\bar{r}^{2}\bar{L}_{Q}\over{\cal I}}\,\,{\rm nsec},$ (11) where the current, ${\cal I}$, is measured in amps. if we again take $\bar{B}^{\prime}=3.7$, $\bar{r}=2.5$, ${\cal I}=10$, and $\bar{L}_{Q}=47$, then $T_{E\times B}=761$ nsec, i.e. electrons would be confined for several turns, even with this overestimate of the ${E\times B\;}$drift. With a more realistic calculation, including the full orbit dynamics of the electrons and the reverse drifts that occur when only the electrons are present, it is likely that the electrons will be confined for many turns. Electrons to the left and right of the beam, horizontally, are free to move vertically (initially) until they move out radially along the field line to a region of greater field strength. Electrons above and below the beam, vertically, are free to move horizontally (initially) until they move out radially along a field line to a region of greater field strength. A complete model of the electron motion is very complicated, but a simple model will suffice to treat the motion of the center of mass of the electrons for oscillations near the beam axis. Let us note that for electrons that can move vertically, i.e. those to the left and right of the beam, the restoring mirror force exactly vanishes at zero vertical position and the restoring force reverses sign there. For electrons that can move horizontally, i.e. those above and below the beam, the restoring mirror force exactly vanishes at zero horizontal position and the restoring force reverses sign there. Thus, in both transverse directions we should expect the restoring potential for an electron to be approximately a harmonic oscillator potential near the axis. To see this in more detail, let us begin with the equation from Krall and Trivelpiece, [12], for the equation of motion along a field line of a particle in a magnetic field ${d^{2}s\over dt^{2}}\approx-{v_{\perp 0}^{2}\over 2B_{0}}{\partial B\over\partial s},$ (12) where $s$ is the distance along the field line, $v_{\perp 0}$ is the initial value of the transverse velocity, and $B_{0}$ is the initial value of the magnitude of the magnetic field. The components of the quadrupole field are $B_{x}=B_{0}^{\prime}y,$ (13) $B_{y}=B_{0}^{\prime}x.$ (14) We thus see that ${\partial B\over\partial s}={2B_{0}^{\prime}xy\over x^{2}+y^{2}}.$ (15) From this we see that a particle that starts at $x=x_{0}$, $y=0$ satisfies the approximate equation ${d^{2}y\over dt^{2}}\approx-({B_{0}^{\prime}v_{\perp 0}^{2}\over B_{0}x_{0}})y,$ (16) i.e. it is approximately a harmonic oscillator with a squared angular frequency of $\omega_{m}^{2}={B_{0}^{\prime}v_{\perp 0}^{2}\over B_{0}x_{0}}.$ (17) But $B_{0}\approx B_{0}^{\prime}x_{0}$, so $\omega_{m}^{2}\approx{v_{\perp 0}^{2}\over x_{0}^{2}}.$ (18) It thus appears that modeling the mirror trapping of the electrons by a harmonic oscillator potential, but with a large spread in oscillation frequencies, should be a fairly good approximation. ## 2 Dipole Model of the e-p Instability In this section, in order to find thresholds and growth rates, we will present a simple theory of the _e-p_ instability. The model for the linear theory of the instability in this section that we use is similar to the theory of Keil and Zotter, [13]. We model the proton beam by the beam centroid at each azimuthal position around the ring. The background electrons have a complex distribution both in physical and in velocity space determined by their formation, capture in the quadrupoles, interaction with the proton beam, and loss, as discussed in the previous section. We cannot hope to accurately model all of these effects in an analytic theory; we will simply assume that the electrons have a distribution in the squared magnetic bounce frequency, $g_{m}=\omega_{m}^{2}$, and that at each bounce frequency those electrons are described by their centroid position, with electrons at a different bounce frequency having a different centroid. We assume the proton beam moves at a constant azimuthal velocity around the ring and is subject to a constant transverse focusing force that produces betatron oscillations at the betatron frequency, i.e. we make the smooth approximation, [14]. We only model proton beam and electron motion in one transverse direction. The protons and electrons are assumed to interact with each other via a force that is linear in the relative displacement of the centroids of the protons and electrons. The equations of motion for the centroids are thus given by $(\frac{\partial}{\partial t}+\omega_{0}\frac{\partial}{\partial\theta})^{2}y_{p}+\Gamma_{d}(\frac{\partial}{\partial t}+\omega_{0}\frac{\partial}{\partial\theta})y_{p}=-\omega^{2}_{\beta}y_{p}+\omega_{p}^{2}(Y_{e}-y_{p})$ (19) $\frac{\partial^{2}y_{em}}{\partial t^{2}}+\omega^{2}_{m}y_{em}=\omega^{2}_{e}(y_{p}-y_{em})$ (20) where $y_{p}(\theta,t)$ is the proton centroid position at an azimuth, $\theta$, around the machine and time, $t$, $\omega_{0}$ is the proton beam angular revolution frequency in the machine, and $\omega_{\beta}$ is the angular betatron frequency of the protons. The proton beam centroid only responds to the net electron centroid position, $Y_{e}$, which is given by $Y_{e}=\int f(g_{m})y_{em}(\theta,t)dg_{m},$ (21) where $f(g_{m})$ is the equilibrium distribution function of electrons in the squared bounce frequency and $y_{em}(\theta,t)$ is the centroid of electrons with a particular bounce frequency. The coupling frequencies $\omega_{p}$ and $\omega_{e}$ are given by $\omega^{2}_{e}=\frac{2N_{p}r_{e}c^{2}}{\pi b(a+b)R}$ (22) $\omega^{2}_{p}=(\frac{Fm_{e}}{\gamma m_{p}})\omega^{2}_{e}$ (23) with $N_{p}$ the number of protons in the machine, $r_{e}$ the classical electron radius, $c$ the velocity of light, $\gamma$ the relativistic factor of the proton beam, $a$ and $b$ the sizes of the proton beam, $F$ the neutralization fraction of electrons, and $R$ the effective radius of the ring. Note that the inter-species force is assumed to depend linearly on the distance between the beam centroids; this is approximately correct for small amplitudes of oscillation, but clearly fails at larger oscillation amplitudes. Also note that we have inserted a linear damping term with coefficient $\Gamma_{d}$ into the proton equation to account for the chromatic spread in proton revolution frequencies; the different revolution frequencies will give different longitudinal velocities which will Landau damp the transverse oscillations. A more extensive model would have the proton beam described by a distribution function in the azimuthal direction and take into account the Landau damping due to the spread in azimuthal velocities. The approximation we have adopted mimics this damping and has the same functional dependence as the result of this more extensive model (see below), i.e. the damping depends on 1) the energy spread, 2) the momentum compaction factor, and 3) the mode number (through the derivative in the damping term). Thus, this damping term will give rise to the correct qualitative behavior with the correct functional dependencies, i.e. damping of off-axis oscillations as they phase-mix away. We can estimate this damping rate of transverse oscillations due to this spread to be the chromatic fractional tune spread times the betatron frequency. Note that the chromatic fractional tune spread is just the chromaticity times the energy spread, i.e. it measures the longitudinal velocity spread and its influence on the transverse oscillations. We do not include the transverse tune spread due to space charge and machine nonlinearities because we are using a dipole model and the centroid motion of the protons does not depend on these terms. $\Gamma_{d}\sim({\Delta\nu\over\nu}){\omega_{\beta}\over 2\pi}.$ (24) Because we are using an unbunched beam model, i.e. the smooth approximation, the average neutralization around the ring will be smaller than the neutralization in the quadrupoles by roughly the ratio of the ratio of total quadrupole length to the ring circumference; thus the neutralization fraction in a quadrupole will be about $20$ times $F$ since quadrupoles are about $10$% of the circumference and only about half the electrons can move vertically. We have seen in the context of the drift space instability model, [10], that bunching doesn’t have a large effect on the instability, and we assume the same to be true here. There seems to be no simple way to incorporate bunching; a moderately realistic model would result in a dispersion equation which would be an infinite matrix eqation with all unbunched beam modes coupled. The unbunched beam model of this paper would then be just the diagonal approximation to this matrix equation. It is likely that an extensive numerical investigation would be required to resolve the behavior. The above model is overly simplified, but contains most of the important physics. It will break down, of course, if the electron loss rate is too high. Of couse, we are also assuming that the background electron density, on average, is constant so that if electron generation and loss rates fluctuate rapidly our model should fail. The model of Bosch, [15], for the effect of beam gaps on the trapped ion instability in an electron ring also considers the effect of a large spread of (ion) oscillation frequencies on the instability, and his formulation is similar to ours. If we assume that the perturbations have a dependence on time and angle proportional to $e^{-i\omega t+in\theta}$, then the equations become $(-(\omega-n\omega_{0})^{2}-i\Gamma_{d}(\omega-n\omega_{0})+\omega^{2}_{\beta}+\omega^{2}_{p})y_{p}=\omega^{2}_{p}Y_{e}$ (25) $(\omega^{2}_{e}+\omega^{2}_{m}-\omega^{2})y_{e}=\omega^{2}_{e}y_{p}.$ (26) Solving equation 26 for $y_{e}$ and using equations 21 and 25 we find $((\omega-n\omega_{0})^{2}+i\Gamma_{d}(\omega-n\omega_{0})-\omega^{2}_{\beta}-\omega^{2}_{p})=-\omega^{2}_{e}\omega^{2}_{p}\int{f(g_{m})\over g_{m}+\omega^{2}_{e}-\omega^{2}}dg_{m},$ (27) where we have used the definition of $g_{m}=\omega^{2}_{m}$. We have to deal with the singularity in the integral on the right hand side of this equation. We adopt the Landau prescription, see [12], where the integral is replaced by the principal value plus $\pi i$ times the residue at the pole; $\int{f(g_{m})\over g_{m}+\omega^{2}_{e}-\omega^{2}}dg_{m}=\mathchoice{{\vbox{\hbox{$\textstyle-$}}\kern-4.86108pt}}{{\vbox{\hbox{$\scriptstyle-$}}\kern-3.25pt}}{{\vbox{\hbox{$\scriptscriptstyle-$}}\kern-2.29166pt}}{{\vbox{\hbox{$\scriptscriptstyle-$}}\kern-1.875pt}}\\!\int{f(g_{m})\over g_{m}+\omega^{2}_{e}-\omega^{2}}dg_{m}+\pi if(\omega^{2}-\omega^{2}_{e}).$ (28) Equation 27 thus becomes $\displaystyle((\omega-n\omega_{0})^{2}+i\Gamma_{d}(\omega-n\omega_{0})-\omega^{2}_{\beta}-\omega^{2}_{p})$ $\displaystyle=$ $\displaystyle-\omega^{2}_{e}\omega^{2}_{p}\mathchoice{{\vbox{\hbox{$\textstyle-$}}\kern-4.86108pt}}{{\vbox{\hbox{$\scriptstyle-$}}\kern-3.25pt}}{{\vbox{\hbox{$\scriptscriptstyle-$}}\kern-2.29166pt}}{{\vbox{\hbox{$\scriptscriptstyle-$}}\kern-1.875pt}}\\!\int{f(g_{m})\over g_{m}+\omega^{2}_{e}-\omega^{2}}dg_{m}$ (29) $\displaystyle-\pi i\omega^{2}_{e}\omega^{2}_{p}f(\omega^{2}-\omega^{2}_{e}),$ where the bar through the integral sign indicates principal value. This is the dispersion relation for the two-stream mode. To solve it we have to specify the distribution function of electron bounce frequencies, $f$. Of course, there should be no electrons in the ‘loss-cone’, i.e. at zero $\omega^{2}_{m}$, but otherwise the detailed distribution depends on their formation, capture in the quadrupoles, interaction with the proton beam, and loss. We will simply take one distribution as an example, one in which the distribution is constant between a minimum squared bounce frequency and a maximum squared bounce frequency; i.e. $\displaystyle f(g_{m})$ $\displaystyle=$ $\displaystyle{1\over g_{max}-g_{min}}\;\;\;g_{min}\leq g_{m}\leq g_{max},$ (30) $\displaystyle 0\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;\;{\rm otherwise}$ With this distribution the dispersion equation, 29, becomes $\displaystyle(\omega-n\omega_{0})^{2}$ $\displaystyle=$ $\displaystyle\omega^{2}_{\beta}+\omega^{2}_{p}-i\Gamma_{d}(\omega-n\omega_{0})$ (31) $\displaystyle-{\omega^{2}_{e}\omega^{2}_{p}\over g_{max}-g_{min}}(\ln({g_{max}-\omega^{2}+\omega^{2}_{e}\over\omega^{2}-\omega^{2}_{e}-g_{min}})+\pi i)$ Though this is a transcendental equation and can’t be solved exactly, we note that the coefficient of the logarithmic term is small and the logarithm varies slowly, so we can simply solve iteratively. The remainder of the equation is a quadratic for $\omega-n\omega_{0}$ and the resulting approximate solution is $\displaystyle\omega$ $\displaystyle\approx$ $\displaystyle n\omega_{0}-{i\Gamma_{d}\over 2}$ (32) $\displaystyle\pm{1\over 2}\bigl{[}4(\omega^{2}_{\beta}+\omega^{2}_{p})-\Gamma_{d}^{2}$ $\displaystyle-{4\omega^{2}_{e}\omega^{2}_{p}\over g_{max}-g_{min}}(\ln({g_{max}-(n\omega_{0})^{2}+\omega^{2}_{e}\over(n\omega_{0})^{2}-\omega^{2}_{e}-g_{min}})+\pi i)\bigr{]}^{1\over 2}$ We note the damping due to the phase mixing term, as expected, and the usual upper and lower sidebands. Note that we have taken $\omega\approx n\omega_{0}$ inside the logarithm because the mode numbers are usually rather high $30-50$ and this is a good (few percent) approximation for the real part of the frequency. Let us expand just the imaginary term under the square root to find the damping and growth rates. For convenience define the real frequency shift to be $\omega^{2}_{s}\equiv{1\over 4}\bigl{[}4(\omega^{2}_{\beta}+\omega^{2}_{p})-\Gamma_{d}^{2}\\\ -{4\omega^{2}_{e}\omega^{2}_{p}\over g_{max}-g_{min}}(\ln({g_{max}-(n\omega_{0})^{2}+\omega^{2}_{e}\over(n\omega_{0})^{2}-\omega^{2}_{e}-g_{min}}))\bigr{]}$ Note that to a good approximation $\omega_{s}\approx\omega_{\beta}$. Expanding the imaginary term in the square root we get $\omega\approx n\omega_{0}-{i\Gamma_{d}\over 2}\pm\omega_{s}(1-{\pi i\omega^{2}_{e}\omega^{2}_{p}\over 2\omega^{2}_{s}(g_{max}-g_{min}))})$ (33) Note that the upper side band (plus sign) is always damped, but that the lower side band can be unstable if ${\pi\omega^{2}_{e}\omega^{2}_{p}\over\omega_{s}(g_{max}-g_{min}))}>\Gamma_{d},$ (34) with growth rate given by $\gamma_{\rm growth}={\pi\omega^{2}_{e}\omega^{2}_{p}\over 2\omega_{s}(g_{max}-g_{min}))}-{\Gamma_{d}\over 2}.$ (35) A number of modes in lower side bands can be unstable, limited only by the condition $\omega_{e}^{2}+g_{min}<\omega^{2}<\omega_{e}^{2}+g_{max}$, with roughly equal growth rates (there is some weak dependence on mode number in $\omega_{s}$) and this is consistent with experiments where multiple modes are usually observered, [16]. ### 2.1 Example Let us look at an example typical of the PSR; let us take $a=b=1.8\;{\rm cm},$ $\omega_{0}=2\pi*2.8\;{\rm MHz},$ $\omega_{\beta}=2.2*\omega_{0},$ $2\pi R=89\;{\rm m}$ If we express the number of particles in the ring as $N_{p}={\cal N}\times 10^{13},$ (36) then we can compute $\omega^{2}_{e}=1.76*{\cal N}*10^{17}\;{\rm sec}^{-2},$ (37) and $\omega^{2}_{p}=0.5182*F*{\cal N}*10^{14}\;{\rm sec}^{-2}.$ (38) In the PSR the measured vertical chromaticity is about $-1.68$ and the energy spread (typical conditions) is about $0.5\%$ so we take the chromatic tune spread to be about $0.009$, i.e. a fractional tune spread of $0.43$%, then $\Gamma_{d}\approx 0.0252*10^{6}\;{\rm sec}^{-1}.$ (39) We take the frequency shift to be $\omega_{s}\approx\omega_{\beta}=3.9*10^{7}\;{\rm sec}^{-1}.$ (40) To estimate $g_{max}$ we use equation 18, setting the maximum transverse energy to the beam potential; the result is $g_{max}\approx 3.48*{\cal N}*10^{17}\;{\rm sec}^{-2},$ (41) where we used $x_{0}\approx a=1.8$ cm. Note that we simply ignore $g_{min}$, i.e. assume it is zero; it only modifies our results by a small factor. If we evaluate the threshold condition, equation 34, using equations 37, 38, 39, 40, and 41 we find the criterion for instability to be $F*{\cal N}>0.188;$ (42) in other words, once the product of the particle number (times $10^{13}$) and percent neutralization is about $19.0$, we can expect instability. Recall that the neutralization fraction in quadrupoles will be about $20$ times higher than $F$ since quadrupoles are only about $10$% of the ring and only half the electrons can move vertically. At threshold the growth time is infinite, but if, for simplicity, we assume that we are a factor of $2$ above the threshold, $F*{\cal N}=9.4*10^{-2}$, then using 37, 38, 39, 40, and 41 in equation 35 we find $\gamma_{\rm growth}\approx 12.6\;{\rm KHz},$ (43) i.e. a growth time of about $222$ turns. These estimates are only intended to show that the results seem to be within a factor of two or three of the observations and that the theory is thus a possible explanation of the observed instability. ## 3 Discussion Our results show that electrons trapped in quadrupoles are a plausible explanation of the two-stream instability observed in the PSR. The growth times found are considerably closer to the observed values than the linear growth times derived from the instability treatment for electrons in drift spaces, [10]. The reason for this is that the electrons confined in quadrupoles have a very large frequency spread due to the wide variation in magnetic bounce frequencies as compared to those in drift spaces which have only a very small spread in space charge confinement bounce frequencies. Thus, many fewer electrons are resonant at a particular frequency. In addition, if the instability is due to electrons trapped in quadrupoles, then the transverse momentum kick given to the protons is easily explained; the momentum is transferred from the quadrupoles via the electrons, rather than having to be transferred only from electrons, as in the drift space theory. Clearly a great deal more work can be done to refine this model. A kinetic description of the proton beam could be used, and would give a more sensitive dependence of the phase-mixing damping that depends on the detailed proton distribution. An investigation of different electron distribution functions, perhaps motivated by detailed simulation of electron formation and capture dynamics, would give threshold and growth rate estimates that are better founded than those in this note. The formulation of a bunched beam model would be considerably more difficult, but might be worthwhile. Finally, a composite model with both drift space electrons and quadrupole trapped electrons would be very difficult to analyze but might be necessary to fit all observations in real machines. ## References * [1] George P. Lawrence, Proceedings of the 1987 Particle Accelerator Conference, Washington, DC (IEEE, Piscataway, NJ, 1987), p. 825. * [2] D. Neuffer, E. Colton, D. Fitzgerald, T. Hardek, R. Hutson, R. Macek, M. Plum, H. Thiessen, and T.-S Wang, Nucl. Instrum. Methods Phys. Res., Sect. A 321, 1 (1992). * [3] R. Macek, A. Browman, D. Fitzgerald, R. McCrady, F. Merrill, M. Plum, T. Spickermann, T. S. Wang, J. Griffin, K. Y. Ng, D. Wildman, K. Harkay, R. Custom, and R. Rosenberg, Proceedings of the 2001 Particle Accelerator Conference, Chicago, IL (IEEE, Piscataway, NJ, 2001), p. 688. * [4] R. J. Macek, M. Borden, A. Browman, D. Fitzgerald, T. S. Wang, T. Zaugg, K. Harkay, and R. A. Rosenberg, Proceedings of the 2003 Particle Accelerator Conference, Portland, OR (IEEE, Piscataway, NJ, 2003), p. 508. * [5] M. Plum, J. Allen, M. Borden, D. Fitzgerald, R. Macek, and T. S. Wang, Proceedings of 1995 Particle Accelerator Conference, Dallas, Texas (IEEE, Piscataway, NJ, 1996), p. 3406. * [6] M. A. Plum, D. H. Fitzgerald, D. Johnson, J. Langenbrunner, R. J. Macek, F. Merrill, P. Morton, B. Prichard, O. Sander, M. Shulze, H. A. Thiessen, T. S. Wang, and C. A. Wilkinson, Proceedings of the 1997 Particle Accelerator Conference, Vancouver, Canada (IEEE, Piscataway, NJ, 1998), p. 1611. * [7] R. J. Macek, Proceedings of ECLOUD’02 Workshop, Geneva, edited by G. Rumolo, p. 259 (CERN-2002-001). * [8] R. J. Macek, A. A. Browman, M. J. Borden, D. H. Fitzgerald, R. C. McCrady, T. Spickermann, and T. J. Zaugg, Proceedings of ECLOUD’04, Napa, California, 2004, edited by M. Furman, p. 63 (CERN-2005-001). * [9] R. J. Macek and A. A. Browman, Proceedings of the 2005 Particle Accelerator Conference, Knoxville, TN, 2005 (IEEE, Piscataway, NJ, 2005), p. 2047. * [10] Paul J. Channell, ‘Phenomenological two-stream instability model in the nonlinear electron regime’ Phys. Rev. ST Accel. Beams 5, 114401 (2002) * [11] M. T. F. Pivi and M. A. Furman, Phys. Rev. ST Accel. Beams 6, 034201 (2003). * [12] N.A. Krall and A.W. Trivelpiece, Principles of Plasma Physics, McGraw-Hill, New York, (1973). * [13] E. Keil and B. Zotter, ‘Landau-Damping of Coupled Electron-Proton Oscillations’, CERN Internal Note CERN-ISR-TH/71-58, December 1971. * [14] Paul J. Channell, ‘Systematic solution of the Vlasov-Poisson equations for charged particle beams’, Phys. Plasmas 6, 982 (1999) * [15] R.A. Bosch, Nucl. Instrum. and Meth. A 450,(2000) p 223. * [16] R.J. Macek, private communication (2008).
arxiv-papers
2009-03-19T16:02:26
2024-09-04T02:49:01.251212
{ "license": "Public Domain", "authors": "Paul J. Channell", "submitter": "Paul Channell", "url": "https://arxiv.org/abs/0903.3355" }
0903.3357
# Equivariant Yamabe problem and Hebey–Vaugon conjecture Farid Madani Institut de Mathématiques de Jussieu, Université Pierre et Marie Curie Équipe: d’Analyse Complexe et Géométrie 175, rue Chevaleret 75013 Paris, France. madani@math.jussieu.fr ###### Abstract. In their study of the Yamabe problem in the presence of isometry group, E. Hebey and M. Vaugon announced a conjecture. This conjecture generalizes T. Aubin’s conjecture, which has already been proven and is sufficient to solve the Yamabe problem. In this paper, we generalize Aubin’s theorem and we prove the Hebey–Vaugon conjecture in some new cases. ###### Key words and phrases: Conformal metric; Isometry group; Scalar curvature; Yamabe problem. ###### 1991 Mathematics Subject Classification: 53A30, 53C21, 35J20. ## 1\. Introduction Let $(M,g)$ be a compact Riemannian manifold of dimension $n\geq 3$. Denote by $I(M,g)$, $C(M,g)$ and $R_{g}$ the isometry group, the conformal transformations group and the scalar curvature, respectively. Let $G$ be a subgroup of the isometry group $I(M,g)$. E. Hebey and M. Vaugon[5] considered the following problem: ### Hebey–Vaugon problem _Is there some $G-$invariant metric $g_{0}$ which minimizes the functional_ $J(g^{\prime})=\frac{\int_{M}R_{g^{\prime}}\mathrm{d}v(g^{\prime})}{(\int_{M}\mathrm{d}v(g^{\prime}))^{\frac{n-2}{n}}}$ _where $g^{\prime}$ belongs to the $G-$invariant conformal class of metrics $g$ defined by:_ $[g]^{G}:=\\{\tilde{g}=e^{f}g/f\in C^{\infty}(M),\;\sigma^{*}\tilde{g}=\tilde{g}\quad\forall\sigma\in G\\}$ The positive answer would have two consequences. The first is that there exists an $I(M,g)-$invariant metric $g_{0}$ conformal to $g$ such that the scalar curvature $R_{g_{0}}$ is constant. The second is that the A. Lichnerowicz’s conjecture [7], stated below, is true. By the works of J. Lelong-Ferrand[6] and M. Obata[9], we know that if $(M,g)$ is not conformal to $(S_{n},g_{can})$ (the unit sphere endowed with its standard metric $g_{can}$), then $C(M,g)$ is compact and there exists a conformal metric $g^{\prime}$ to $g$ such that $I(M,g^{\prime})=C(M,g)$. This implies that the first consequence is equivalent to the ### A. Lichnerowicz conjecture _For every compact Riemannian manifold $(M,g)$ which is not conformal to the unit sphere $S_{n}$ endowed with its standard metric, there exists a metric $\tilde{g}$ conformal to $g$ for which $I(M,\tilde{g})=C(M,g)$, and the scalar curvature $R_{\tilde{g}}$ is constant._ To such metrics correspond functions which are necessarily solutions of the Yamabe equation. In other words, if $\tilde{g}=\psi^{\frac{4}{n-2}}g$, $\psi$ is a $G-$invariant smooth positive function then $\psi$ satisfies $\frac{4(n-1)}{n-2}\Delta_{g}\psi+R_{g}\psi=R_{\tilde{g}}\psi^{\frac{n+2}{n-2}}.$ The classical Yamabe problem, which consists to find a conformal metric with constant scalar curvature on a compact Riemannian manifold, is the particular case of the problem above when $G=\\{\mathrm{id}\\}$. Denote by $O_{G}(P)$ the orbit of $P\in M$ under $G$, $W_{g}$ the Weyl tensor associated to the manifold $(M,g)$ and $\omega_{n}$ the volume of the unit sphere $S_{n}$. We define the integer $\omega(P)$ at the point $P$ as $\omega(P)=\inf\\{i\in\mathbb{N}/\|\nabla^{i}W_{g}(P)\|\neq 0\\}\;(\omega(P)=+\infty\text{ if }\forall i\in\mathbb{N},\;\|\nabla^{i}W_{g}(P)\|=0)$ ### Hebey–Vaugon conjecture _Let $(M,g)$ be a compact Riemannian manifold of dimension $n\geq 3$ and $G$ be a subgroup of $I(M,g)$. If $(M,g)$ is not conformal to $(S_{n},g_{can})$ or if the action of $G$ has no fixed point, then the following inequality holds _ (1) $\inf_{g^{\prime}\in[g]^{G}}J(g^{\prime})<n(n-1)\omega_{n}^{2/n}(\inf_{Q\in M}\mathrm{card}O_{G}(Q))^{2/n}$ ###### Remarks 1.1. 1. (1) This conjecture is the generalization of the former T. Aubin’s conjecture [1] for the Yamabe problem corresponding to $G=\\{\mathrm{id}\\}$, where the constant in the right side of the inequality is equal to $\inf_{g^{\prime}\in[g_{can}]}J(g^{\prime})$ for $S_{n}$. In this case, the conjecture is completely proved. 2. (2) The inequality is obvious if $\inf_{g^{\prime}\in[g]^{G}}J(g^{\prime})$ is nonpositive, it is the case when there exists a Yamabe metric with nonpositive scalar curvature. 3. (3) If for any $Q\in M$, $\mathrm{card}O_{G}(Q)=+\infty$ then this conjecture is also obvious. The only results known about this conjecture are given in the following theorem: ###### Theorem 1.1 (E. Hebey and M. Vaugon). Let $(M,g)$ be a smooth compact Riemannian manifold of dimension $n\geq 3$ and $G$ be a subgroup of $I(M,g)$. We always have : $\inf_{g^{\prime}\in[g]^{G}}J(g^{\prime})\leq n(n-1)\omega_{n}^{2/n}(\inf_{Q\in M}\mathrm{card}O_{G}(Q))^{2/n}$ and inequality (1) holds if one of the following items is satisfied. 1. (1) The action of $G$ on $M$ is free 2. (2) $3\leq\dim M\leq 11$ 3. (3) There exists a point $P$ with minimal orbit (finite) under $G$ such that $\omega(P)>(n-6)/2$ or $\omega(P)\in\\{0,1,2\\}$. The case $\omega=3$ was studied by A. Rauzy (private communications). In this prove we prove the following results: ### Main theorem _The Hebey–Vaugon conjecture holds if there exists a point $P\in M$ with minimal orbit (finite) for which $\omega(P)\leq 15$ or if the degree of the leading part of $R_{g}$ is greater or equal to $\omega(P)+1$, in the neighborhood of this point $P$._ ###### Corollary 1.1. Hebey–Vaugon conjecture holds for every smooth compact Riemannian manifold $(M,g)$ of dimension $n\in[3,37]$. To prove the main theorem, we need to construct a $G-$invariant test function $\phi$ such that $I_{g}(\phi)<n(n-1)\omega_{n}^{2/n}(\inf_{Q\in M}\mathrm{card}O_{G}(Q))^{2/n}$ Thus, all the difficulties are in the construction of a such function. For some cases, we can use the test functions constructed by T. Aubin [1] and R. Schoen [10] in the case of Yamabe problem. They have been already proven by E. Hebey and M. Vaugon [5]. But the item 3, presented in Theorem 1.1, uses test functions different than T. Aubin and R. Schoen ones. We multiply T. Aubin’s test function $u_{\varepsilon,P}$ by a function as follows: (2) $\varphi_{\varepsilon}(Q)=(1-r^{\omega+2}f(\xi))u_{\varepsilon,P}(Q)$ (3) $u_{\varepsilon,P}(Q)=\begin{cases}\biggl{(}\displaystyle\frac{\varepsilon}{r^{2}+\varepsilon^{2}}\biggr{)}^{\frac{n-2}{2}}-\biggl{(}\frac{\varepsilon}{\delta^{2}+\varepsilon^{2}}\biggr{)}^{\frac{n-2}{2}}&\mbox{ if }Q\in B_{P}(\delta)\\\ 0&\mbox{ if }Q\in M-B_{P}(\delta)\end{cases}$ for all $Q\in M$, where $r=d(Q,P)$ is the distance between $P$ and $Q$. $(r,\xi^{j})$ is a geodesic coordinates system in the neighborhood of $P$ and $B_{P}(\delta)$ is the geodesic ball of center $P$ with radius $\delta$ fixed sufficiently small. $f$ is a function depending only on $\xi$, chosen such that $\int_{S_{n-1}}fd\sigma=0$. Without loss of generality, we suppose that in the coordinates system $(r,\xi^{j})$ we have $\det g=1+o(r^{m})$ for $m\gg 1$. In fact, E. Hebey and M. Vaugon proved that there exists $\tilde{g}\in[g]^{G}$ for which $\det\tilde{g}=1+o(r^{m})$ and $\inf_{g^{\prime}\in[g]^{G}}J(g^{\prime})$ does not depend on the conformal $G-$invariant metric. ## 2\. Computation of $\int_{M}R_{g}\varphi_{\varepsilon}^{2}dv$ Let be $I_{a}^{b}(\varepsilon)=\int_{0}^{\delta/\varepsilon}\frac{t^{b}}{(1+t^{2})^{a}}dt\text{ and }I_{a}^{b}=\lim_{\varepsilon\to 0}I_{a}^{b}(\varepsilon)$ then $I_{a}^{2a-1}(\varepsilon)=\log\varepsilon^{-1}+O(1)$. If $2a-b>1$ then $I_{a}^{b}(\varepsilon)=I_{a}^{b}+O(\varepsilon^{2a-b-1})$ and by integration by parts, we establish the following relationships : (4) $I_{a}^{b}=\frac{b-1}{2a-b-1}I_{a}^{b-2}=\frac{b-1}{2a-2}I_{a-1}^{b-2}=\frac{2a-b-3}{2a-2}I_{a-1}^{b},\quad\frac{4(n-2)I_{n}^{n+1}}{(I^{n-2}_{n})^{(n-2)/n}}=n$ Using the inequality $(a-b)^{\beta}\geq a^{\beta}-\beta a^{\beta-1}b$ for $0<b<a$, we have for $\beta\geq 2$, $0\leq\alpha<(n-2)(\beta-1)-n$ (5) $\int_{M}r^{\alpha}u_{\varepsilon,P}^{\beta}\mathrm{d}v=\omega_{n-1}I_{(n-2)\beta/2}^{\alpha+n-1}\varepsilon^{\alpha+n-\beta(n-2)/2}+O(\varepsilon^{n-2})$ This integral appears frequently in the following computations, and it allows us to neglect the constant term in the expression of $u_{\varepsilon}$, when we choose $\delta$ sufficiently small and $\varepsilon$ smaller than $\delta$. Denote by $I_{g}$ the Yamabe functional defined for all $\psi\in H^{1}(M)$ by (6) $I_{g}(\psi)=\biggr{(}\int_{M}|\nabla_{g}\psi|^{2}\mathrm{d}v+\frac{(n-2)}{4(n-1)}\int_{M}R_{g}\psi^{2}\mathrm{d}v\biggl{)}\|\psi\|_{N}^{-2}$ where $N=2n/(n-2)$ and $\nabla_{g}$ is the gradient of the metric $g$. The second integral of the functional $I_{g}$ with the scalar curvature term needs a special consideration. Let $\mu(P)$ be an integer defined as follows : $|\nabla_{\beta}R_{g}(P)|=0$ for all $|\beta|<\mu(P)$ and there exists $\gamma\in\mathbb{N}^{\mu(P)}$ such that $|\nabla_{\gamma}R_{g}(P)|\neq 0$ then $R_{g}(Q)=\bar{R}+O(r^{\mu(P)+1})$ where $\bar{R}=r^{\mu(P)}\sum_{|\beta|=\mu}\nabla_{\beta}R_{g}(P)\xi^{\beta}$ is a homogeneous polynomial of degree $\mu(P)$, the $\beta$ are multi-indices. For simplicity, we drop the letter $P$ in $\omega(P)$ and $\mu(P)$. By E. Hebey and M. Vaugon [5] results: ###### Lemma 2.1. $\mu\geq\omega$, $g_{ij}=\delta_{ij}+O(r^{\omega+2})$ and $\bar{\int}_{S(r)}R_{g}=O(r^{2\omega+2})$ which implies that $\int_{S(r)}\bar{R}d\sigma=\leavevmode\nobreak\ 0$ when $\mu<2\omega+2$ $\bar{\int}$ denotes the average. Then (7) $\begin{split}\int_{M}R_{g}\varphi_{\varepsilon}^{2}\mathrm{d}v&=\int_{M}R_{g}u_{\varepsilon,P}^{2}\mathrm{d}v-2\int_{M}fu_{\varepsilon,P}^{2}R_{g}r^{\omega+2}\mathrm{d}v+\int_{M}f^{2}u_{\varepsilon,P}^{2}R_{g}r^{2\omega+4}\mathrm{d}v\\\ &=\varepsilon^{2\omega+4}\omega_{n-1}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma I_{n-2}^{n+2\omega+1}(\varepsilon)-\\\ &2\varepsilon^{\omega+\mu+4}I_{n-2}^{\omega+\mu+n+1}(\varepsilon)\omega_{n-1}\bar{\int}_{S(r)}r^{-\mu}f(\xi)\bar{R}\mathrm{d}\sigma(\xi)+O(\varepsilon^{n-2})\\\ \end{split}$ Moreover T. Aubin [2] proved that: ###### Theorem 2.1. If $\mu\geq\omega+1$ then there exists $C(n,\omega)>0$ such that $\bar{\int}_{S_{n-1}(r)}R\mathrm{d}\sigma=C(n,\omega)(-\Delta_{g})^{\omega+1}R(P)r^{2\omega+2}+o(r^{2\omega+2})$ $(-\Delta_{g})^{\omega+1}R(P)$ is negative. Then $I_{g}(u_{\varepsilon,P})<\frac{n(n-2)}{4}\omega_{n-1}^{2/n}$. From now until the end of this section, we make the assumption that $\mu=\omega$. Now, we recall some results obtained by T. Aubin in his papers [3, 4]: $\bar{R}$ is homogeneous polynomial of degree $\omega$ then $\Delta_{\mathcal{E}}\bar{R}$ is homogeneous of degree $\omega-2$ and $\Delta_{\mathcal{E}}\bar{R}=r^{-2}(\Delta_{s}\bar{R}-\omega(n+\omega-2)\bar{R})$ where $\Delta_{\mathcal{E}}$ is the Euclidean Laplacian and $\Delta_{s}$ is the Laplacian on the sphere $S_{n-1}$. $\Delta_{\mathcal{E}}^{k-1}\bar{R}$ is homogeneous of degree $\omega-2k+2$ and $\Delta^{k}_{\mathcal{E}}\bar{R}=r^{-2}(\Delta_{s}-\nu_{k}\mathrm{id})\Delta^{k-1}_{\mathcal{E}}\bar{R}=r^{-2k}\prod_{p=1}^{k}(\Delta_{S}-\nu_{p}\mathrm{id})\bar{R}$ with (8) $\nu_{k}=(\omega-2k+2)(n+\omega-2k)$ The sequence of integers $(\nu_{k})_{\\{1\leq k\leq[\omega/2]\\}}$ is decreasing. It will play the role of the eigenvalues of the Laplacian on the sphere $S_{n-1}$. It is known that the eigenvalues of the geometric Laplacian are non-negative and increasing. Our $\nu_{k}$ are in the opposite order. We know by T. Aubin’s paper [2] that $\Delta^{[\omega/2]}_{\mathcal{E}}\bar{R}=0$ and $\int_{S(r)}\bar{R}\mathrm{d}\sigma=0$, then $q=\min\\{k\in\mathbb{N}/\Delta_{\mathcal{E}}^{k}\bar{R}=0\\}$ is well defined and $r^{-\omega}\bar{R}\in\bigoplus_{k=1}^{q}E_{k}$, with $E_{k}$ the eigenspace associated to the positive eigenvalues $\nu_{k}$ of the Laplacian $\Delta_{s}$ on the sphere $S_{n-1}$. If $j\neq k$, then $E_{k}$ is orthogonal to $E_{j}$, for the standard scalar product in $H_{1}^{2}(S_{n-1})$. Moreover, since $\int\bar{R}d\sigma=0$ there exist $\varphi_{k}\in E_{k}$ (eigenfunctions of $\Delta_{s}$) such that (9) $\bar{R}=r^{\omega}\Delta_{s}\sum_{k=1}^{q}\varphi_{k}=r^{\omega}\sum_{k=1}^{q}\nu_{k}\varphi_{k}$ According to Lemma 2.1, we can split the metric $g$ in the following way: (10) $g=\mathcal{E}+h$ where $\mathcal{E}$ is the Euclidean metric and $h$ is a symmetric 2-tensor defined in our geodesic coordinates system by (11) $h_{ij}=r^{\omega+2}\bar{g}_{ij}+r^{2(\omega+2)}\hat{g}_{ij}+\tilde{h}_{ij}\text{ and }h_{ir}=h_{rr}=0$ where $\bar{g}$, $\hat{g}$ and $\tilde{h}$ are symmetric 2-tensors defined on the sphere $S_{n-1}$. We denote by $s$ the standard metric on the sphere, $\nabla$, $\Delta$ are the associated gradient and Laplacian on $S_{n-1}$. By straightforward computations, Aubin [3] proved that: ###### Lemma 2.2. $\bar{R}=\nabla^{ij}\bar{g}_{ij}r^{\omega}\text{ and }$ $\bar{\int}_{S_{n-1}(r)}R\mathrm{d}\sigma=[B/2-C/4-(1+\omega/2)^{2}Q]r^{2(\omega+1)}+o(r^{2(\omega+1)})$ where $B=\bar{\int}_{S_{n-1}}\nabla^{i}\bar{g}^{jk}\nabla_{j}\bar{g}_{ik}\mathrm{d}\sigma$, $C=\bar{\int}_{S_{n-1}}\nabla^{i}\bar{g}^{jk}\nabla_{i}\bar{g}_{jk}\mathrm{d}\sigma$ and $Q=\bar{\int}_{S_{n-1}}\bar{g}_{ij}\bar{g}^{ij}\mathrm{d}\sigma$ For further details refer to [8]. The integrals $Q$, $B$ and $C$ are given in terms of the tensor $\bar{g}$. Our goal is to compute them using the eigenfunctions $\varphi_{k}$ above. Let us define $b_{ij}=\sum_{k=1}^{q}\frac{1}{(n-2)(\nu_{k}+1-n)}[(n-1)\nabla_{ij}\varphi_{k}+\nu_{k}\varphi_{k}s_{ij}]$ and $a_{ij}$ such that $\bar{g}_{ij}=a_{ij}+b_{ij}$ then, according to (9), we check that (12) $\bar{R}=\bar{R}_{b}=\nabla^{ij}b_{ij}r^{\omega}\quad\text{and }\bar{R}_{a}=\nabla^{ij}a_{ij}r^{\omega}=0$ If $\bar{g}_{ij}=a_{ij}$ then $\bar{R}=\bar{R}_{a}=0$ and $\mu\geq\omega+1$. By Theorem 2.1 $\bar{\int}_{S_{n-1}(r)}R\mathrm{d}\sigma=\bar{\int}_{S_{n-1}(r)}R_{a}\mathrm{d}\sigma<0$ If $\bar{g}_{ij}=b_{ij}$ then $\bar{\int}_{S_{n-1}(r)}R\mathrm{d}\sigma=\bar{\int}_{S_{n-1}(r)}R_{b}\mathrm{d}\sigma=[B_{b}/2-C_{b}/4-(1+\omega/2)^{2}Q_{b}]r^{2(\omega+1)}+o(r^{2(\omega+1)})$ where $B_{b}$, $C_{b}$ and $Q_{b}$ are the same integrals defined in Lemma 2.2 when the considered tensor $\bar{g}_{ij}=b_{ij}$. We compute them in terms of $\varphi_{k}$ $\displaystyle Q_{b}=\bar{\int}_{S_{n-1}}\bar{b}_{ij}\bar{b}^{ij}\mathrm{d}\sigma=\frac{n-1}{n-2}\sum_{k=1}^{q}\frac{\nu_{k}}{\nu_{k}-n+1}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ $\displaystyle B_{b}=-(n-1)Q_{b}+\sum_{k=1}^{q}\nu_{k}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ $\displaystyle C_{b}=-(n-1)Q_{b}+\frac{n-1}{n-2}\sum_{k=1}^{q}\nu_{k}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ To find these expressions, we used several times the identity $\nabla^{i}b_{ij}=-\sum_{k=1}^{q}\nabla_{j}\varphi_{k}$ and Stokes formula (more details are given in [3, 4] and [8]). In the general case, we deduce that ###### Lemma 2.3. If $\mu=\omega$ and $\bar{g}_{ij}=a_{ij}+b_{ij}$, where $b_{ij}$ is defined above, (13) $\bar{\int}_{S_{n-1}(r)}R\mathrm{d}\sigma=\bar{\int}_{S_{n-1}(r)}R_{a}+R_{b}\mathrm{d}\sigma\leq[B_{b}/2-C_{b}/4-(1+\omega/2)^{2}Q_{b}]r^{2(\omega+1)}+o(r^{2(\omega+1)})$ and (14) $B_{b}/2-C_{b}/4-(1+\omega/2)^{2}Q_{b}=\sum_{k=1}^{q}u_{k}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ with (15) $u_{k}=\biggl{(}\frac{n-3}{4(n-2)}-\frac{(n-1)^{2}+(n-1)(\omega+2)^{2}}{4(n-2)(\nu_{k}-n+1)}\biggr{)}\nu_{k}$ $u_{k}$ is obtained using the expressions of $Q_{b}$, $B_{b}$ and $C_{b}$ above. ## 3\. Generalization of T. Aubin’s theorem ###### Theorem 3.1. If there exists $P\in M$ such that $\omega(P)\leq(n-6)/2$ then there exists $f\in C^{\infty}(S_{n-1})$ with vanishing mean integral such that $I_{g}(\varphi_{\varepsilon})<\frac{n(n-2)}{4}\omega_{n-1}^{2/n}$ The case $\omega=0$ of the this theorem has already been proven by T. Aubin [1]. He also proved the theorem when $\mu\geq\omega+1$ (see Theorem 2.1). From now until the end of this paper, we drop the letter $P$ in $\omega(P)$ and $\mu(P)$. ###### Proof. If $\mu\geq\omega+1$ then the inequality holds by Theorem 2.1. So we suppose that $\mu=\omega$ until the end of the proof. We start by computing the first integral of the Yamabe functional (6) with $\psi=\varphi_{\varepsilon}$. Using formula $|\nabla_{g}\varphi_{\varepsilon}|^{2}=(\partial_{r}\varphi_{\varepsilon})^{2}+r^{-2}|\nabla_{s}\varphi_{\varepsilon}|^{2}$, we obtain: $\int_{M}|\nabla_{g}\varphi_{\varepsilon}|^{2}\mathrm{d}v=\int_{M}|\nabla_{g}u_{\varepsilon,P}|^{2}\mathrm{d}v+\int_{0}^{\delta}[\partial_{r}(r^{(\omega+2)}u_{\varepsilon,P})]^{2}r^{n-1}\mathrm{d}r\int_{S_{n-1}}f^{2}\mathrm{d}\sigma+\\\ \int_{0}^{\delta}u^{2}_{\varepsilon,P}r^{n+2\omega+1}\mathrm{d}r\int_{S_{n-1}}|\nabla f|^{2}\mathrm{d}\sigma$ The substitution $t=r/\varepsilon$ gives (16) $\int_{M}|\nabla_{g}\varphi_{\varepsilon}|^{2}\mathrm{d}v=(n-2)^{2}\omega_{n-1}I_{n}^{n+1}(\varepsilon)+\varepsilon^{2\omega+4}\biggl{\\{}\int_{S_{n-1}}|\nabla f|^{2}\mathrm{d}\sigma I_{n-2}^{2\omega+n+1}(\varepsilon)+\\\ \int_{S_{n-1}}f^{2}\mathrm{d}\sigma[(\omega-n+4)^{2}I_{n}^{2\omega+n+5}(\varepsilon)+2(\omega+2)(\omega-n+4)I_{n}^{2\omega+n+3}(\varepsilon)+(\omega+2)^{2}I_{n}^{2\omega+n+1}(\varepsilon)]\biggr{\\}}$ For $\|\varphi_{\varepsilon}\|_{N}^{-2}$, we need to compute the Taylor expansion of : $\varphi_{\varepsilon}^{N}(Q)=[1-Nr^{\omega+2}f(\xi)+\frac{N(N-1)}{2}r^{2\omega+4}f^{2}(\xi)+o(r^{2\omega+4})]u_{\varepsilon,P}^{N}$ Using the fact that $\int_{S_{n-1}}f\mathrm{d}\sigma(\xi)=0$ and formula (5), we conclude that $\begin{split}\|\varphi_{\varepsilon}\|_{N}^{N}&=\int_{0}^{\delta}\int_{S_{n-1}}[1+\frac{N(N-1)}{2}r^{2(\omega+2)}f^{2}(\xi)+o(r^{2\omega+4})]r^{n-1}u^{N}_{\varepsilon,P}\mathrm{d}r\mathrm{d}\sigma(\xi)\\\ &=\omega_{n-1}I^{n-1}_{n}+\frac{N(N-1)}{2}\varepsilon^{2(\omega+2)}\int_{S_{n-1}}f^{2}\mathrm{d}\sigma I_{n}^{2\omega+n+3}+o(\varepsilon^{2\omega+4})\end{split}$ then (17) $\|\varphi_{\varepsilon}\|_{N}^{-2}=(\omega_{n-1}I^{n-1}_{n})^{-2/N}\bigl{\\{}1\\\ -(N-1)\varepsilon^{2(\omega+2)}\int_{S_{n-1}}f^{2}\mathrm{d}\sigma I_{n}^{2\omega+n+3}/(\omega_{n-1}I^{n-1}_{n})\bigr{\\}}+o(\varepsilon^{2\omega+4})$ By Eqs (16), (17), (7) and the relationship (4), if $n>2\omega+6$ then : $I_{g}(\varphi_{\varepsilon})=\frac{n(n-2)}{4}\omega_{n-1}^{2/n}+(\omega_{n-1}I^{n-1}_{n})^{-2/N}I_{n-2}^{n+2\omega+1}\varepsilon^{2\omega+4}\times\\\ \biggl{\\{}\frac{(n-2)\omega_{n-1}}{4(n-1)}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma-\frac{n-2}{2(n-1)}\int_{S_{n-1}}f(\xi)\bar{R}\mathrm{d}\sigma+\int_{S_{n-1}}|\nabla f|^{2}\mathrm{d}\sigma+\\\ -\frac{n(n-2)^{2}-(\omega+2)^{2}(n^{2}+n+2)}{(n-1)(n-2)}\int_{S_{n-1}}f^{2}\mathrm{d}\sigma\biggr{\\}}+o(\varepsilon^{2\omega+4})$ If $n=2\omega+6$ then $I_{g}(\varphi_{\varepsilon})=\frac{n(n-2)}{4}\omega_{n-1}^{2/n}+(\omega_{n-1}I^{n-1}_{n})^{-2/N}\varepsilon^{2\omega+4}\log\varepsilon^{-1}\times\\\ \biggl{\\{}\frac{(n-2)\omega_{n-1}}{4(n-1)}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma-\frac{n-2}{2(n-1)}\int_{S_{n-1}}f(\xi)\bar{R}\mathrm{d}\sigma+\\\ \int_{S_{n-1}}|\nabla f|^{2}\mathrm{d}\sigma+(\omega+2)^{2}\int_{S_{n-1}}f^{2}\mathrm{d}\sigma\biggr{\\}}+O(\varepsilon^{2\omega+4})$ For further details refer to [8]. Let $I_{S}$ be the functional defined for a function $f$ on the sphere $S_{n-1}$, with zero mean integral , by $I_{S}(f)=\bar{\int}_{S_{n-1}}4(n-1)(n-2)|\nabla f|^{2}-[4n(n-2)^{2}-4(\omega+2)^{2}(n^{2}+n+2)]f^{2}+\\\ -2(n-2)^{2}f\bar{R}\mathrm{d}\sigma$ This implies that if $n>2\omega+6$ (18) $I_{g}(\varphi_{\varepsilon})=\frac{n(n-2)}{4}\omega_{n-1}^{2/n}+\frac{\omega_{n-1}^{2/n}I_{n-2}^{n+2\omega+1}\varepsilon^{2\omega+4}}{4(n-1)(n-2)(I^{n-1}_{n})^{2/N}}\times\\\ \\{(n-2)^{2}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma+I_{S}(f)\\}+o(\varepsilon^{2\omega+4})$ and if $n=2\omega+6$ (19) $I_{g}(\varphi_{\varepsilon})=\frac{n(n-2)}{4}\omega_{n-1}^{2/n}+\frac{\omega_{n-1}^{2/n}I_{n-2}^{n+2\omega+1}\varepsilon^{2\omega+4}\log\varepsilon^{-1}}{4(n-1)(n-2)(I^{n-1}_{n})^{2/N}}\times\\\ \\{(n-2)^{2}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma+I_{S}(f)\\}+O(\varepsilon^{2\omega+4})$ Notice that if $k\neq j$ then $I_{S}(\varphi_{k}+\varphi_{j})=I_{S}(\varphi_{k})+I_{S}(\varphi_{j})$. Indeed, $\varphi_{k}$ and $\varphi_{j}$ are orthogonal for the standard scalar product in $H_{1}^{2}(S_{n-1})$. $\begin{split}I_{S}(c_{k}\nu_{k}\varphi_{k})&=\bigl{\\{}d_{k}c_{k}^{2}-2(n-2)^{2}c_{k}\bigr{\\}}\nu_{k}^{2}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma\\\ &=-\frac{(n-2)^{4}}{d_{k}}\nu_{k}^{2}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma\end{split}$ where $d_{k}=4[(n-1)(n-2)\nu_{k}-n(n-2)^{2}+(\omega+2)^{2}(n^{2}+n+2)]\text{ and }c_{k}=\frac{(n-2)^{2}}{d_{k}}$ Using (8), we can check easily that $d_{k}$ is positive for any $1\leq k\leq[\omega/2]$. Now, let us consider $f=\sum_{1}^{q}c_{k}\nu_{k}\varphi_{k}$. Then $I_{S}(f)=-\sum_{1}^{q}\frac{(n-2)^{4}}{d_{k}}\nu_{k}^{2}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ and by Lemma 2.3 $(n-2)^{2}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma+I_{S}(f)\leq\sum_{1}^{q}(u_{k}(n-2)^{2}-\frac{(n-2)^{4}}{d_{k}}\nu_{k}^{2})\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma+o(1)$ The following lemma implies that $I_{g}(\varphi_{\varepsilon})<\frac{n(n-2)}{4}\omega_{n-1}^{2/n}$ ∎ ###### Lemma 3.1. For any $k\leq q\leq[\omega/2]$ the following inequality holds $u_{k}-\frac{(n-2)^{2}}{d_{k}}\nu_{k}^{2}<0$ ###### Proof. Recall the expression of $\nu_{k}$ given in (8). The sequence $(U_{k})$ defined by $U_{k}:=(\nu_{k}-n+1)d_{k}\\{(n-2)\frac{u_{k}}{\nu_{k}}-\frac{(n-2)^{3}}{d_{k}}\nu_{k}\\}$ is polynomial decreasing in $\nu_{k}$ when $\nu_{k}\geq 0$. In fact, $U_{k}=P(\nu_{k})$ with $P$ the decreasing polynomial in $\mathbb{R}_{+}$, defined by $P(x)=[(n-1)(n-2)x-n(n-2)^{2}+(\omega+2)^{2}(n^{2}+n+2)]\times\\\ [(n-3)(x-n+1)-(n-1)^{2}-(n-1)(\omega+2)^{2}]-(n-2)^{3}(x^{2}-(n-1)x)$ The derivative of $P$ is $P^{\prime}(x)=-2(n-2)x-2n(n-2)^{3}+2(n^{2}-3n-2)(\omega+2)^{2}$ By assumption $\omega+2\leq(n-2)/2$ then $P$ is decreasing in $\mathbb{R}_{+}$. Hence $U_{k}=P(\nu_{k})\leq P(\nu_{\omega/2})=U_{\omega/2}$ for all $k\leq\omega/2$. It easy to check that $u_{\omega/2}$ is negative so $U_{k}\leq U_{\omega/2}<0$. ∎ ## 4\. Proof of the main theorem By Remarks 1.1, we consider only the positive case (i.e., $\inf_{g^{\prime}\in[g]^{G}}J(g^{\prime})>0$) and the case when there exists $P\in M$ such that $O_{G}(P)=\\{P_{i}\\}_{1\leq i\leq m},\;\;m=\mathrm{card}O_{G}(P)=\inf_{Q\in M}\mathrm{card}O_{G}(Q),\;\omega\leq\frac{n-6}{2}\text{ and }P_{1}=P$ Let $\tilde{\varphi}_{\varepsilon,i}$ be a function defined as follows: (20) $\tilde{\varphi}_{\varepsilon,i}(Q)=(1-r_{i}^{\omega+2}f_{i}(\xi))u_{\varepsilon,P_{i}}(Q)$ where $r_{i}=d(Q,P_{i})$, the function $u_{\varepsilon,P_{i}}$ is defined as in (3) and $f_{i}$ is defined by: (21) $f_{i}(Q)=cr_{i}^{-\omega}\nabla_{g}^{\omega}R_{(P_{i})}(\exp_{P_{i}}^{-1}Q,\cdots,\exp_{P_{i}}^{-1}Q)$ $\exp_{P_{i}}$ is the exponential map. In a geodesic coordinates system $\\{r,\xi^{j}\\}$ with origin $P$, induced by the exponential map $f_{1}=cr^{-\omega}\bar{R}=c\sum_{k=1}^{q}\nu_{k}\varphi_{k}$ where $\bar{R}$, $\varphi_{k}$ and $\nu_{k}$ are defined in Section 2. Thus the functions $f_{i}$ are defined on the sphere $S_{n-1}$. The choice of the constant $c$ is important. ###### Lemma 4.1. Suppose that $\omega\leq(n-6)/2$. If $\omega\in[3,15]$ or if $\mathrm{deg}\bar{R}\geq\omega+1$ then there exists $c\in\mathbb{R}$ such that the corresponding functions $\tilde{\varphi}_{\varepsilon,i}$ satisfy : (22) $I_{g}(\tilde{\varphi}_{\varepsilon,i})<\frac{1}{4}n(n-2)\omega_{n}^{2/n}$ ###### Remarks 4.1. 1. (1) We proved inequality of this lemma for any $\omega\leq(n-6)/2$, using test function $\varphi_{\varepsilon}$ (see Theorem 3.1). We notice that the difference between $\varphi_{\varepsilon}$ and $\tilde{\varphi}_{\varepsilon,i}$ is on the construction of the corresponding functions $f$ and $f_{i}$ respectively. From $\tilde{\varphi}_{\varepsilon,i}$ we define a $G-$invariant function (see proof of the main theorem below), this property is not possible with the function $\varphi_{\varepsilon}$. 2. (2) For $\omega=16$ and $n$ sufficiently big, we can check that for any $c\in\mathbb{R}$, inequality (22) is false. ###### Proof. 1\. If $\mathrm{deg}\bar{R}\geq\omega+1$, then by Theorem 2.1 $I_{g}(u_{\varepsilon,P_{i}})<\frac{n(n-2)}{4}\omega_{n}^{2/n}$ It is sufficient to take $c=0$, hence $\tilde{\varphi}_{\varepsilon,i}=u_{\varepsilon,P_{i}}$. 2\. If $\mathrm{deg}\bar{R}=\omega$. Using estimates given in the proof of Theorem 3.1 (see (18), (19)), it is sufficient to show that there exists $c\in\mathbb{R}$ such that (23) $I_{S}(f_{1})+(n-2)^{2}\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma_{r}<0$ We keep the notations used in the proof of Theorem 3.1. Thus $I_{S}(f_{1})=\sum_{k=1}^{q}I_{S}(c\nu_{k}\varphi_{k})=\bigl{\\{}d_{k}c^{2}-2(n-2)^{2}c\bigr{\\}}\nu_{k}^{2}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ $\text{and }\bar{\int}_{S(r)}r^{-2\omega-2}R_{g}\mathrm{d}\sigma_{r}=\sum_{k=1}^{q}u_{k}\bar{\int}_{S_{n-1}}\varphi_{k}^{2}\mathrm{d}\sigma$ To prove inequality (23), it is sufficient to prove that (24) $\forall k\leq q\quad\frac{d_{k}}{2(n-2)}c^{2}-(n-2)c+(n-2)\frac{u_{k}}{2\nu_{k}^{2}}<0$ The left side of the inequality above is a second degree polynomial with variable $c$, his discriminant is: (25) $\Delta_{k}=(n-2)^{2}-\frac{d_{k}u_{k}}{\nu_{k}^{2}}$ Using Lemma 3.1, we deduce that for any $k\leq q$, $\Delta_{k}>0$. Hence, the polynomial above admits two different roots denoted $x_{k}<y_{k}$ and given by $x_{k}=\frac{(n-2)^{2}-(n-2)\sqrt{\Delta_{k}}}{d_{k}},\qquad y_{k}=\frac{(n-2)^{2}+(n-2)\sqrt{\Delta_{k}}}{d_{k}}$ Inequality (24) holds if and only if (26) $\bigcap_{k=1}^{q}(x_{k},y_{k})\neq\varnothing$ The sequence $(d_{k})_{k\leq[\omega/2]}$ decreases. It is easy to check that (27) $\forall k<j\leq[\frac{\omega}{2}]\qquad x_{k}<y_{j}$ Hence intersection (26) is not empty if (28) $\forall k<j\leq[\frac{\omega}{2}]\qquad x_{j}<y_{k}$ We also check that if $\omega$ is even, $u_{\omega/2}<0$, which implies $x_{\omega/2}<0$. * $i.$ If $\omega=3$ then $q=1$, intersection above is not empty. It is sufficient to take $c=(x_{1}+y_{2})/2$. * $ii.$ If $\omega=4$ then $k\in\\{1,2\\}$, $x_{2}<0$ (because $u_{2}<0$) and $0<x_{1}<y_{2}$. Hence intersection $]x_{1},y_{1}[\cap]x_{2},y_{2}[$ is not empty. * $iii.$ If $5\leq\omega\leq 15$, it is sufficient to prove (28) which is equivalent to prove that (29) $\forall k<j\leq[\frac{\omega}{2}]\quad(n-2)(d_{j}-d_{k})+d_{k}\sqrt{\Delta_{j}}+d_{j}\sqrt{\Delta_{k}}>0$ Notice that $\Delta_{k}$ given by (25) is a rational fraction in $n$. By straightforward computations, we check that there exists reel numbers $a_{k},\;b_{k},\;e_{k},\;h_{k}$ and $s_{k}$ which depend on $k$ and $\omega$ such that (30) $\displaystyle\Delta_{k}=a_{k}n^{2}+b_{k}n+e_{k}+\frac{h_{k}}{n-2}+\frac{s_{k}}{\nu_{k}+1-n}$ (31) $\displaystyle\sqrt{\Delta_{k}}>\sqrt{a_{k}}(n+\frac{b_{k}}{2a_{k}})$ Inequality (29) holds if we use (31). The expressions of the reel numbers above are known explicitly (we used the software Maple to compute them, see [8]). For simplicity, we omit to give these expressions. ∎ ###### Proof of the main theorem. The orbit of $P$ under the action of $G$ is supposed to be minimal (i.e. $\mathrm{card}O_{G}(P)=\inf_{Q\in M}\mathrm{card}O_{G}(Q)$). Without loss of generality, we suppose that $3\leq\omega\leq(n-6)/2$, because if $\omega>(n-6)/2$ or $\omega\leq 2$, we conclude using Theorem 1.1. From functions $\tilde{\varphi}_{\varepsilon,i}$ defined by (20), we define the function $\phi_{\varepsilon}$ as follows: $\phi_{\varepsilon}=\sum_{k=1}^{m}\tilde{\varphi}_{\varepsilon,i}$ $\phi_{\varepsilon}$ is $G-$invariant. In fact, for any $\sigma\in G$, such that $\sigma(P_{i})=P_{j}$ $u_{\varepsilon,P_{i}}=u_{\varepsilon,P_{j}}\circ\sigma\text{ and }f_{i}=f_{j}\circ\sigma$ $f_{i}$ are defined by (21), we deduce that $\tilde{\varphi}_{\varepsilon,i}=\tilde{\varphi}_{\varepsilon,j}\circ\sigma$ The support of $\tilde{\varphi}_{\varepsilon,i}$ is included in the ball $B_{P_{i}}(\delta)$. We choose $\delta$ sufficiently small such that for all integers $i\neq j$ in $[1,m]$, intersection $B_{P_{j}}(\delta)\cap B_{P_{i}}(\delta)=\varnothing$. Thus $I_{g}(\phi_{\varepsilon})=(\mathrm{card}O_{G}(P))^{2/n}I_{g}(\varphi_{\varepsilon})$ By Lemma 4.1, we conclude that $I_{g}(\phi_{\varepsilon})<\frac{n(n-2)}{4}\omega_{n-1}^{2/n}(\mathrm{card}O_{G}(P))^{2/n}$ It remains to notice that if $\tilde{g}=\phi_{\varepsilon}^{4/(n-2)}g$ then $J(\tilde{g})=4\frac{n-1}{n-2}I_{g}(\phi_{\varepsilon})<n(n-1)\omega_{n-1}^{2/n}(\mathrm{card}O_{G}(P))^{2/n}$ where $\varepsilon$ is sufficiently smaller than $\delta$. ∎ ###### Proof of the Corollary 1.1. Suppose that the orbit of $P$ under the action of $G$ is minimal (otherwise the conjecture is obvious). If $\omega=\omega(P)>[(n-6)/2]$, we conclude using Theorem 1.1. If $\omega\leq[(n-6)/2]\leq 15$, we conclude using main theorem. ∎ ## References * [1] T. Aubin, _Équations différentielles non linéaires et problème de Yamabe_ , J. Math. Pures et appl 55 (1976), 269–296. * [2] by same author, _Sur quelques problèmes de courbure scalaire_ , J. Funct. Anal 240 (2006), 269–289. * [3] by same author, _Solution complète de la ${C}^{0}$ compacité de l’ensemble des solutions de l’équation de Yamabe_, J. Funct. Anal. 244 (2007), 579–589. * [4] by same author, _On the ${C}^{0}$ compactness of the set of the solutions of the Yamabe equation_, Bull. Sci. Math (2008). * [5] E. Hebey and M. Vaugon, _Le problème de Yamabe équivariant_ , Bull. Sci. Math 117 (1993), 241–286. * [6] J. Lelong-Ferrand, Mém. Acad. Royale Belgique, Classe des Sciences 39 (1971). * [7] A. Lichnerowicz, _Sur les transformations conformes d’une variété riemannienne compacte_ , C. R. Acad. Sci. Paris 259 (1964). * [8] F. Madani, _Le problème de Yamabe avec singularités et la conjecture de Hebey–Vaugon_ , Ph.D. thesis, Université Pierre et Marie Curie, 2009. ArXiv: 0910.0562. * [9] M. Obata, _The conjectures on conformal transformations of riemannian manifolds_ , J. Diff. Geom. 6 (1971), 247–258. * [10] R. Schoen, _Conformal deformation of a riemannian metric to constant scalar curvature_ , J. Differ. Geom 20 (1984), 479–495.
arxiv-papers
2009-03-19T16:13:17
2024-09-04T02:49:01.257694
{ "license": "Public Domain", "authors": "Farid Madani", "submitter": "Farid Madani", "url": "https://arxiv.org/abs/0903.3357" }
0903.3448
# Comment on “Quantum Key Distribution with Classical Bob” Yong-gang Tan ygtan@lynu.edu.cn Physics and Information Engineering College, Luoyang Normal College, Luoyang 471022, Henan, People’s Republic of China Hua Lu Department of Physics, Hubei University of Technology, Wuhan 430068, People’s Republic of China Qing-yu Cai qycai@wipm.ac.cn State Key Lab of Magnetics Resonance and Atom and Molecular Physics, Wuhan Institute of Physics and Mathematics Wuhan 430071, People’s Republic of China ###### pacs: 03.67.Hk M. Boyer _et al._ Boyer07 recently proposed an interesting quantum key distribution scheme (BKM07). It claimed that Bob doesn’t need quantum capacity to ensure the protocol’s security. That is to say, a ”classical” Bob can ensure the security of the key. This work is conceptually novel and interesting. However, in this comment, we will show that classical Bob is not good enough for detecting a powerful Eve’s eavesdropping. In BKM07, when Alice’s photons flying into Bob’s Lab, Bob measures about half of the incoming photons to generate key and reflects back the others. Among the registered photons on Bob’s detectors, Alice and Bob drop the results prepared on the $X$ basis and keep the left as their raw key. Then Alice and Bob’s photons can be classified into two categories: the CTRL photons which are reflected back to Alice and the SIFT photons which are used to generate key. If Eve has tagged all of Alice’s photons before they enter Bob’s realm, she can differentiate Bob’s SIFT photons from CTRL photons: Bob consumed all the SIFT photons during the course of his measurement, so he has to send fresh photons which are not tagged in the SIFT mode. Therefore, Eve can distinguish the SIFT photons from the CTRL photons in the return line and she can thus obtain the information of the INFO bits by using the method in the mock protocol presented in Boyer07 . In fact, Eve’s tag can be finished with practical technology. Suppose Eve has an optical wavelength converter which can provide a very small wavelength change to the aim photons interpretation1 . In practice, the information may be encoded on the photon’s polarization (If the phase-encoding was used, Eve can select to tag the polarization of the travel photons.). Since the polarization is communicative with the wavelength, Eve’s operation does not affect the information encoded on the photons. A practical eavesdropping scheme can hence be depicted as following. 1\. Alice prepares a string of photons randomly in the $X$ basis or in the $Z$ basis. Let the wavelength of Alice’s photons be $\lambda$. 2\. Eve performs a CNOT from the incoming photons into a $|0\rangle_{blank}$ ancilla before they entering the wavelength converter. The wavelength becomes $\lambda+\delta\lambda$ after the photons passed through Eve’s Lab. Eve forwards the tagged photons to Bob. 3\. Bob randomly operates the incoming photons in the CTRL mode or in the SIFT mode. In the former case, Bob just reflects Alice’s photons back to Alice. In the latter case, he measures the photons in the $Z$ basis to read out the information, then he makes a copy of the information he obtained on a string of fresh photons and sends them to Alice. 4a. Eve operates a CNOT conversely on the tagged photons as that in step2 which can reset her ancilla and erase the interaction on the initial photon prepared by Alice. 4b. If Bob’s photons are not tagged, Eve measure her ancilla on the $Z$ basis to extract its information. It is the same as the information Bob read from Alice’s photons. 5\. Alice and Bob declare which mode the photons are operated in. If the quantum bit error rate (QBER) is below a tolerant threshold, they will use the information obtained from the $Z$-SIFT mode as their raw key. Or else, they discard the protocol. In Eve’s eavesdropping, if $\delta\lambda$ is chosen appropriately, the tagged photons can register on Bob’s detectors correctly. With the above eavesdropping scheme, Eve may obtain all Alice and Bob’s information without being detected. Thus we have showed the classical Bob is not good enough to discover a powerful Eve. Furthermore, the practical apparatuses of Alice and Bob can not be the same. The photons prepared by Bob may have different characters with that of Alice’s and then a powerful Eve can distinguish Alice’s photons from that of Bob’s. In this case, Eve even doesn’t need to tag Alice’s photon but Bob himself tags the travel photons. This work is funded by NSFC under Grant No. 10504039 and Wuhan Chenguang Project. Y.-G. Tan also thank the youth fund of Luoyang Normal College. ## References * (1) Michel Boyer, Dan Kenigsberg, and Tal Mor, Phys. Rev. Lett. 99, 140501 (2007). * (2) S. Preble and M. Lipson, _Dynamic Wavelength Converterus_ , WO/2008/024458 (US Patent).
arxiv-papers
2009-03-20T03:48:38
2024-09-04T02:49:01.265698
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Yong-gang Tan, Hua Lu and Qing-yu Cai", "submitter": "Yonggang Tan", "url": "https://arxiv.org/abs/0903.3448" }
0903.3460
# The best bound of the area–length ratio in Ahlfors Covering surface theory (I) Guang Yuan Zhang Department of Mathematical Sciences, Tsinghua University, Beijing 100084, P. R. China. Email:gyzhang@math.tsinghua.edu.cn ###### Abstract. In Ahlfors’ covering surface theory, it is well known that there exists a positive constant $h$ such that for any nonconstant holomorphic mapping $f:\overline{\Delta}\rightarrow S,$ if $f(\Delta)\cap\\{0,1,\infty\\}=\emptyset,$ then $A(f,\Delta)\leq hL(f,\partial\Delta),$ where $\Delta$ is the disk $|z|<1$ in $\mathbb{C},$ $S$ is the unit Riemann sphere, $A(f,\Delta)$ is the area of the image of $\Delta$ and $L(f,\partial\Delta)$ is the length of the image of $\partial\Delta$, both counting multiplicities. In this paper, we will show that the best lower bound for $h$ is the number $h_{0}=\max_{\tau\in[0,1]}\left[\frac{\sqrt{1+\tau^{2}}\left(\pi+\arcsin\tau\right)}{\mathrm{{arccot}\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}}}-\tau\right]=4.\,\allowbreak 034\,159\,790\,\allowbreak 51\dots,$ and this is the exact estimation, i.e. there exists a sequence of holomorphic mappings $f_{n}:\overline{\Delta}\rightarrow S$ such that $f_{n}(\Delta)\cap\\{0,1,\infty\\}=\emptyset$ and $\lim_{n\rightarrow\infty}A(f_{n},\Delta)/L(f_{n},\partial\Delta)=h_{0}.$ ###### 2000 Mathematics Subject Classification: 30D35, 30D45, 52B60 Project 10271063 and 10571009 supported by NSFC ## 1\. Introduction In this paper, the Riemann sphere $S$ is the unit sphere $S=\\{(x_{1},x_{2},x_{3})\in\mathbb{R}^{3};\;x_{1}^{2}+x_{2}^{2}+x_{3}^{2}=1\\}$ endowed with the stereographic projection $P:\overline{\mathbb{C}}=\mathbb{C}\cup\\{\infty\\}\rightarrow S$ with $P(0)=(0,0,-1)$, $P(\infty)=(0,0,1).$ The lengths of curves and the areas of domains in $S$ are defined in the usual way. Thus, $P$ induces the spherical metric $ds=\rho(z)|dz|=\frac{2}{1+|z|^{2}}|dz|,z\in\mathbb{C}.$ For a set $V$ in $\overline{\mathbb{C}},$ we denote by $\partial V$ its boundary and $\overline{V}$ its closure. We will identify the extended plane $\overline{\mathbb{C}}=\mathbb{C}\cup\\{\infty\\}$ with $S,$ via the stereographic projection $P$. So for any set $D\subset\mathbb{C}$, we will also write $D\subset S,$ but in the later relation, $D$ in fact means the set $P(D).$ When we write $0\in S$, for example, $0$ indicates the point $P(0)=(0,0,-1)$ in $S.$ In this way, some notations in $\mathbb{C}$ will be used in $S$: we use the interval notation $[-1,1],[0,+\infty]$ to denote the line segment $P([-1,1]),P([0,+\infty])$ in $S,$ etc. For a Jordan domain $U$ in $\mathbb{C}$ and a holomorphic mapping $g:\overline{U}\rightarrow S,$ we denote by $A(g,U)$ the spherical area of the image of $U,$ counted with multiplicities, and denote by $L(g,\partial U)$ the spherical length of the image of $\partial U,$ counted with multiplicities. If we regard $g$ as a mapping from from $\overline{U}$ into $\overline{\mathbb{C}}=\mathbb{C\cup\\{\infty\\}}$, via the stereographic projection $P$, we have $A(g,U)=\iint_{U}(\rho(g(z))|g(z)|)^{2}dxdy,\ z=x+iy;$ $L(g,\partial U)=\int_{\partial U}\rho(g(z))\left|g(z)\right||dz|.$ In Ahlfors’ covering surface theory ([1], [4]), it is well known that there exists a positive constant $h$ such that for any holomorphic mapping $f:\overline{\Delta}\rightarrow S,$ if $f(z)\neq 0,1,\infty$ for any $z\in\Delta,$ then (1.1) $A(f,\Delta)\leq hL(f,\partial\Delta).$ The goal of this paper is to give the best lower bound for $h,$ and our main result is the following theorem. ###### Theorem 1.1. Let $f:\overline{\Delta}\rightarrow S$ be a nonconstant holomorphic mapping such that $f(z)\neq 0,1,\infty$ for any $z\in\Delta$. Then (1.2) $A(f,\Delta)<h_{0}L(f,\partial\Delta),$ where (1.3) $h_{0}=\max_{\tau\in[0,1]}\left[\frac{\sqrt{1+\tau^{2}}\left(\pi+\arcsin\tau\right)}{\mathrm{arccot}\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}}-\tau\right]=4.03415979051\dots,$ and $h_{0}$ is the best lower bound in the sense that there exists a sequences of holomorphic mappings $f_{n}:\overline{\Delta}\rightarrow S$ such that $f_{n}(\Delta)\cap\\{0,1,\infty\\}=\emptyset$ and $\lim_{n\rightarrow\infty}\frac{A(f_{n},\Delta)}{L(f_{n},\partial\Delta)}=h_{0}.$ Consider the function (1.4) $h(\tau)=\frac{\sqrt{1+\tau^{2}}\left(\pi+\arcsin\tau\right)}{\mathrm{arccot}\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}}-\tau,\tau\in[0,1].$ It is clear that $h(0)=4,h(1)=3\sqrt{2}-1<4,$ and $h^{\prime}(0)=\frac{4}{\pi}-1>0.$ Thus, $h$ takes its maximum $h_{0}$ at some point $\tau_{0}\in(0,1)$ and $h_{0}>4.$ For a domain $U$ in $S,$ we denote by $A(U)$ the area of $U.$ If $U\subset\mathbb{C},$ we still use the notation $A(U)$ to denote the spherical area of $U,$ which is the area of $P(U)$ given by $A(U)=\iint_{U}(\rho(x+iy))^{2}dxdy.$ For a curve $\Gamma=\Gamma(t),t\in[0,1],$ in $S,$ we denote by $L(\Gamma)$ the length of the set $\Gamma=\\{\Gamma(t);t\in[0,1]\\}.$ If $\Gamma=\Gamma(t),t\in[0,1],$ is a curve in $\mathbb{C}$, we still denote by $L(\Gamma)$ the spherical length of $\Gamma,$ which is the length of the set $P(\Gamma),$ and in the case that $\Gamma$ is simple we have $L(\Gamma)=\int_{\Gamma}\rho(z)|dz|.$ Now we explain the geometric meaning of the function $h(\tau)$ given by (1.4). Let $D$ be the disk in $S$ with diameter $\overline{1,\infty},$ the shortest path from $1$ to $\infty$ in $S.$ Let $l\in[\pi,\sqrt{2}\pi]$ and let $D_{l}$ be a domain inside $D$ whose boundary is composed of the two congruent circular arcs, each of which has endpoints $\\{1,\infty\\}$ and spherical length $\frac{l}{2}.$ Then we have $L(\partial D_{l})=l.$ It is clear that $D_{l},$ regarded as a domain in $\mathbb{C},$ is an angular domain whose vertex is $1$ and bisector is the ray $[1,+\infty)$ in $\mathbb{C}$. We denote by $2\theta_{l}$ the value of the angle of this angular domain. Then it is clear that $\theta_{l}<\frac{\pi}{2}.$ It is proved in Section 4 that the area $A(D_{l})$ and the length $L(\partial D_{l})=l$ are real analytic functions of $\tau=\sin\theta_{l},\theta_{l}\in[0,\frac{\pi}{2}],$ and when we understand $A(D_{l})$ and $l,$ in the ratio $\frac{4\pi+A(D_{l})}{l},$ as functions of $\tau=\sin\theta_{l},$ we obtain the function $h(\tau)$ given by (1.4): (1.5) $h(\tau)=\frac{A(S)+A(D_{l})}{l}=\frac{4\pi+A(D_{l})}{l},\tau\in[0,1].$ This is the geometrical meaning of the function $h(\tau).$ Considering that $l\geq\pi$ and $A(D_{l})\leq A(D)=2\pi(1-\frac{\sqrt{2}}{2}),$ we have $h(\tau)\leq\frac{4\pi+2\pi(1-\frac{\sqrt{2}}{2})}{\pi}<4.6,$ and then $4<h_{0}<4.6.$ A numerical computation shows that $h_{0}=4.034\,159\,790\,51\dots$ The inequality (1.1) directly follows from the fundamental theorem of L. Ahlfors’ covering surface theory ([1], [4]) for a finite number of points $a_{1},\dots,a_{q}$: ###### Theorem 1.2 (Ahlfors). Let $a_{1},\dots,a_{q}$ be distinct $q$ points in $S.$ Then there exists a positive constant $h=h(a_{1},\dots,a_{q})$ such that for any meromorphic function defined on $\overline{\Delta}$ (1.6) $(q-2)A(f,\Delta)/4\pi\leq\sum_{m=1}^{q}n(f,a_{m})+hL(f,\partial\Delta),$ where $n(f,a_{m})$ is the number of solutions of the equation $f(z)=a_{m},z\in\Delta,$ ignoring multiplicities. ###### Remark 1.1. J. Dufresnoy’s work [3] may be the first literature estimating the number $h$ in (1.6) explicitly, in which it is shown that the number $h$ in (1.6) can be taken to be $h=h_{1}=\frac{3}{2\delta_{0}},$ where $\delta_{0}$ is the smallest spherical distance between the points $a_{m},m=1,\dots,q$. When $f(z)\neq 0,1,\infty,z\in\Delta,$ Dufresnoy’s result is that $A(f,\Delta)\leq 12L(f,\partial\Delta).$ ###### Remark 1.2. J. Dufresnoy’s work [3] also studied the relationship between the constant in (1.1) and some other classical constants, such as Landau’s, Bloch’s and Schotkii’s constants. This is also introduced in the book [4] by Haymann. To prove the main theorem, the difficulty lies in the inequality (1.2). It seems hard to estimate the best lower bound for the constant $h$ by following Ahlfors’ method in his covering surface theory. Fortunately, we managed to re- understand Ahlfors’s theory via the classical isoperimetric inequality of the unit hemisphere which is obtained by F. Bernstein [2] in 1905 (see Section 4). The following is the outline of the proof of the main theorem. (A). Observation for certain class of open mappings. We have been able to find that the area-length ratio is relative easy to figure out for a special family $F$ of mappings from $\overline{\Delta}$ into $S$ such that for each $f\in F,$ $f$ satisfies the following conditions (a)–(e): (a) $f$ is open, discrete111The term _discrete_ means that for each $q\in f(\overline{\Delta}),$ $f^{-1}(q)$ is a finite set. and continuous, the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is a polygonal curve in $S$ and $f(\Delta)\cap\\{0,1,\infty\\}=\emptyset.$ (b) Each natural edge222See Definition 2.2 (2) and (3). of $\Gamma$ has spherical length strictly less than $\pi.$ (c) $\Gamma_{f}$ is locally convex everywhere except at $0,1,\infty.$ (d) All branched points of $f$ are located in $\\{0,1,\infty\\}.$ (e) $\Gamma_{f}\cap[0,+\infty]$ contains at most finitely many points. Here $[0,+\infty]$ denotes the line segment in $S$ from $0$ to $\infty$ passing through $1.$ It is clear that normal mappings defined in Section 3 satisfy condition (a). Conversely, any mapping satisfying (a) that is orientation preserved is a normal mapping333We will not introduce the proof for this conclusion, since it is not used in this paper.. It is relatively easy to estimate the area–length ratio for mappings in the family $F:$ for each $f\in F\ $one can obtain the following inequality by Lemmas 14.1 and 14.2, $A(f,\Delta)\leq h_{0}L(g,\partial\Delta)-\min\\{A(f,\Delta),4\pi\\},$ where $h_{0}$ is given by (1.3). On the other hand, it is fortunate that we are able to prove that, for any holomorphic mapping $f:\overline{\Delta}\rightarrow S$ with $f(\Delta)\cap\\{0,1,\infty\\}=\emptyset,$ and for sufficiently small $\varepsilon>0,$ there exist a finite number of mappings $\\{g_{1},\dots,g_{n}\\}$ in the family $F,$ such that (1.7) $\sum_{j=1}^{n}A(g_{j},\Delta)\geq A(f,\Delta)-\varepsilon,\ \mathrm{and\ }\sum_{j=1}^{n}L(g_{j},\partial\Delta)\leq L(f,\partial\Delta)+\varepsilon.$ Summarizing the above two aspects, we obtain (1.2). The existence of the family $\\{g_{1},\dots,g_{n}\\},$ which is given by Theorem 12.1, is the first key step to prove the main theorem. Sections 8–11 is prepared for proving Theorem 12.1: we first prove Theorems 10.1 and 11.1, and then we apply these two results to deduce Theorem 12.1 in Section 12. The ingredients of Sections 8 and 9 are Theorem 8.1, Lemma 9.2 and Lemma 9.3, which are just used to prove Theorem 10.1 and Theorem 11.1. We will give the outline for the proof of Theorem 12.1 in the following part (B). The content of Sections 4–7 and 13 is for proving Lemmas 14.1 and 14.2, which, with the existence of the family $\\{g_{1},\dots,g_{n}\\},$ deduce the main theorem in the last section, Section 14. In Section 4, we introduce two classical results, the Bernstein’s isoperimetric inequality of the unit hemisphere and the Ladó’s theorem, from which we prove Theorems 4.3 and 4.4 that is used in Section 14 for proving Lemmas 14.1 and 14.2. Sections 5 and 6 are prepared for Section 7, and the ingredient of Section 7 is Theorem 7.1, which is the second key step to prove the main theorem: with Theorems 4.3, 4.4 and 13.1, it deduces Lemmas 14.1 and 14.2. Theorem 13.1, which is proved just based on Lemma 6.3 and Corollary 7.1, is the third key step to prove the main theorem. (B). The existence of $\\{g_{1},\dots,g_{n}\\}$ in (A). Now, we introduce the outline to prove the existence of $\\{g_{1},\dots,g_{n}\\}.$ Let $f:\overline{\Delta}\rightarrow S$ be a holomorphic mapping with $f(\Delta)\cap\\{0,1,\infty\\}=\emptyset.$ To show the existence of the family $\\{g_{1},\dots,g_{n}\\},$ for any $\varepsilon>0,$ we first approximate $f$ by an open mapping $f_{1}$ such that $f_{1}$ satisfies (a) and (b) in (A) and $A(f_{1},\Delta)>A(f,\Delta)-\frac{\varepsilon}{2}\ \mathrm{and\ }L(f_{1},\partial\Delta)<L(f,\partial\Delta)-\frac{\varepsilon}{2}.$ Then we are able to first show that there exist a finite number of mappings $\\{G_{1},\dots,G_{n}\\}$ that satisfy (1.7) and (a)–(d) as follows. Operation 1: (a)(b)$\rightarrow$(a)(b)(c). We can apply Theorem 11.1 several times to obtain a mapping $f_{2}$ such that $f_{2}$ satisfies (a)–(c) and $A(f_{2},\Delta)\geq A(f_{1},\Delta)\ \mathrm{and\ }L(f_{2},\partial\Delta)\leq L(f_{1},\partial\Delta).$ If $f_{2}$ satisfies (d), then $\\{G_{1}\\}=\\{f_{2}\\}$ is the desired family. Otherwise we turn to next operation. Operation 2: (a)(b)(c)$\rightarrow$(a)(b)(d). If $f_{2}$ does not satisfies (d), then we can apply Theorem 10.1 a finite number of times to decompose $f_{2}$ into a finite444By Theorem 10.1 (iv) we may assume $\sum_{j=1}^{m}V(f_{2j})\leq V(f_{2})+2(m-1),$ where $V(f_{2})$ is the number of natural vertices (see Definition 2.2) of the polygonal curve $\Gamma_{f_{2}}=f_{2}(z),z\in\partial\Delta.$ Then by Lemma 12.1 we have $3m\leq V(f_{2})+2(m-1),$ which implies $m\leq V(f_{2})-2,$ and then the finiteness follows. number of mappings $f_{2j},j=1,\dots,m,$ that satisfy (a), (b), (d) and $\sum_{j=1}^{m}A(f_{2j},\Delta)\geq A(f_{2},\Delta)\ \mathrm{and\ }\sum_{j=1}^{m}L(f_{2j},\partial\Delta)\leq L(f_{2},\partial\Delta).$ Operation 2 may destroy condition (c)! We try to repair this by applying Operation 1 to all the mappings $f_{2j}$ and obtain mappings $f_{12j},j=1,\dots,m,$ that satisfy (a)–(c) and $A(f_{12j},\Delta)\geq A(f_{2j},\Delta)\ \mathrm{and\ }L(f_{12j},\partial\Delta)\leq L(f_{2j},\partial\Delta),j=1,\dots,m.$ But Operation 1 may destroy condition (d)! We try to repair this by applying Operation 2 to each $f_{12j}$ that has ramification points in $\Delta$ and obtain more mappings. But then condition (c) may again be destroyed for the mappings obtained from Operation 2. It seems we are arguing in a circle! Luckily, we are able to prove that Operations 1 and 2 can not be applied infinitely many times! This is the ingredient of Theorem 12.1. Thus, we can execute Operations 1 and 2 alternatively with in a finite number of steps to obtain the desired mappings $G_{j},j=1,\dots,n.$ From the mappings $G_{j}$ we can easily obtain the mappings $g_{j},j=1,2,\dots,n,$ by slightly perturb each $G_{j}$. ###### Remark 1.3. The method in this paper can also be used to estimate the best bound of the constant $h$ in Ahlfors’s fundamental theorem for any number $(\geq 3)$ of points. We will discuss this in another paper. ## 2\. Some notations and definitions related to curves in $S$ In this section we introduce some notations, definitions and make some conventions. _Locally convex polygonal paths_ and _locally convex polygonal curves_ in the Riemann sphere $S$ defined in this section play a central role in this paper. Let $\Gamma=\Gamma(t),t\in[\alpha,\beta],$ be a curve in $\mathbb{C}$ or $S$. Then the orientation of the curve $\Gamma$ will be regarded as the orientation as $t$ increases. Therefore, if $\Gamma$ is not closed, the orientation of $\Gamma$ is from $\Gamma(\alpha)$ to $\Gamma(\beta),$ and we will denote by $-\Gamma=\Gamma(t_{2}+t_{1}-t),t\in[t_{1},t_{2}],$ the same curve with opposite orientation. If $\Gamma_{j}=\Gamma_{j}(t),t\in[t_{j1},t_{j2}],$ are two curves in $\mathbb{C}$ (or $S$) and $\Gamma_{1}(t_{12})=\Gamma_{2}(t_{21}),$ we will denote by $\Gamma_{1}+\Gamma_{2}$ the curve $\Gamma(t)=\left\\{\begin{array}[]{ll}\Gamma_{1}(t),&t\in[t_{11},t_{12}],\\\ \Gamma_{2}(t+t_{21}-t_{12}),&t\in(t_{12},t_{12}+t_{22}-t_{21}].\end{array}\right.$ When $\Gamma_{1}+(-\Gamma_{2})$ makes sense, we will write it by $\Gamma_{1}-\Gamma_{2}.$ Curves in this paper are always oriented and continuous curves. Some times a curve $\Gamma$ will be regard as a set in $S.$ But this is only in the case that the curve is involved in some set operations. For a Jordan domain $D$ in $\mathbb{C},$ the boundary $\partial D$ of $D$ is always regarded as an oriented curve with the anticlockwise orientation. If $D$ is a Jordan domain in $\mathbb{C}$ and $f:\overline{D}\rightarrow S$ is a continuous mapping, then the the boundary curve (2.1) $\Gamma_{f}=\Gamma_{f}(z),z\in\partial D,$ of $f$ is always regarded as an oriented curve with the oreintation induced by $\partial D$. The notation $\Gamma_{f}$ will be used through out this paper, which alway denotes the curve given by (2.1) for any given Jordan domain $D$ of $\mathbb{C}$ and any mapping $f:\overline{D}\rightarrow S$. An oriented great circle $C$ in $S$ divides the sphere into two hemispheres. We will call the hemisphere that is on the left hand side of $C$ _inside, or enclosed by,_ $C$, in the sense that we are standing on the sphere with our heads pointing to the center of $S,$ and going along $C$ in the orientation of $C.$ For example, when $\Delta$ is regarded as a disk in $S,$ $\Delta$ is the lower hemisphere of $S$ and $\Delta$ is inside the oriented circle $\partial\Delta,$ i.e. $P(\Delta)$ is inside the great circle $P(\partial\Delta);$ and the upper hemisphere $\overline{\mathbb{C}}\backslash\overline{\Delta}$ in $S$ is inside the oriented circle $-\partial\Delta.$ If $\Gamma$ is a Jordan curve in $S$, then the domain in $S$ that is bounded by $\Gamma$ and is inside $\Gamma$ is also called the domain inside, or enclosed by, $\Gamma.$ Of course, here “inside” means “on the left hand side of”. A section of a great circle in $S$ is called a _line segment_. To emphasize this, we also call it _straight line segment_ or _geodesic line segment._ The spherical distance of two points $p$ and $q$ in $S$ will be denoted by $d(p,q).$ In the case that $p$ and $q$ are not antipodal, we denote by $\overline{pq}$ the shortest (simple) path in $S$ from $p$ to $q,$ which is unique and is in fact the shorter of the two arcs with end points $p$ and $q$ of the great circle of $S$ passing through $p$ and $q.$ We will write $\overline{q_{1}q_{2}\dots q_{n}}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{n-1}q_{n}},$ if each term of the right hand side makes sense, where $q_{1},\dots,q_{n}$ are points in $S.$ We write $\overline{pq}$ by $\overline{p,q},$ if $p,$ or $q,$ or both, is replaced by explicit complex numbers. For example, we denote by the shortest path from $p=1$ to $q=2$ by $\overline{pq}=\overline{1,2}.$ Note that we identify $\overline{\mathbb{C}}=\mathbb{C}\cup\\{\infty\\}$ with $S,$ via the stereographic projection $P.$ When $\overline{pq}$ makes sense, we will denote by $\overline{pq}^{\circ}$ the interior of the path. ###### Definition 2.1. A closed curve $\Gamma=f(z),z\in\partial\Delta,$ in $S$ is called a _polygonal closed curve_ if and only if there exist a finite number of points $p_{j}\in\partial\Delta,j=1,\dots,n,$ with (2.2) $\arg p_{1}<\arg p_{2}<\dots<\arg p_{n}<\arg p_{1}+2\pi$ such that for each section555A section of a curve always inherits the orientation of the curve. $\alpha_{j}$ of $\partial\Delta$ from $p_{j}$ to $p_{j+1}$ $(p_{n+1}=p_{1}),$ the section $\Gamma_{j}$ of $\Gamma$ restricted to $\alpha_{j}$ is a locally simple and locally straight path, and in this case $\Gamma=\Gamma_{1}+\dots+\Gamma_{n}$ is called a _partition_ of $\Gamma$. Note that the term _partition_ emphasizes that each term $\Gamma_{j}$ is locally simple and locally straight. A locally simple and locally straight curve in $S$ must be contained in some great circle of $S.$ So, for each $\alpha_{j}$ in the above definition, each $p_{0}\in\alpha_{j}$ has a neighborhood $L_{p_{0}}$ in $\alpha_{j}$ such that $\Gamma$ restricted to $L_{p_{0}}$ is a homeomorphism onto a line segment in $S.$ Through out this paper, we denote by $E$ the set $\\{0,1,\infty\\}$ in $S.$ ###### Definition 2.2. Let $\Gamma=f(z),z\in\partial\Delta,$ be a polygonal closed curve in $S$. (1) A point $p_{0}\in\partial D$ is called a _natural vertex_ of $\Gamma$ if and only if one of the following conditions holds: (a) $f(p_{0})\in E=\\{0,1,\infty\\}.$ (b) $f(p_{0})\notin E$ and for any neighborhood $I_{p_{0}}$ of $p_{0}$ in $\partial\Delta,$ the restriction $\Gamma|_{I_{p_{0}}}=f(z),z\in I_{p_{0}},$ can not be a straight and simple path. (2) In the case that $\Gamma$ has at least two natural vertices, a closed interval $I$ in $\partial\Delta$ is called a _natural edge_ of $\Gamma$ if and only if the endpoints of $I$ are both natural vertices of $\Gamma$ but the interior of $I$ does not contain any natural vertex of $\Gamma.$ (3) If $I$ is a natural edge of $\Gamma,$ then the restriction $\Gamma|_{I}=f(z),z\in I,$ is also called a _natural edge_ of $\Gamma.$ For the above definition (2), the reader should be aware that a natural edge can not contain any point of $f^{-1}\left(E\right)=f^{-1}\left(\\{0,1,\infty\\}\right)$ in its interior (in $\partial\Delta$), because by definition each point in $f^{-1}\left(E\right)$ is a natural vertex. Thus, one can not understand any natural edge to be a maximal interval on which $\Gamma$ is locally simple and locally straight. If we regard the great circle $C$ determined666This is in the sense that $C$ contains $\overline{0,1}$ and is oriented by $\overline{0,1}.$ by $\overline{0,1}$ as a simple closed curve, it has three natural edges $\overline{0,1},\overline{1,\infty}$ and $\overline{\infty,-1,1}=\overline{\infty,-1}+\overline{-1,1}$, but the whole curve $C$ is simple and straight. If $\Gamma$ has no any natural vertex, $\Gamma$ must be a closed curve contained in some great circle $C_{1}$ of $S$ with $C_{1}\cap\\{0,1,\infty\\}=\emptyset$ and $\Gamma$ is locally simple, and in this case, $\partial\Delta$ is regard as a natural edge without endpoints. If $\Gamma$ has only one natural vertex $p_{0}\in\partial\Delta,$ then, by the definition, $q_{0}=f(p_{0})=0,1$ or $\infty,$ and $\Gamma$ must be also contained in some great circle $C_{2}$ of $S$ so that $C_{2}\cap\\{0,1,\infty\\}=\\{q_{0}\\}$ and $\Gamma$ must be a simple path from $q_{0}$ to $q_{0}.$ In this case $\partial\Delta$ will be regarded as a natural edge with endpoints coinciding at the unique natural vertex $q_{0}$. ###### Definition 2.3. Let $\Gamma=f(z),z\in\partial\Delta,$ be a _polygonal closed curve_ and assume that $p_{1}\in\partial\Delta$ is a natural vertex of $\Gamma$. Then there uniquely exist a finite number of points $p_{j}\in\partial\Delta,j=1,\dots,n,$ with (2.2) such that $p_{1},\dots,p_{n}$ is an enumeration of all natural vertices of $\Gamma.$ In this case, (2.3) $\Gamma=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n}$ is called a _natural partition_ of $\Gamma,$ where each $\Gamma_{j}$ is the restriction of $\Gamma$ to the section $\alpha_{j}$ of $\partial\Delta$ from $p_{j}$ to $p_{j+1}$ $(p_{n+1}=p_{n}),$ and (2.4) $\partial\Delta=\alpha_{1}+\alpha_{2}+\dots+\alpha_{n}$ is also called a _natural partition_ of $\partial\Delta$ corresponding to (2.3). ###### Remark 2.1. For the sake of simplicity and avoiding confusions, we make the following conventions. (1) When we say that $\Gamma^{\prime}$ is a natural edge of a polygonal closed curve $\Gamma=f(z),z\in\partial\Delta,$ we always mean that $\Gamma$ and $\partial\Delta$ have natural partitions (2.3) and (2.4), respectively, such that $\Gamma^{\prime}$ is the restriction $\Gamma_{j}=f(z),z\in\alpha_{j},$ for some $j.$ (2) When we use (2.3) to denote a natural partition of $\Gamma,$ we always mean that there is a natural partition (2.4) corresponding to (2.3). Then, in the above definition we also call $q_{j}=f(p_{j}),$ which should be understood to be the pair $(p_{j},q_{j}),$ a _natural vertex_ of $\Gamma$ for $j=1,\dots,n$. ###### Definition 2.4. A partition $\Gamma=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n}$ of a closed polygonal curve in $S$ is called a _permitted partition_ if each $\Gamma_{j}$ is contained in some natural edge of $\Gamma.$ A polygonal Jordan curve in $S$ that is composed of exactly three line segments is called a _triangle_. Note that a vertex of a triangle may not be a natural vertex. Any great circle may be regarded as a triangle, while it has no any natural vertex. ###### Definition 2.5. Let $\Gamma=\Gamma(z),z\in\partial\Delta,$ be a closed polygonal curve in $S$. (1) For a point $p_{0}\in\partial\Delta,$ $\Gamma$ is called _convex_ at $p_{0}$, if $p_{0}$ has a neighborhood $I$ in $\partial\Delta$ such that the following two conditions (a) and (b) hold. (a) The restriction $\Gamma|_{I}$ of $\Gamma$ to $I$ is a simple path. (b) Either $\Gamma|_{I}$ is straight or $\Gamma^{\prime}=\Gamma|_{I}+\overline{p^{\prime\prime}p^{\prime}},$ in which $p^{\prime}\ $and $p^{\prime\prime}$ are the initial and terminal point of $\Gamma|_{I},$ respectively, is a triangle which encloses777By definition, “encloses” means the triangle domain is “on the left hand side of” of the triangle $\Gamma^{\prime}$. a convex triangle domain in $S.$ (2) $\Gamma$ is called _strictly convex_ at $p_{0}\in\partial\Delta$ if $\Gamma$ is convex at $p_{0}$ and for any neighborhood $I$ of $p_{0}$ in $\partial\Delta,$ $\Gamma|_{I}$ is not straight. (3). For a point $q_{0}\in S,\ \Gamma$ is called _convex_ at $q_{0}\in S$ if and only if for each $p\in\partial\Delta$ with $\Gamma(p)=q_{0},$ $\Gamma$ is convex at $p.$ (4). For a set $T\subset S,$ the closed curve $\Gamma$ is called _locally convex in_ $T$ if and only if $\Gamma$ is convex at each point $q_{0}\in T.$ It is clear that if $\Gamma$ is convex at $q_{0}\in S,$ then for some neighborhood $T$ of $q_{0}$ in $S,$ $\Gamma$ is locally convex in $T.$ ###### Definition 2.6. A path $\Gamma=\Gamma(t),t\in[0,1],$ in $S,$ is called a _polygonal path_ if and only if $[0,1]$ has a partition (2.5) $0=t_{0}<t_{1}<\dots<t_{n}=1,$ such that the section $\Gamma_{j}=\Gamma(t),t\in[t_{j-1},t_{j}]$, is a locally simple and locally straight path, $j=1,\dots,n,$ and in this case $\Gamma=\Gamma_{1}+\dots+\Gamma_{n}$ is called a _partition_ of $\Gamma.$ Natural vertices, natural edges, natural partition, permitted partitions and convex vertices of a polygonal path $\Gamma=\Gamma(t),t\in[0,1],$ in $S,$ can be defined as that for polygonal closed curves. But convex vertices are only defined in the open interval $(0,1)$ of $[0,1]$ and we don’t call the endpoints $0$ and $1$ natural vertices. To avoid confusions we write these definitions completely. ###### Definition 2.7. Let $\Gamma=f(t),t\in[0,1],$ be a polygonal path in $S$. (1) A point $p_{0}\in(0,1)$ is called a _natural vertex_ of $\Gamma$ if and only if one of the following conditions holds: (a) $f(p_{0})\in E=\\{0,1,\infty\\}.$ (b) $f(p_{0})\notin E$ and for any neighborhood $I_{p_{0}}$ of $p_{0}$ in $(0,1),$ the restriction $\Gamma|_{I_{p_{0}}}=f(t),t\in I_{p_{0}},$ can not be a straight and simple path. (2) A closed interval $I$ in $[0,1]$ is called a _natural edge_ of $\Gamma$ if and only if each endpoint of $I$ is either $0,$ or $1,$ or a natural vertex of $\Gamma,$ and the interior of $I$ does not contain any natural vertex of $\Gamma.$ (3) If $I$ is a natural edge of $\Gamma,$ the restriction $\Gamma|_{I}=f(t),t\in I,$ is also called a _natural edge_ of $\Gamma.$ ###### Definition 2.8. For a polygonal path $\Gamma=f(t),t\in[0,1],$ a partition (2.6) $\Gamma=\Gamma_{1}+\dots+\Gamma_{n}$ is called a _natural partition_ of $\Gamma,$ if and only if $[0,1]$ has a partition (2.7) $0=t_{0}<t_{1}<\dots<t_{n}=1,$ such that each $[t_{j-1},t_{j}]$ is a natural edge of $\Gamma,$ and $\Gamma_{j}$ is the restriction of $\Gamma$ to $[t_{j-1},t_{j}],j=1,\dots,n$, in this case (2.7) is also called a _natural partition_ of $[0,1]$ corresponding to (2.6). ###### Remark 2.2. We make similar conventions as in Remark 2.1 for polygonal paths. (1) When we say that $\Gamma^{\prime}$ is a natural edge of a polygonal path $\Gamma=f(t),t\in[0,1],$ we always mean that $\Gamma$ and $[0,1]$ have natural partitions (2.6) and (2.7), respectively, such that $\Gamma^{\prime}$ is the restriction $\Gamma_{j}=f(t),t\in[t_{j-1},t_{j}],$ for some $j.$ (2) When we use (2.6) to denote a natural partition of $\Gamma,$ we always mean that there is a natural partition (2.7) corresponding to (2.6). Then, in the above definition we also call $q_{j}=f(t_{j}),$ which should be understood to be the pair $(t_{j},q_{j}),$ a natural vertex of $\Gamma$ for $j=1,\dots,n-1$. ###### Definition 2.9. Let $\Gamma=\Gamma(t),t\in[0,1],$ be a polygonal path in $S$. (1) For a point $p_{0}\in(0,1),$ $\Gamma$ is called _convex_ at $p_{0}$, if there is a closed interval $I\subset(0,1)$ such that (a) and (b) in Definition 2.5 (1) hold. (2) $\Gamma$ is called _strictly convex_ at $p_{0}\in\partial\Delta$ if $\Gamma$ is convex at $p_{0}$ and for any neighborhood $I$ of $p_{0}$ in $(0,1),$ $\Gamma|_{I}$ is not straight. (3). For a point $q_{0}\in S,\ \Gamma$ is called _convex_ at $q_{0}\in S$ if and only if for each $p\in(0,1)$ with $\Gamma(p)=q_{0},$ $\Gamma$ is convex at $p.$ (4). For a set $T\subset S,$ the closed curve $\Gamma$ is called _locally convex in_ $T$ if and only if $\Gamma$ is convex at each point $q_{0}\in T.$ Geometrically, a locally convex path (or curve) has the property that when we go ahead along the path (or curve) with our heads pointing to the center of the sphere $S$, we always go straight or turn left. ###### Remark 2.3. The term “closed polygonal path” and “closed polygonal curve” have distinct meaning in some sense. If a polygonal path $\Gamma$ given by its natural partition (2.6), the natural vertices mean $t_{1},\dots,t_{n-1}$. But when $f(0)=f(1)$ and $\Gamma$ is regarded as a _closed curve,_ $t_{1},\dots,t_{n-1}$ are still natural vertices of $\Gamma,$ $t_{0}=0$, identified with $t_{n}=1,$ may or may not be a natural vertex of the _closed curve_ $\Gamma.$ Closed polygonal paths still emphasize the initial and terminal points, while for a closed polygonal curve, there is no initial and terminal points, all points on it have equality. ###### Remark 2.4. A _locally convex polygonal Jordan path_ that is closed may not be a _locally convex polygonal Jordan curve_ , by the definition. ###### Definition 2.10. A polygonal Jordan curve in $S$ that is either a great circle, or is composed of exactly two straight edges is called a biangle. A biangle divides the sphere $S$ into two biangle domains. Note that a biangle may contains more than two natural edges, in the case that it contains $0$, $1$ or $\infty$ in its straight edges. ###### Definition 2.11. A triangle in $S$ is called a _generic_ triangle if it encloses a triangle domain whose three angles are all strictly less than $\pi.$ ###### Definition 2.12. A Jordan curve $\Gamma$ in $S$ is called convex if the domain $D_{\Gamma}\subset S$ inside $\Gamma$ is a convex domain in the sense that for any two points $q_{1}$ and $q_{2}$ in $D_{\Gamma},$ there is a line segment $L\subset S$ with endpoints $q_{1}$ and $q_{2}$ such that $L\subset D_{\Gamma}.$ ###### Remark 2.5. By the definition, each locally convex polygonal Jordan curve is a convex curve and is contained in some closed hemisphere, while any locally convex curve that is not simple may not be contained in any closed hemisphere. ###### Remark 2.6. Any triangle $\Gamma$ in $S$ all of whose edges have length $\leq\pi$ has a orientation so that $\Gamma$ is a convex polygonal Jordan curve. But when a triangle $\Gamma$ in $S$ has an edge with length $>\pi,$ $\Gamma,$ with either orientation, may not be a locally convex triangle. ###### Remark 2.7. For any convex triangle $\Gamma$ in $S$, the triangle domain enclosed888By definition, “enclosed” means “on the left hand side of”. by $\Gamma$ is contained in some hemisphere of $S.$ Conversely, any triangle domain whose closure is contained in some open hemisphere of $S$ is enclosed by a generic convex triangle in the same open hemisphere. ## 3\. Definition and some properties of Normal mappings The proof of the main theorem is based on the investigation of so called normal mappings defined in this section, which are the mappings satisfying condition (a) in Section 1. But we will use another definition. ###### Definition 3.1. Let $D$ be a Jordan domain in $\mathbb{C}$. A mapping $f:\overline{D}\rightarrow S$ is called a _normal mapping_ if the following five conditions are satisfied: (a) The boundary curve $\Gamma_{f}=f(z),z\in\partial D,$ is a polygonal closed curve. (b) For each $p\in D,$ there exist a neighborhood $U\subset D$ of $p$, a disk $V\ $in $S$ centered at $q=f(p)$ and homeomorphisms $h_{1}:U\rightarrow\Delta$ and $h_{2}:V\rightarrow\Delta,$ such that $h_{2}\circ f|_{U}\circ h_{1}^{-1}(\zeta)=\zeta^{d},\zeta\in\Delta$ for some positive integer $d.$ (c) For each $p\in\partial D,$ there exists a neighborhood $U$ of $p$ in $\overline{D}$, a disk $V\ $in $S$ centered at $q=f(p)$ and homeomorphisms $h_{1}:\overline{U}\rightarrow\overline{\Delta^{+}}$ and $h_{2}:\overline{V}\rightarrow\overline{\Delta},$ such that $\displaystyle h_{1}\left(\overline{U}\cap\partial D\right)$ $\displaystyle=$ $\displaystyle[-1,1],$ $\displaystyle h_{2}\circ f|_{\overline{U}}\circ h_{1}^{-1}(\zeta)$ $\displaystyle=$ $\displaystyle\zeta^{d},\zeta\in\overline{\Delta^{+}},$ for some positive integer $d$, where $\Delta^{+}$ is the upper half disk $\\{\zeta\in\Delta,\mathrm{Im}\zeta>0\\}.$ (d) $f(D)\cap\\{0,1,\infty\\}=\emptyset.$ (e) $f$ is orientation preserved in the sense that $P^{-1}\circ f$ is orientation preserved, where $P$ is the stereographic projection. The reader should be aware of that a normal mapping satisfies condition (a) in Section 1. Conversely, a mapping that is orientation preserved and satisfies (a) in Section 1 must be a normal mapping, but this is not important for us. In the above definition if for some point $p\in D,$ the corresponding $d\geq 2,$ then $p$ is called a _ramification point_ , $f(q)$ is called a _branched point_ , $v_{f}(p)=d$ is called the _multiplicity_ of $f$ at $p,$ and $b_{f}(p)=d-1$ is called the _branched number_ of $f$ at $p.$ If for some $p\in\partial D,$ the corresponding $d\geq 3,$ then $p$ is called a _ramification point_ , $f(q)$ is called a _branched point_ , $v_{f}(p)=\left[\frac{d}{2}\right]$ is called the multiplicity of $f$ at $p,$ and $b_{f}(p)=\left[\frac{d+1}{2}\right]-1$ is called the branched number of $f$ at $p.$ In the definition, “orientation preserved” means that for any regular point $p\in\overline{\Delta}$ of $f,$ there is a closed Jordan domain $K_{p}$ in $\overline{\Delta}$ that is a neighborhood999This means that if $p\in\Delta,$ $p$ is contained in the interior of $K_{p}$ in $\mathbb{C},$ and if $p\in\partial\Delta,$ $p$ is contained in the interior of the arc $K_{p}\cap\partial\Delta$ in $\partial\Delta.$ of $p$ in $\overline{\Delta}$ such that $\widetilde{f}=P^{-1}\circ f$ or $\frac{1}{\widetilde{f}}$ maps $K_{p}$ homeomorphically onto a Jordan domain $K^{\prime}$ in $\mathbb{C}$ such that when $z$ goes along $\partial K_{p}$ anticlockwise, $\widetilde{f}(z)$ goes along $\partial K^{\prime}$ anticlockwise. For a normal mapping $f:\overline{D}\rightarrow S$, $f$ has only finitely many ramification points. $p\in\overline{D}$ is called a regular point of $f$ if $v_{p}(f)=1.$ The reader may be puzzled by the definition of $v_{f}(p)$ and $b_{f}(p)$ when $p\in\partial D.$ As a matter of fact, the definition in this case follows from the fact that we can extend the mapping $f$ to be a normal mapping so that $p$ becomes an interior ramification point with multiplicity $\left[\frac{d+1}{2}\right].$ For a Jordan domain $D$ and a normal mapping $f:\overline{D}\rightarrow S,$ the boundary curve $\Gamma_{f}=f(z),z\in\partial D,$ is a polygonal closed curve. Then the term _natural vertex_ , _natural edge,_ _natural partition, permitted partition,_ etc. introduced in Section 2 are well defined for $\Gamma_{f}.$ ###### Definition 3.2. For a Jordan domain $D$ and a normal mapping $f:\overline{D}\rightarrow S.$ We define $V(f)$ to be the number of natural vertices of the boundary curve $\Gamma_{f}=f(z),z\in\partial D;$ define $V_{E}(f)$ to be the number of natural vertices of $\Gamma_{f}$ that is contained in $E$ and define $V_{NE}(f)=V(f)-V_{E}(f),$ which is the number of natural vertices of $\Gamma_{f}$ that is not contained in $E.$ Recall that $E$ always denotes the set $\\{0,1,\infty\\}$ in $S.$ Let $f:\overline{D}\rightarrow S$ be a normal mapping. Then by the definition, $\overline{D}$ has a triangulation such that each ramification point of $f$ is a vertex of the triangulation and $f$ restricted to each triangle of the triangulation of $\overline{D}$ is a homeomorphism onto a real triangle on $S,$ i.e., each edge of the triangle is straight. Then $f$ and the triangulation of $\overline{D}$ induce a triangulation of the Riemann surface of $f;$ which is consisted of real triangles in $S.$ Therefore, the following two lemmas are obvious. ###### Lemma 3.1. Let $D$ be a Jordan domain in $\mathbb{C}$ and let $f:\overline{D}\rightarrow S$ be a normal __ mapping. Then for any Jordan domain $D_{1}$ contained in $D,$ the restriction of $f$ to $\overline{D_{1}}$ is a normal mapping, provided that the curve $f(z),z\in\partial D_{1},$ is a polygonal curve. ###### Lemma 3.2. Let $D$ be a Jordan domain in $\mathbb{C}$, let $\alpha$ be a Jordan path in $\overline{D}$ such that the interior101010This means the curve $\alpha$ without endpoints. of $\alpha$ is contained in $D$ and $\alpha$ has two distinct endpoints lying on $\partial D$, let $D_{1}$ and $D_{2}$ be the two components of $D\backslash\alpha$, and let $f_{j}:\overline{D_{j}}\rightarrow S$ be two normal mappings, $j=1,2$. If $f_{1}(z)=f_{2}(z)$ for each $z\in\alpha,$ then the mapping $F=\left\\{\begin{array}[]{l}f_{1}(z),z\in\overline{D_{1}},\\\ f_{2}(z),z\in D\backslash\overline{D_{1}},\end{array}\right.$ is a normal mapping defined on $\overline{D}.$ ###### Lemma 3.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let $q\in f(\overline{\Delta}).$ Then, for sufficiently small disk $D(q)$ in $S$ centered at $q,$ $f^{-1}(\overline{D(q)})$ is a union of disjoint closed domains $\overline{U_{j}}$ in $\overline{\Delta},j=1,2,\dots,n,$ such that for each $j,$ $\overline{U_{j}}$ is the closure of a (relatively) open subset $U_{j}$ of $\overline{\Delta},$ $U_{j}\cap f^{-1}(q)$ contains exactly one point $x_{j}$ and the followings holds: (i). If $x_{j}\in\Delta,$ then $f$ restricted to $\overline{U_{j}}$ is a branched covering mapping onto $\overline{D(q)}$ such that $x_{j}$ is the unique possible ramification point. (ii). If $x_{j}\in\partial\Delta,\ $then $f(\overline{U_{j}})=\overline{D(q)}$ or $f(\overline{U_{j}})$ is a closed sector of $\overline{D(q)}$, and there exist homeomorphisms $\phi_{j}$ from $\overline{U_{j}}$ onto the closed half disk $\overline{\Delta^{+}}$ and $\psi_{j}$ from $D(q)$ onto $\overline{\Delta}$ such that $\phi_{j}(x_{j})=0,\ \phi_{j}(\overline{U_{j}}\cap\partial\Delta)=[-1,1],$ and $\psi_{j}\circ f\circ\phi_{j}^{-1}(\xi)=\xi^{d_{j}},\xi\in\overline{\Delta^{+}},$ for some positive integer $d_{j}$. ###### Proof. The proof is quite simple and standard. Note that in (ii) $f(\overline{U_{j}}\cap\Delta)$ may be the disk $D(q)$ omitting a radius. ∎ ###### Corollary 3.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that has a ramification point $p_{0}\in\partial\Delta$. Then $\partial\Delta$ has a section $\alpha_{1}$ from $p_{0}$ to some point in $\partial\Delta\backslash\\{p_{0}\\}$ such that $\beta=f(z),z\in\alpha_{1},$ is a simple path in $S$ starting from $f(p_{0})$ and, lifted by $f,$ $\beta$ has $b=b_{f}(p_{0})$ lifts $\alpha_{2},\dots,\alpha_{b+1}$ that start from $p_{0}$ and satisfy $\alpha_{j}\backslash\\{p_{0}\\}\subset\Delta,j=2,\dots,b+1.$ ###### Lemma 3.4. Let $D$ be a Jordan domain in $\mathbb{C}$ and let $\alpha_{j}=\alpha_{j}(t),t\in[0,1],$ be two paths contained in $\partial D$ such that $\alpha_{1}(0)=\alpha_{2}(0)$ and $\alpha_{1}\cap\alpha_{2}$ contains at most two points. Let $f:\overline{D}\rightarrow S$ be a normal mapping such that $f(\alpha_{1}(t))=f(\alpha_{2}(t)),t\in[0,1].$ If $\alpha_{1}(1)\neq\alpha_{2}(1),$ then $f$ can be regarded as a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $A(g,\Delta)=A(f,D),L(g,\partial\Delta)=L(f,\left(\partial D\right)\backslash\\{\alpha_{1}\cup\alpha_{2}\\}),$ and $\Gamma_{g}=g(z),z\in\partial\Delta,$ is the same as the closed curve $\Gamma_{f}=f(z),z\in\left\\{\left(\partial D\right)\backslash\left[\alpha_{1}\cup\alpha_{2}\right]\right\\}\cup\\{\alpha_{1}(1)\\},$ ignoring a parameter transformation. If $\alpha_{1}(1)=\alpha_{2}(1),$ then $f$ can be regard as an open continuous mapping $g$ from the sphere $S$ onto itself. And so, $f$ takes every value in $S.$ ###### Proof. The proof is the standard gluing argument that glue the domain $D$ by identifying $\alpha_{1}(t)$ and $\alpha_{2}(t)$ for each $t\in[0,1]$. ∎ ###### Lemma 3.5. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let $p_{0}\in\overline{\Delta}$ be a ramification point of $f$. Assume that $\beta=\beta(t),t\in[0,1],$ is a polygonal Jordan path in $S$ such that the followings hold. (a) $\beta(0)=f(p_{0}),$ $\beta$ has two distinct lifts $\alpha_{j}=\alpha_{j}(t),t\in[0,1],$ in $\overline{\Delta}$ by $f,$ with $\alpha_{j}(0)=p_{0}$ and (3.1) $f(\alpha_{1}(t))=f(\alpha_{2}(t))=\beta(t),t\in[0,1],j=1,2.$ (b) The interior $\alpha_{j}^{\circ}=\alpha_{j}(t),t\in(0,1),$ of $\alpha_{j}$ is contained in $\Delta,j=1,2,\ $and $\\{\alpha_{1}(1),\alpha_{2}(1)\\}\subset\partial\Delta.$ (c) $f$ has no ramification point in the interior of $\alpha_{1}$ and $\alpha_{2}.$ Then $\alpha_{1}(1)\neq\alpha_{2}(1).$ ###### Proof. Since there is no ramification point in the interiors of $\alpha_{1}$ and $\alpha_{2},$ we have (3.2) $\alpha_{1}\cap\alpha_{2}\subset\\{\alpha_{1}(0),\alpha_{1}(1)\\}.$ By (3.1) and (b), (3.3) $\beta(t)\neq 0,1,\infty,t\in(0,1).$ If $\alpha_{1}(1)=\alpha_{2}(1),$ then $\alpha_{1}-\alpha_{2},$ or $\alpha_{2}-\alpha_{1},$ encloses a Jordan domain $D$ in $\overline{\Delta},$ and then by Lemma 3.4, $f(\overline{D})=S.$ But $f$ is a normal mapping, and then $f(D)\subset f(\Delta)\subset S\backslash\\{0,1,\infty\\},$ and then by (3.2) and (3.3) we have $f^{-1}(\\{0,1,\infty\\})\subset\\{\alpha_{1}(0),\alpha_{2}(1)=\alpha_{2}(1)\\}.$ Therefore we have $f(\overline{D})\neq S$. This is a contradiction. ∎ ## 4\. A classical isoperimetric inequality of the unit hemisphere In this section we use Bernstein’s isoperimetric inequality to prove theorems 4.3 and 4.4, which will be used in Section 14. The following result is obtained by Bernstein in 1905. ###### Theorem 4.1 (Bernstein inequality [2]). Let $\Gamma$ be a simple curve in some hemisphere $S^{\ast}$ of $S.$ Then the length $L=L(\Gamma)$ and the area $A$ of the domain in $S^{\ast}$ enclosed by $\Gamma$ satisfy $L^{2}\geq 4\pi A-A^{2},$ equality holds if and only if $\Gamma$ is a circle. The following inequality is another version of Bernstein inequality. ###### Corollary 4.1. Under the same hypothesis and additional condition $L(\Gamma)\leq 2\pi,$ $A\leq 2\pi\left(1-\sqrt{1-R^{2}}\right),$ equality holds if and only if $\Gamma$ is a circle, where $R=\frac{L(\Gamma)}{2\pi}.$ In fact, any circle in $S$ with Euclidian radius $R$ divides the sphere into two spherical disks with areas $2\pi\left(1\pm\sqrt{1-R^{2}}\right).$ The following result is obtained by Ladó in 1935. ###### Theorem 4.2 (Ladó [5]). Any closed curve in $S$ with length less than $2\pi$ is contained in some open hemisphere. ###### Corollary 4.2. Let $l$ be a given positive number with $\pi<l<\sqrt{2}\pi,$ let $l_{1}$ and $l_{2}$ be positive numbers with $l_{1}+l_{2}=l\ \mathrm{and\ }l_{j}\geq\frac{\pi}{2},j=1,2,$ and, for $j=1,2,$ let $\gamma_{j}$ be a circular path in $S$ such that $\gamma_{j}$ has endpoints $\\{0,1\\}$, $L(\gamma_{j})=l_{j},$ and $\gamma=\gamma_{1}+\gamma_{2}$ is a Jordan curve that encloses a domain $D_{\gamma}$ in some hemisphere of $S.$ Then the area of $D_{\gamma}$ assumes the maximum if and only if $l_{1}=l_{2}=\frac{1}{2}l$ and $D_{\gamma}$ is convex. By this corollary, $D_{\gamma}$ assume the maximum if and only $D_{\gamma}$ is congruent with the domain $D_{l}$ defined in Section 1. ###### Proof. This follows from Corollary 4.1 and Theorem 4.2 directly. Let $\Gamma_{1}$ be a circle passing through $0$ and $1$ in $S$ so that the length of the section $\alpha_{1}$ of $\Gamma_{1}$ from $0$ to $1$ is $\frac{l}{2}$ and $\Gamma_{1}$ is convex in the sense that the disk inside $\Gamma_{1}$ is contained in some open hemisphere of $S$. Then by the assumption, we have $L(\alpha_{1})<L(\Gamma_{1}\backslash\alpha_{1}),$ and then there is a point $p\in\Gamma_{1}\backslash\alpha_{1}$ so that the section $\alpha_{2}$ of $\Gamma_{1}$ from $1$ to $p$ has length $\frac{l}{2}$ as well. We replace $\alpha_{j}$ with $\gamma_{j}^{\prime}$ so that $\gamma_{j}^{\prime}$ is congruent with $\gamma_{j},j=1,2,$ and that the circle $\Gamma_{1}$ becomes a Jordan curve $\Gamma_{2}$ that is convex everywhere, except at $0,1$ and $p,$ in the sense that the triangle $\overline{0,1,p,0}$ is inside the closure of the domain inside $\Gamma_{2}$. It is clear that $L(\Gamma_{1})=L(\Gamma_{2})<2\pi,$ and thus by Theorem 4.2, $\Gamma_{j}$ is contained in some hemisphere $S_{j}$ of $S,j=1,2$. Then by Theorem 4.1 $A_{\Gamma_{1}}\geq A_{\Gamma_{2}},$ the equality holds if and only if $\Gamma_{2}$ is a circle, where $A_{\Gamma_{j}}$ is the area enclosed by $\Gamma_{j}$ in $S_{j},j=1,2.$ From this, the conclusion follows. ∎ ###### Lemma 4.1. Let $l<2\pi$ be a positive number and let $l_{1},l_{2},\dots,l_{n}$ be nonnegative numbers with $0\leq l_{1}\leq l_{2}\leq\dots\leq l_{n}\ \mathrm{and\ }l_{1}+l_{2}+\dots+l_{n}=l.$ Then $\sum_{k=1}^{n}\left(2\pi-\sqrt{(2\pi)^{2}-l_{k}^{2}}\right)\leq 2\pi-\sqrt{(2\pi)^{2}-l^{2}},$ the equality holds if and only if $l_{1}=\dots=l_{n-1}=0$ and $l_{n}=l.$ ###### Proof. There is a standard way in calculus to prove this. In fact, it also follows from Bernstein’s inequality and Ladó’s theorem directly. ∎ ###### Theorem 4.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that $L(f,\partial\Delta)<2\pi.$ Then (4.1) $A(f,\Delta)\leq A(D_{f})=\frac{1-\sqrt{1-R_{f}^{2}}}{R_{f}}L(f,\partial\Delta)<L(f,\partial\Delta)$ with $R_{f}=\frac{L(f,\partial\Delta)}{2\pi}$ and $D_{f}$ is a disk in some open hemisphere of $S$ with $L(\partial D_{f})=L(f,\partial\Delta).$ If, in addition, $L(f,\partial\Delta)\geq\sqrt{2}\pi,$ then (4.2) $4\pi+A(f,\Delta)<4L(f,\partial\Delta).$ ###### Proof. We first show that (4.3) $A(f,\Delta)\leq 2\pi-\sqrt{4\pi^{2}-\left(L(f,\partial\Delta)\right)^{2}}.$ We may assume that (a) The boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ has finitely many multiple points, i.e. there is a finite set $Q\subset\partial\Delta,$ such that $f$ restricted to $\left(\partial\Delta\right)\backslash Q$ is injective. If (a) fails, we may conside the restriction $f_{1}=f|_{\overline{D}}$ of $f$ to some closed Jordan domain $\overline{D}\subset\overline{\Delta},$ such that the boundary curve $\Gamma_{f_{1}}=f_{1}(z)=f(z),z\in\partial D,$ of $f_{1}$ satisfies (a), while $|A(f,\Delta)-A(f_{1},D)|$ and $|L(f,\partial\Delta)-L(f_{1},\partial D)|$ may be made arbitrarily small. Then we prove (4.3) for $f_{1},$ which implies (4.3) for $f$. By Theorem 4.2, $f(\partial\Delta)$ is contained in some open hemisphere $S^{\prime}$ of $S,$ and then $f(\partial\Delta)\cap\left(S\backslash S^{\prime}\right)=\emptyset.$ If $f(\Delta)\cap\left(S\backslash S^{\prime}\right)\neq\emptyset,$ then, since $f$ is normal and a normal mapping is an open mapping, it is clear that $S\backslash S^{\prime}\subset f(\Delta),$ which implies that $f(\Delta)\cap E\neq\emptyset$ (recall that $E=\\{0,1,\infty\\}),$ for $S\backslash S^{\prime}$ is a closed hemisphere of $S$ and a closed hemisphere of $S$ must contain at least one point of $E.$ But this contradicts that $f$ is a normal mapping. Thus, the followings holds. (b) $f(\overline{\Delta})$ is contained in $S^{\prime}.$ For each positive integer $j,$ let $\Delta_{j}$ be the set that for each point $p\in\Delta_{j},$ $f(z)=p$ has at least $j$ solutions in $\Delta$, counted with multiplicities. Since $f$ is normal, there exists a positive integer $n$ such that $n$ is the largest number with $\Delta_{n}\neq\emptyset.$ Then (4.4) $A(f,\Delta)=\sum_{j=1}^{n}A(\Delta_{j}),$ and by (a), considering that $f$ is a normal mapping, it is clear that for any pair $\\{j,k\\}$ with $j\neq k,$ $\left(\partial\Delta_{j}\right)\cap\left(\partial\Delta_{k}\right)$ is a finite set and (4.5) $L(f,\partial\Delta)=\sum_{j=1}^{n}L(\partial\Delta_{j}).$ For each $j\leq n,$ $\Delta_{j}$ is a union of finitely many components $\Delta_{jk},k=1,2,\dots,k_{j},$ each of which is a domain also contained in $S^{\prime}$ (by (b)) and is enclosed by a finite number of polygonal Jordan curves. For each $j$ and each $k\leq k_{j},$ Let $\Delta_{jk}^{\ast}$ be the domain which is the complement of the component of $S\backslash\Delta_{jk}$ in $S$ that contains $\partial S^{\prime}.$ Then $\Delta_{jk}^{\ast}$ is a polygonal Jordan domain with $\partial\Delta_{jk}^{\ast}\subset\partial\Delta_{jk}\mathrm{\ but\ }\Delta_{jk}^{\ast}\supset\Delta_{jk},$ and then by Corollary 4.1 we have $A(\Delta_{jk})\leq A(\Delta_{jk}^{\ast})\leq 2\pi-\sqrt{4\pi^{2}-L(\partial\Delta_{jk}^{\ast})^{2}}\leq 2\pi-\sqrt{4\pi^{2}-L(\partial\Delta_{jk})^{2}},$ i.e. $A(\Delta_{jk})\leq 2\pi-\sqrt{4\pi^{2}-L(\partial\Delta_{jk})^{2}},$ for each $j\leq n$ and each $k\leq k_{j}.$ Then, by Lemma 4.1 we have $\displaystyle\sum_{j=1}^{n}\sum_{k=1}^{k_{j}}A(\Delta_{jk})$ $\displaystyle\leq$ $\displaystyle\sum_{j=1}^{n}\sum_{k=1}^{k_{j}}(2\pi-\sqrt{4\pi^{2}-L(\partial\Delta_{jk})^{2}})$ $\displaystyle\leq$ $\displaystyle 2\pi-\sqrt{4\pi^{2}-\left(\sum_{j=1}^{n}\sum_{k=1}^{k_{j}}L(\partial\Delta_{jk})\right)^{2}},$ the second equality holds if and only if $n=1$ and $\Delta_{1}=f(\Delta).$ By (4.4) and (4.5), considering that $\sum_{j=1}^{n}A(\Delta_{j})=\sum_{j=1}^{n}\sum_{k=1}^{k_{j}}A(\Delta_{jk}),$ and $\sum_{j=1}^{n}L(\partial\Delta_{j})=\sum_{j=1}^{n}\sum_{k=1}^{k_{j}}L(\partial\Delta_{jk}),$ we have (4.3). Let $R_{f}=\frac{L(f,\partial\Delta)}{2\pi}.$ Then by (4.3), considering that $R_{f}<1,$ we have $\displaystyle A(f,\Delta)$ $\displaystyle\leq$ $\displaystyle 2\pi(1-\sqrt{1-R_{f}^{2}})$ $\displaystyle=$ $\displaystyle\frac{1-\sqrt{1-R_{f}^{2}}}{R_{f}}L(f,\partial\Delta)$ $\displaystyle<$ $\displaystyle L(f,\partial\Delta),$ and (4.1) is proved. On the other hand, under the additional assumption $L(f,\partial\Delta)\geq\sqrt{2}\pi,$ we have $\frac{4\pi}{L(f,\partial\Delta)}\leq 2\sqrt{2},$ and then by (4.1), we have $A(f,\Delta)+4\pi<L(f,\partial\Delta)+4\pi\leq\left(1+2\sqrt{2}\right)L(f,\partial\Delta)<4L(f,\partial\Delta).$ This completes the proof. ∎ ###### Corollary 4.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that $f$ maps the diameter $I=[-1,1]$ of $\overline{\Delta}$ homeomorphically onto the line segment $\gamma=\overline{0,1}$ in $S$ and (4.6) $L(f,\partial\Delta)<\sqrt{2}\pi.$ Then $A(f,\Delta)\leq A(D_{l}),$ where $D_{l}$ is the convex Jordan domain in $S$ which is contained in the spherical disk in $S$ with diameter $\overline{0,1}$ and is enclosed by the two circular arcs in $S,$ each of which has endpoints $\\{0,1\\}$ and length $l=\frac{1}{2}L(f,\partial\Delta).$ ###### Remark 4.1. The domain $D_{l}$ defined here is congruent with the domain $D_{l}$ defined in Section 1 and the convexity of $D_{l}$ is ensured by (4.6). ###### Proof. This follows from Corollaries 4.2 and Theorem 4.3. Without loss of generality, we assume that the orientation of $f([-1,1])\subset S$ is from $0$ to $1.$ Let $\alpha^{+}=\\{z\in\partial\Delta;\mathrm{Im}z\geq 0\\},\ \alpha^{-}=\\{z\in\partial\Delta;\mathrm{Im}z\leq 0\\},$ $\Delta^{+}=\\{z\in\Delta;\mathrm{Im}z>0\\},\ \Delta^{-}=\\{z\in\Delta;\mathrm{Im}z<0\\}.$ Then by (4.6) there uniquely exists a circle $C$ in $S$ passing through $0$ and $1$ such that the interior $\overline{0,1}^{\circ}$ of $\overline{0,1}$ is contained in the disk $K$ enclosed by $C$ and the section $c_{1}$ of $C$ from $1$ to $0$ has length $L(f,\alpha^{+}).$ Then, by the assumption, it is clear that $L(c_{1})=L(f,\alpha^{+})\geq\frac{\pi}{2}.$ If $f(\alpha^{+})=\frac{\pi}{2},$ then by the assumption we have $f(\partial\Delta^{+})=\overline{0,1},$ and then $f(\Delta^{+})$ must contains $\infty,$ for normal mappings are open mappings. But this contradicts the assumption that $f$ is normal and as a normal mapping $f(z)\neq 0,1,\infty$ for all $z\in\Delta$. Thus we have $L(f,\alpha^{+})>\frac{\pi}{2},$ which implies (4.7) $L(\partial K)=L(C)<2\pi.$ Thus $\overline{0,1}+c_{1}$ encloses a Jordan domain $D_{1}$ and $D_{2}=K\backslash\overline{D_{1}}$ is also a Jordan domain. We may extend $f|_{\overline{\Delta^{+}}}$ to be a continuous mapping $F:\overline{\Delta}\rightarrow S$ such that $F$ restricted to $\overline{\Delta^{-}}$ is a homeomorphism onto $\overline{D_{2}}$ and restricted to $\alpha^{-}$ is a homeomorphism onto $C\backslash c_{1}.$ Then, we have $L(F,\partial\Delta)=L(f,\alpha^{+})+L(F,\alpha^{-})=L(c_{1})+L(C\backslash c_{1})=L(C),$ which, with (4.7), implies (4.8) $L(F,\partial\Delta)=L(\partial K)=L(C)<2\pi.$ $F$ is not a normal mapping, and so we can not apply Theorem 4.3 to $F$ directly. But by (4.8) we can apply Theorem 4.3 to a normal mapping $g$ so that $|L(g,\partial\Delta)-L(F,\partial\Delta)|$ and $|A(g,\Delta)-A(F,\Delta)|$ can be made arbitrarily small, and finally obtain (4.9) $A(F,\Delta)\leq A(D_{F}),$ where $D_{F}$ is a disk in some hemisphere of $S$ with (4.10) $L(\partial D_{F})=L(F,\partial\Delta).$ $F$ is not normal just because the boundary curve $\Gamma_{F}=F(z),z\in\partial\Delta,$ is not polygonal. Since $F(\alpha^{+})=f(\alpha^{+})$ is already polygonal, $F(\alpha^{-})=C\backslash c_{1}$ and $\partial\Delta=\alpha^{+}\cup\alpha^{-},$ the mapping $g$ mentioned above can be obtained by restricting $F$ to a domain $\Delta_{g}\subset\Delta$ with $\Delta_{g}\supset\Delta^{+}.$ By (4.8) and (4.10) we have $L(\partial D_{F})=L(\partial K),$ which implies $A(D_{F})=A(K).$ Thus, by (4.9) we have $A(F,\Delta)\leq A(K).$ Therefore, by the facts $A(K)=A(D_{1})+A(D_{2})$ and $A(F,\Delta)=A(f,\Delta^{+})+A(D_{2})$ we have $A(f,\Delta^{+})\leq A(D_{1}).$ Similarly, we can show that $A(f,\Delta^{-})\leq A(D_{1}^{\prime}),$ where $D_{1}^{\prime}$ is the convex domain in some hemisphere of $S$ and is enclosed by $\overline{1,0}$ and the circular arc $c_{2}$ from $0$ to $1$ with $L(c_{2})=L(f,\alpha^{-}).$ Then $\gamma=c_{1}+c_{2}$ encloses a Jordan domain $D_{\gamma}$ with $A(D_{\gamma})=A(D_{1})+A(D_{1}^{\prime})$ and $A(f,\Delta)\leq A(D_{1})+A(D_{1}^{\prime})=A(D_{\gamma}),$ and by Corollary 4.2, the desired result follows. This completes the proof. ∎ Let $\alpha$ be a circular path in the upper half plane $\mathrm{Im}z\geq 0$ from $1$ to $0$ and let $\mathfrak{A}_{\alpha}$ be the domain in $\mathbb{C}$ enclosed by $\alpha$ and the interval $[0,1]$ and assume $L(\alpha)\leq\frac{\sqrt{2}}{2}\pi,$ which means that $\alpha$ is contained in the closed half-disk $\\{z\in\mathbb{C};\ \mathrm{Im}z\geq 0\ \mathrm{and\ }|z-\frac{1}{2}|<\frac{1}{2}\\}.$ Then $\frac{\pi}{2}\leq L(\alpha)\leq\frac{\sqrt{2}}{2}\pi.$ We want to find the relation between the spherical length $L(\alpha)$ and the spherical area $A(\mathfrak{A}_{\alpha}).$ We will show that both $L(\alpha)$ and $A(\mathfrak{A}_{\alpha})$ is a real analytical function of $\tau=\sin\theta_{a},0\leq\theta_{\alpha}\leq\frac{\pi}{2}.$ where $\theta_{\alpha}$ is the value of the angle between $\alpha$ and the interval $[0,1]$ at $0.$ ###### Lemma 4.2. In the above setting, we have (4.11) $L(\alpha)=\zeta_{0}(\tau):=\frac{2}{\sqrt{1+\tau^{2}}}(\frac{\pi}{2}-\arctan\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}),\tau\in[0,1],$ and (4.12) $A(\mathfrak{A}_{\alpha})=\zeta_{1}(\tau):=2\arcsin\tau-\tau\zeta_{0}(\tau),\tau\in[0,1].$ ###### Proof. Let $c_{\alpha}\in\mathbb{C}$ be the center of the circle containing $\alpha.$ Then $\mathrm{Re}c_{\alpha}=\frac{1}{2},$ and since $L(\alpha)\leq\frac{\sqrt{2}}{2}\pi,$ $\mathrm{Im}c_{\alpha}\leq 0.$ Let $d_{\alpha}=2c_{\alpha}.$ Then the triangle in $\mathbb{C}$ with vertices $0,1$ and $d_{\alpha}$ is a right-angled triangle and $\theta_{\alpha}$ is the value of the angle at $d_{\alpha}.$ It is clear that $|d_{\alpha}|=\frac{1}{\sin\theta_{\alpha}}.$ On the other hand, for any point $z\in\alpha,$ it is clear that $|z|=\sin(\theta_{\alpha}-t)|d_{\alpha}|,$ where $t=\arg z.$ Then we obtain a parameter expression of the circular path $\alpha$: $\alpha=\alpha(t)=\frac{\sin(\theta_{\alpha}-t)}{\sin\theta_{\alpha}}e^{it},t\in[0,\theta_{\alpha}],$ Then we have $|d\alpha(t)|=\frac{|-e^{it}\cos(\theta_{\alpha}-t)+ie^{it}\sin(\theta_{\alpha}-t)|}{\sin\theta_{\alpha}}dt=\frac{dt}{\sin\theta_{\alpha}},$ and $\displaystyle L(\alpha)$ $\displaystyle=$ $\displaystyle\int_{\alpha}\frac{2|dz|}{1+|z|^{2}}=\int_{0}^{\theta_{\alpha}}\frac{2|d\alpha(t)|}{1+|\alpha(t)|^{2}}$ $\displaystyle=$ $\displaystyle\int_{0}^{\theta_{\alpha}}\frac{2\sin\theta_{\alpha}}{\sin^{2}\theta_{\alpha}+\sin^{2}(\theta_{\alpha}-t)}dt$ $\displaystyle=$ $\displaystyle\int_{0}^{\theta_{\alpha}}\frac{2\sin\theta_{\alpha}}{\sin^{2}\theta_{\alpha}+\sin^{2}x}dx$ $\displaystyle=$ $\displaystyle\frac{2}{\sqrt{1+\sin^{2}\theta_{\alpha}}}\left(\frac{\pi}{2}-\arctan\frac{\sqrt{1-\sin^{2}\theta_{\alpha}}}{\sqrt{1+\sin^{2}\theta_{\alpha}}}\right),$ and we have (4.11). On the other hand, we have $\displaystyle A(\mathfrak{A}_{\alpha})$ $\displaystyle=$ $\displaystyle\iint\limits_{\mathfrak{A}_{\alpha}}\frac{4dxdy}{\left(1+|z|^{2}\right)^{2}}$ $\displaystyle=$ $\displaystyle\int_{0}^{\theta_{a}}dt\int_{0}^{|\alpha(t)|}\frac{4rdr}{\left(1+r^{2}\right)^{2}}=2\int_{0}^{\theta_{a}}\left(1-\frac{1}{1+|\alpha(t)|^{2}}\right)dt$ $\displaystyle=$ $\displaystyle 2\theta_{\alpha}-2\int_{0}^{\theta_{a}}\frac{dt}{1+|\alpha(t)|^{2}}$ $\displaystyle=$ $\displaystyle 2\theta_{a}-2\int_{0}^{\theta_{a}}\frac{\sin^{2}\theta_{\alpha}dx}{\sin^{2}\theta_{\alpha}+\sin^{2}x}$ $\displaystyle=$ $\displaystyle 2\theta_{a}-\sin\theta_{\alpha}L(\alpha),$ and we have (4.12). ∎ It is clear from the geometrical sense that the function $\zeta_{0}(\tau)=\frac{2}{\sqrt{1+\tau^{2}}}\left(\frac{\pi}{2}-\arctan\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}\right),\tau\in[0,1]$ is an injective mapping. ###### Corollary 4.4. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that $f$ maps the diameter $[-1,1]$ of $\overline{\Delta}$ homeomorphically onto the line segment $\overline{0,1}$ in $S$ and $L(f,\partial\Delta)<\sqrt{2}\pi.$ Then $A(f,\Delta)\leq 2\zeta_{1}(\tau)=4\arcsin\tau-2\tau\zeta_{0}(\tau),$ where $\tau=\zeta_{0}^{-1}(\frac{1}{2}L(f,\partial\Delta))$. ###### Proof. This follows from Lemma 4.2 and Corollary 4.3 directly. ∎ ###### Theorem 4.4. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that $f$ maps the diameter $[-1,1]$ of $\overline{\Delta}$ homeomorphically onto the interval $[0,1]$ in $S$ and $L(f,\partial\Delta)<\sqrt{2}\pi.$ Then $4\pi+A(f,\Delta)\leq h_{0}L(f,\partial\Delta),$ where $h_{0}$ is given by (1.3), i.e. $h_{0}=\max_{\tau\in[0,1]}\left[\frac{\sqrt{1+\tau^{2}}\left(\pi+\arcsin\tau\right)}{\mathrm{arccot}\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}}-\tau\right].$ ###### Proof. Let $\tau=\zeta_{0}^{-1}(\frac{1}{2}L(f,\partial\Delta)).$ Then $L(f,\partial\Delta)=2\zeta_{0}(\tau)$ and by Corollary 4.4. $A(f,\Delta)\leq 2\zeta_{1}(\tau).$ Then $\displaystyle 4\pi+A(f,\Delta)$ $\displaystyle\leq$ $\displaystyle 4\pi+2\zeta_{1}(\tau)$ $\displaystyle=$ $\displaystyle\frac{4\pi+2\zeta_{1}(\tau)}{L(f,\partial\Delta)}L(f,\partial\Delta)$ $\displaystyle=$ $\displaystyle\frac{4\pi+2\zeta_{1}(\tau)}{2\zeta_{0}(\tau)}L(f,\partial\Delta)$ $\displaystyle=$ $\displaystyle\frac{2\pi+\zeta_{1}(\tau)}{\zeta_{0}(\tau)}L(f,\partial\Delta)\leq h_{0}L(f,\partial\Delta),$ where $\displaystyle h_{0}$ $\displaystyle=$ $\displaystyle\max_{\tau\in[0,1]}\frac{2\pi+\zeta_{1}(\tau)}{\zeta_{0}(\tau)}=\max_{\tau\in[0,1]}\frac{2\pi+2\arcsin\tau-\tau\zeta_{0}(\tau)}{\zeta_{0}(\tau)}$ $\displaystyle=$ $\displaystyle\max_{\tau\in[0,1]}\left[\frac{2\pi+2\arcsin\tau}{\frac{2}{\sqrt{1+\tau^{2}}}\left(\frac{\pi}{2}-\arctan\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}\right)}-\tau\right]$ $\displaystyle=$ $\displaystyle\max_{\tau\in[0,1]}\left[\frac{\sqrt{1+\tau^{2}}\left(\pi+\arcsin\tau\right)}{\mathrm{arccot}\frac{\sqrt{1-\tau^{2}}}{\sqrt{1+\tau^{2}}}}-\tau\right].$ ∎ ## 5\. Locally convex polygonal paths and curves in the Riemann sphere The goal of Sections 5–7 is to prove Theorem 7.1, which is the second key step to prove the main theorem. In this section we prove some results about locally convex polygonal Jordan paths and curves, which is used in Sections 6 and 7. It is clear that a generic convex triangle111111See Definition 2.11. in $S$ is contained in some open hemisphere of $S,$ and then we have the followings. ###### Lemma 5.1. Let $T\subset S$ be a triangle domain inside121212By definition, “inside” means “on the left hand side of”. a generic convex triangle $\overline{q_{1}q_{2}q_{3}q_{1}}$ in $S.$ Then for any $q\in T$, the notation $\overline{q_{1}qq_{3}q_{1}}$ makes sense and denotes a generic convex triangle. The following result is easy to see. ###### Lemma 5.2. For any polygonal convex Jordan curve $\Gamma$ in $S$ and any natural edge131313By definition, natural edges are oriented by the polygonal curve. $l$ of $\Gamma,$ the domain inside $\Gamma$ is contained in the open hemisphere of $S$ which is inside the great circle determined141414This means that the great circle contains $l$ and is oriented by $l$. by $l.$ ###### Lemma 5.3. Let $\Gamma=\Gamma(z),z\in\partial\Delta,$ be a polygonal Jordan curve in $S.$ (i) If $\Gamma$ is convex and contains a pair of antipodal points, then $\Gamma$ is a biangle, and moreover, if in addition $\Gamma$ has a straight edge with length $>\pi,$ then $\Gamma$ is a great circle of $S.$ (ii) If $\Gamma$ is convex and has at least three vertices in the usual sense, i.e. $\Gamma$ can be expressed as $\Gamma=l_{1}+l_{2}+\dots+l_{m},m\geq 3,$ where each $l_{j}$ is a straight edge151515Note that the interior of $l_{j}$ may contain points in $E,$ and so $l_{j}$ may not be a natural edge of $\Gamma,$ by the definition of natual edges. of $\Gamma$ whose endpoints are both strictly convex vertices of $\Gamma$, $j=1,2,\dots,m;$ then for each $j,$ $j=1,2,\dots,m,$ (5.1) $L(l_{j})<\pi$ and for the great circle $C_{l_{j}}$ in $S$ determined by $l_{j},$ (5.2) $\Gamma\cap C_{l_{j}}=l_{j},$ and therefore, $\Gamma$ is contained in some open hemisphere of $S.$ ###### Proof. Assume that $\Gamma$ has a pair of antipodal points $q_{1}$ and $q_{2}$. We show that the section $\Gamma^{\prime}$ of $\Gamma$ from $q_{1}$ to $q_{2}\ $is straight. For any natural edge $e$ of $\Gamma^{\prime}$, by Lemma 5.2, $q_{1}$ and $q_{2}$ are both contained in the closed hemisphere inside the great circle $C_{e}$ determined by $e,$ and thus $q_{1}$ and $q_{2}$ are both contained in $C_{e}.$ By the arbitrariness of $e,$ $\Gamma^{\prime}$ must be a straight path from $q_{1}$ to $q_{2}.$ For the same reason, we can show that $\Gamma\backslash\Gamma^{\prime}$ is also a straight path. Thus, $\Gamma$ is a biangle, which implies the second conclusion of (i), and (i) is proved. Now, we prove (ii). It is clear that (i) implies (5.1) directly, for otherwise $\Gamma$ is a biangle which contains at most two edges in the usual sense. So we may write $\Gamma=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m}q_{1}},m\geq 3,$ where $l_{j}=\overline{q_{j}q_{j+1}}$ with $q_{m+1}=q_{1}.$ We denote by $C_{l_{m}}$, $C_{l_{1}}$ and $C_{l_{2}}$ the great circles in $S$ determined by $l_{m}=\overline{q_{m}q_{1}},l_{1}=\overline{q_{1}q_{2}}\ $and $l_{2}=\overline{q_{2}q_{3}},$ and denote by $D_{l_{m}}$, $D_{l_{1}}$ and $D_{l_{2}}$ the domains inside $C_{l_{m}}$, $C_{l_{1}}$ and $C_{l_{2}},$ respectively. Then, $q_{m}$ and $q_{3}$ must be both contained in $D_{l_{1}},$ since, by the assumption, $\Gamma$ is strictly convex at $q_{1}$ and $q_{2}$; and then, it is clear that $K=\overline{D_{l_{m}}}\cap\overline{D_{l_{1}}}\cap\overline{D_{l_{2}}}$ is a closed triangle domain whose three angles are all strictly less than $\pi$, and then $K$ has a vertex in $D_{l_{1}}$ and $l_{1}=\overline{q_{1}q_{2}}=K\cap C_{l_{1}}.$ On the other hand, it is clear that $\Gamma\cap C_{l_{1}}\supset l_{1}$ and, by Lemma 5.2, $K\supset\Gamma.$ Therefore, we have (5.2) for $j=1$. This completes the proof. ∎ ###### Lemma 5.4. Let $\Gamma$ be a locally convex polygonal Jordan path with initial and terminal point at $q_{1}.$ Assume $\Gamma$ has the following natural partition161616By definition, here ”locally convex” means that for each $j=1,2,\dots,m-1,$ $\overline{q_{j}q_{j+1}q_{j+2}}$ is a convex path from $q_{j}$ to $q_{j+2}.$ So, as a closed curve, $\Gamma$ may not be convex at $q_{1}$, i.e., $\overline{q_{m}q_{1}q_{2}}$ may not be a convex path. (5.3) $\Gamma=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m}q_{1}},m\geq 3,$ such that (5.4) $\overline{q_{1}q_{2}\dots q_{m}}\cap[0,+\infty]=\\{q_{1}\\}.$ Then the followings hold. (i) For each $j=1,\dots,m-2,$ $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}}$ is a generic convex triangle. (ii) The closure $\overline{T_{\Gamma}}$ of the domain $T_{\Gamma}$ inside $\Gamma$ is contained in some open hemisphere of $S.$ (iii) For each triangle domain $T_{j}$ inside the triangle $L_{j},$ $T_{j}\cap T_{k}=\emptyset,1\leq j<k\leq m-2,$ and $\overline{T_{\Gamma}}=\cup_{j=1}^{m-2}\overline{T_{j}}.$ ###### Remark 5.1. (1). Condition (5.4) is used just to ensure that each vertex $q_{j},j=2,3,\dots,m,$ of $\Gamma$ is a _strictly_ convex vertex. Thus, (5.4) can be replaced by the condition that $\Gamma$ is strictly convex at $q_{2},\dots,q_{m}.$ By Definition 2.9, (5.4) can also be replaced by $\\{q_{2},\dots q_{m}\\}\cap E=\emptyset,$ which, with the assumption that $\Gamma$ is locally convex, implies that $\Gamma$ is strictly convex at $q_{2},\dots,q_{m}.$ (2). The reader should notice that (5.3) makes sense if and only if $d(q_{j},q_{j+1})<\pi$ for all $j=1,\dots,m-1,$ by the appointment. (3). By conclusion (ii), in the case that $\overline{q_{m}q_{1}}+\overline{q_{1}q_{m}}$ is straight, we have $L(\overline{q_{m-1}q_{m}}+\overline{q_{m}q_{1}})<\pi.$ Thus if we regard $\Gamma$ as a closed polygonal Jordan curve, each edge, in the usual sense, of $\Gamma$ has length $<\pi,$ and thus, each natural edge of $\Gamma$ has length $<\pi.$ ###### Proof. We regard $\Gamma$ as a closed curve. Then $\Gamma$ is locally convex everywhere, with at most one exceptional point at $q_{1}.$ Let $T_{\Gamma}$ be the polygonal domain inside $\Gamma.$ Then, it is easy to see that there is a path $l$ in $\overline{T_{\Gamma}}$ from $q_{1}$ to some point $q^{\prime}\in\Gamma$ such that the followings hold. (a) $l\cap\overline{q_{s}q_{s+1}}^{\circ}=\\{q^{\prime}\\}$ for some natural edge $\overline{q_{s}q_{s+1}}$ of $\Gamma,$ where $\overline{q_{s}q_{s+1}}^{\circ}$ is the interior of $\overline{q_{s}q_{s+1}}$ (if $s=m,$ $q_{s+1}=q_{1})$. (b) The interior of $l$ is in the domain $T_{\Gamma}.$ (c) $l$ divides the angle $\Theta_{q_{1}}$ of the polygonal domain $T_{\Gamma}$ at $q_{1}$ into two angles, each of which has value $<\pi.$ By the fact that any two distinct straight lines in the sphere $S$ only intersect at a pair of antipodal points, and that (5.3) implies $L(\overline{q_{1}q_{2}})<\pi$ and $L(\overline{q_{m}q_{1}})<\pi,$ we have that (5.5) $l\cap\overline{q_{1}q_{2}}=l\cap\overline{q_{m}q_{1}}=\\{q_{1}\\},$ which implies (5.6) $2\leq s\leq m-1.$ It is easy to see from (a)–(c) that $\Gamma_{1}=\overline{q_{1}q_{2}\dots q_{s}q^{\prime}}-l$ is strictly convex at $q_{1}$ and $q^{\prime},$ and then by (5.4) and the assumption that $\Gamma$ is a locally convex path and that $q_{2},\dots,q_{m}$ are the all natural vertices, $\Gamma_{1}$ is a polygonal convex Jordan curve that is strictly convex at all points $q_{1},\dots,q_{s},q^{\prime}.$ On the other hand, since $\Gamma$ is simple, by (5.5) and (5.6) we conclude that $q_{1},q_{2}$ and $q^{\prime}$ are distinct each other. Therefore, $\Gamma_{1}$ is a convex polygonal Jordan curve that has at least three strictly convex vertices, and thus, by Lemma 5.3 (ii), $\Gamma_{1}\backslash\overline{q_{s}q^{\prime}}$ is contained in the open hemisphere $S^{\prime}$ inside the great circle determined by $\overline{q_{s}q_{s+1}}\supset\overline{q_{s}q^{\prime}}$, and for the same reason, $\Gamma_{2}=\overline{q^{\prime}q_{s+1}\dots q_{m}q_{1}}+l$ is also a convex polygonal Jordan curve that has at least three strictly convex vertices and $\Gamma_{2}\backslash\overline{q^{\prime}q_{s+1}}$ is also contained in $S^{\prime}.$ Thus, $\Gamma\backslash\overline{q_{s}q_{s+1}}$ is contained in $S^{\prime},$ and, considering that $L(\overline{q_{s}q_{s+1}})<\pi,$ we have proved (ii). (i) follows from (ii) and the convexity of $\Gamma_{1}$ and $\Gamma_{2}$; and (iii) follows from (i) and (ii) directly. This completes the proof. ∎ In the rest of this section we assume that $\gamma_{0}$ is a locally convex polygonal Jordan path that has the natural partition (5.7) $\gamma_{0}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{m}},m\geq 3,$ with (5.8) $\gamma_{0}\cap[0,+\infty]=\\{q_{1},q_{m}\\}.$ Then $q_{2},\dots,q_{m-1}$ are natural vertices of $\gamma_{0},$ at which $\gamma_{0}$ is convex, and none of $q_{2},\dots,q_{m-1}$ is contained in $E.$ Thus, by Definitions 2.7 and 2.9 we have that (a) $\gamma_{0}$ is strictly convex at all its natural vertices, the points $q_{2},\dots,q_{m-1}.$ ###### Lemma 5.5. Assume $q_{1}\neq q_{m}$ and let $I_{q_{1}q_{m}}$ be the section of $[0,+\infty]$ from $q_{1}$ to $q_{m}.$ Then the followings hold. (i) $\Gamma=\gamma_{0}-I_{q_{1}q_{m}}$ is a polygonal Jordan curve that is convex everywhere, with at most one exceptional point at $q_{1}$ or $q_{m}$. (ii) $L(I_{q_{1}q_{m}})<\pi,$ and $\Gamma$ and the closure $\overline{T_{\Gamma}}$ of the domain $T_{\Gamma}$ enclosed by $\Gamma=\gamma_{0}-I_{q_{1}q_{m}}=\gamma_{0}+\overline{q_{m}q_{1}}$ is contained in some open hemisphere of $S$. (iii) If, in addition, $q_{1}=0,$ then $\Gamma$ is strictly convex at $q_{m}.$ ###### Proof. It is clear that $\Gamma=\gamma_{0}-I_{q_{1}q_{m}}$ is simple, and by (a) we have (b) $q_{2},\dots,q_{m-1}$ are strictly convex vertices of $\Gamma.$ Thus the possible nonconvex vertices of $\Gamma$ are $q_{1}$ and $q_{m}.$ We show that $\Gamma$ is convex at $q_{1}$ or $q_{m}.$ We assume the contrary that both $q_{1}$ and $q_{m}$ are nonconvex vertices and without loss of generality, we assume (5.9) $q_{1}<q_{m}.$ Then we have171717Note that under this contrary assumption, $\Gamma$ does not go straight at $q_{1},$ nor at $q_{m}$, but turn right at both $q_{1}$ and $q_{m}$. On the other hand, $\overline{q_{1}q_{2}},\overline{q_{m-1}q_{m}}$ make sense if and only if $d\\{q_{1},q_{2}\\}<\pi$ and $d\\{q_{m-1},q_{m}\\}<\pi.$ Thus, $\overline{q_{1}q_{2}}\cap C_{1m}=\\{q_{1}\\}\ $and and $\overline{q_{m-1}q_{m}}\cap C_{1m}=\\{q_{m}\\}$, which, with the assumption $q_{1}<q_{m},$ implies (c). (c) Both $q_{2}$ and $q_{m-1}$ are contained in the open hemisphere $S^{\prime}$ inside the great circle $C_{1m}$ determined by $I_{q_{1}q_{m}}.$ Then by (5.8), $I_{q_{1}q_{m}}$ has a neighborhood $J_{1}$ in the great circle $C_{1m}$ determined by $I_{q_{1}q_{m}}\subset[0,+\infty]$ such that $J_{1}^{\circ}\supset[0,+\infty]$ and $J_{1}\backslash I_{q_{1}q_{m}}\subset T_{\Gamma},$ where $T_{\Gamma}$ is the domain inside $\Gamma$ and $J_{1}^{\circ}$ is the interior of $J_{1}.$ It is clear that there are only two cases need to discuss: Case 1. $C_{1m}\cap\Gamma=I_{q_{1}q_{m}}.$ Case 2. $\left(C_{1m}\cap\Gamma\right)\backslash I_{q_{1}q_{m}}\neq\emptyset.$ Assume Case 1 occurs. Then $C_{1m}\cap\gamma_{0}=\\{q_{1},q_{m}\\},$ and for the section181818Recall that, by the appointment, a section of a curve inherits the orientation of the curve, and so $I_{q_{m}q_{1}}^{\prime}$ is the complementary of $I_{q_{1}q_{m}}^{\circ}$ in $C_{1m}.$ $I_{q_{m}q_{1}}^{\prime}$ of $C_{1m}$ from $q_{m}$ to $q_{1},$ by (5.9) and (c) we conclude that $\Gamma^{\prime}=\gamma_{0}+I_{q_{m}q_{1}}^{\prime}$ is a Jordan curve that is strictly convex at $q_{1}$ and $q_{m},$ and then by (a) and Remark 2.5 we can conclude that $\Gamma^{\prime}$ is a convex polygonal Jordan curve in $S$ and is strictly convex at $q_{1},\dots,q_{m},$ and thus we have by Lemma 5.3 that $L(I_{q_{m}q_{1}}^{\prime})<\pi,$ but on the other hand $L(I_{q_{m}q_{1}}^{\prime})=L(C_{1m})-L(I_{q_{1}q_{m}})\geq 2\pi-L([0,+\infty])=\pi,$ which is a contradiction. Thus, Case 1 can not occur, and then, Case 2 must occur. Then, we can extend the path $J_{1}$ past both sides to be a longer path $J$ from $q^{\prime}$ to $q^{\prime\prime}$ such that (d) $\\{q^{\prime},q^{\prime\prime}\\}\subset\Gamma,\ J$ is oriented by $I_{q_{1}q_{m}},$ the interior of the section of $J$ from $q^{\prime}$ to $q_{1}$ and the interior of the section of $J$ from $q_{m}$ to $q^{\prime\prime}$ are both contained in $T_{\Gamma}.$ Then (5.10) $L(J)>\pi,$ for $J\supset J_{1}^{\circ}\supset[0,+\infty].$ We first show that $q^{\prime}\neq q^{\prime\prime}.$ We assume the contrary that $q^{\prime}=q^{\prime\prime}.$ Then it is clear that $q^{\prime}$ is in the interior $\gamma_{0}^{\circ}$ of $\gamma_{0}$ and, by (d), we have (5.11) $C_{1m}\cap\gamma_{0}^{\circ}=\\{q^{\prime}\\}.$ Then, by (c), (5.11) and the fact that $\gamma_{0}$ is simple and connected, we have (5.12) $\gamma_{0}^{\circ}\backslash\\{q^{\prime}\\}\subset S^{\prime}.$ Since $q^{\prime}\neq q_{1},q_{m},$ $\gamma_{0}$ is convex at $q^{\prime}$ by the assumption. Then by (5.12), $\gamma_{0}$ is strictly convex at $q^{\prime},$ and thus the domain $T_{\Gamma}$ is a polygonal Jordan domain with an angle at $q^{\prime}$ strictly less than $\pi.$ But by (d) and the assumption $q^{\prime}=q^{\prime\prime},$ $J\backslash I_{q_{1}q_{m}}$ is a neighborhood of $q^{\prime}$ in $C_{1m}$ and $\left(J\backslash I_{q_{1}q_{m}}\right)\backslash\\{q^{\prime}\\}\subset T_{\Gamma}$. This is a contradiction. Thus, $q^{\prime}\neq q^{\prime\prime}.$ Let $\gamma_{0}^{\prime}$ be the section of $\gamma_{0}$ from $q^{\prime}$ to $q^{\prime\prime}.$ Then $\Gamma^{\prime}=\gamma_{0}^{\prime}-J$ is a polygonal Jordan curve that is strictly convex at $q^{\prime}\ $and $q^{\prime\prime},$ for $\gamma_{0}$ is a locally convex path, $\\{q^{\prime},q^{\prime\prime}\\}\subset\gamma_{0}^{\prime}\subset\gamma_{0}^{\circ}$, $q^{\prime}$ and $q^{\prime\prime}$ have neighborhoods in $J$ contained in $T_{\Gamma}.$ Thus, $\Gamma^{\prime}$ is convex everywhere by the assumption on $\gamma_{0}$, and then $\Gamma^{\prime}$ is convex by Remark 2.5, and then by (5.10) and Lemma 5.3 (i), $\Gamma^{\prime}$ is a great circle, which is a contradiction since $\Gamma^{\prime}$ strictly convex at $q^{\prime}.$ Summarizing the above argument, we can conclude that $\Gamma$ must be convex at $q_{1}$ or $q_{m}$, and (i) is proved. To prove the inequality in (ii), assume the contrary, that is, $L(I_{q_{1}q_{m}})\geq\pi.$ Then $q_{1}=0\ \mathrm{and\ }q_{m}=\infty,$ and so $L(I_{q_{1}q_{m}})=\pi.$ Without loss of generality, by (i), we may assume that (e) $\Gamma=\gamma_{0}-I_{q_{1}q_{m}}$ is convex at $q_{1}=0.$ If $\Gamma$ is also convex at $q_{m},$ then $\Gamma$ is a convex curve in $S,$ and then by Lemma 5.3 (i), $\Gamma$ is a biangle with vertices $0$ and $\infty$, and then $[0,+\infty]$ and $\gamma_{0}$ should be the two straight edges of the biangle $\Gamma;$ but by (b) this is a contradiction. We first assume that $\Gamma$ is not convex at $q_{m}.$ Then we can extend $I_{q_{1}q_{m}}$ past $q_{m}$ to obtain a longer line segment $J^{\prime}$ from $q_{1}$ to $q^{\prime}$ so that (5.13) $q^{\prime}\in\gamma_{0}\ \mathrm{and\ }\left(J^{\prime}\backslash I_{q_{1}q_{m}}\right)\backslash\\{q^{\prime}\\}\subset T_{\Gamma}.$ If $q^{\prime}=q_{1},$ then we have $J^{\prime}=C_{1m}\ $and then (5.14) $J^{\prime}\backslash I_{q_{1}q_{m}}=C_{1m}\backslash[0,+\infty]\subset T_{\Gamma}.$ But on the other hand, by (e), $\overline{q_{1}q_{2}}\backslash\\{q_{1}\\}$ is either contained in the open hemisphere $S\backslash\overline{S^{\prime}}$ outside $C_{1m},$ or $\overline{q_{1}q_{2}}\subset C_{1m}.$ Then, in the case $q^{\prime}=q_{1},$ we have $\overline{q_{1}q_{2}}\backslash\\{q_{1}\\}\subset S\backslash\overline{S^{\prime}}$ by (5.14), and then $q^{\prime}=q_{1}$ has a neighborhood in $J^{\prime}$ that is outside $T_{\Gamma},$ which contradicts (5.14). Thus, $q^{\prime}\neq q_{1}.$ Then $-J^{\prime}$ and the segment of $\gamma_{0}$ from $q_{1}$ to $q^{\prime}$ compose a polygonal Jordan curve $\Gamma^{\prime},\ $and $\Gamma^{\prime}$ is strictly convex at $q^{\prime},$ since $J^{\prime}\backslash I_{q_{1}q_{m}}$ intersects $\Gamma$ at $q^{\prime}$ from the left hand side of $\Gamma,$ by (5.13), and $\Gamma$ is convex at $q^{\prime}(\neq q_{1},q_{m}).$ Hence, by (b) and (e), $\Gamma^{\prime}$ is locally convex polygonal Jordan curve with the straight edge $-J^{\prime}$ with $L(J^{\prime})>\pi,$ which implies that $\Gamma^{\prime}$ is a great circle in $S$ by Lemma 5.3 (i). But this contradicts that $\Gamma^{\prime}$ is strictly convex at $q^{\prime},$ and we obtain a contradiction again. Summarizing the above discussion, we have proved (5.15) $L(I_{q_{1}q_{m}})<\pi,$ the inequality in (ii). Then, we can write $-I_{q_{1}q_{m}}=-\overline{q_{1}q_{m}}=\overline{q_{m}q_{1}},$ and $\Gamma=\overline{q_{1}q_{2}}+\overline{q_{2}q_{2}}+\dots\overline{q_{m-1}q_{m}}+\overline{q_{m}q_{1}}.$ Now we prove that $\Gamma$ is contained in some open hemisphere of $S.$ If $\\{q_{1},q_{m}\\}\subset(0,\infty),$ then by (5.8), neither $q_{2},$ nor $q_{m-1}$ can lie in $C_{1m}$ and thus by (i) $\Gamma$ is strictly convex at $q_{1}$ or $q_{m}.$ Assume $q_{1}=0$. Then, by (5.15), $q_{m}\in(0,\infty)$ and by (5.8) (5.16) $q_{m-1}\notin C_{1m}.$ If $\Gamma$ is not convex at $0,$ then by (i) and by (5.8), $\Gamma$ is strictly convex at $q_{m}.$ If $\Gamma$ is straight near $q_{1},$ then $\overline{q_{1}q_{2}}\subset C_{1m}$ and by (b), $\overline{q_{2}q_{3}}\backslash\\{q_{2}\\}\subset S\backslash\overline{S^{\prime}},$ and then we can extend $\overline{q_{3}q_{2}}$ past $q_{2}$ to a point $q_{2}^{\prime}$ so that $\overline{q_{3}q_{2}^{\prime}}$ makes sense and $\overline{q_{1}q_{2}^{\prime}q_{3}}$ is still strictly convex at $q_{2}^{\prime}.$ Then the curve $\gamma_{0}^{\ast}=\overline{q_{1}q_{2}^{\prime}q_{3}\dots q_{m}}$ satisfies all the assumptions of $\gamma_{0}$ but the curve $\Gamma^{\ast}=\gamma_{0}^{\ast}-I_{q_{1}q_{m}}$ is not convex at $q_{1},$ and thus by (i) and (5.16) $\Gamma^{\ast}$ is strictly convex at $q_{m}.$ But $\Gamma^{\ast}$ and $\Gamma$ coincide near $q_{m},$ and thus $\Gamma$ is strictly convex at $q_{m}.$ If $q_{m}=\infty,$ the discussion is similar. Summarizing the above discussion, we can conclude that $\Gamma$ is strictly convex at $q_{1}$ or $q_{m},$ and thus, by (b), either $\overline{q_{1}q_{2}\dots q_{m}q_{1}}$, or $\overline{q_{m}q_{1}\dots q_{m-1}q_{m}},$ is a locally convex path that is strictly convex at each natural vertices, and then $\Gamma=\overline{q_{1}q_{2}\dots q_{m}q_{1}}$ is contained in some open hemisphere of $S.$ The second part of (ii) is proved, and (ii) is proved completely. Now, assume $q_{1}=0.$ Then $q_{m}\in(0,+\infty)$ by the assumption and (ii). Thus, by the assumption, $q_{m-1}$ is either contained in the open hemisphere $S^{\prime}$ inside the great circle determined by $[0,+\infty],$ or $q_{m-1}\in S\backslash\overline{S^{\prime}}.$ If $q_{m-1}\in S^{\prime},$ then $\Gamma$ is not convex at $q_{m}$ and the open interval of the great circle $C$ determined by $[0,+\infty]$ from $q_{m}$ to $\infty$ is contained in $T_{\Gamma},$ and then we can obtain a contradiction as the above argument involving $J^{\prime}$. Thus $q_{m-1}\in S\backslash\overline{S^{\prime}},$ i.e. $\Gamma$ is strictly convex at $q_{m},$ and (iii) is proved. ∎ ###### Lemma 5.6. If $q_{1}=0$ and $q_{m}\in(0,+\infty),$ then for each $j=1,\dots,m-2,$ $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}}$ is a generic convex triangle and for the triangle domain $T_{j}$ inside $L_{j},$ $T_{j}\cap T_{k}=\emptyset,1\leq j<k\leq m-2,$ $\overline{T_{j}}\cap[0,+\infty]=\\{0\\},\ \mathrm{for\ }j=1,\dots,m-3,$ $\overline{T_{m-2}}\cap[0,+\infty]=\overline{q_{m}q_{1}}.$ ###### Proof. By (b) in the above proof and by Lemma 5.5 (ii) and (iii), $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{m}}+\overline{q_{m}q_{1}}$ is contained in some open hemisphere of $S$ and is strictly convex at $q_{2},\dots,q_{m}$. Then by Lemma 5.4 (iii) and Remark 5.1 (1), the conclusion follows. ∎ ###### Lemma 5.7. If $q_{2}$ is contained in the open hemisphere $S^{\prime}$ inside the great circle $C$ determined by $[0,+\infty]$, $q_{m-1}$ is contained in $S\backslash\overline{S^{\prime}}$, and if (5.17) $\left\\{q_{1},q_{m}\right\\}\subset(0,+\infty),$ then the followings hold. (i) $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}=\overline{q_{1}q_{2}\dots q_{m}q_{1}}$ is a Jordan curve such that $0$ is contained in the domain $T_{\Gamma}$ inside $\Gamma$. (ii) For $q_{0}=0$ and $j=1,\dots,m-1,$ $L_{j}=\overline{q_{0}q_{j}q_{j+1}q_{0}}$ is a generic convex triangle; and for the triangle domain $T_{j}$ inside $L_{j},$ $\overline{T_{j}}\cap[0,+\infty]=\\{0\\},\ \mathrm{for\ }j=2,\dots,m-2,$ $\overline{T_{1}}\cap[0,+\infty]=\overline{q_{0}q_{1}},\ \overline{T_{m-1}}\cap[0,+\infty]=\overline{q_{m}q_{0}}.$ ###### Proof. For any point $q_{1}^{\prime}$ that is in the interior of $\overline{q_{1}q_{2}}$ and is sufficient close to $q_{1},$ by the assumption of the lemma, the polygonal curve $\gamma_{0}^{\prime}=\overline{0q_{1}^{\prime}q_{2}\dots q_{m}}=\overline{0q_{1}^{\prime}}+\dots+\overline{q_{m-1}q_{m}}$ is a locally convex Jordan path and satisfies the assumption on $\gamma_{0}$ just with more edges, then applying Lemma 5.6 to $\gamma_{0}^{\prime}$ and taking $q_{1}^{\prime}\rightarrow q_{1},$ we can obtain (i) and (ii). ∎ ###### Lemma 5.8. If (5.18) $\left\\{q_{1},q_{m}\right\\}\subset(0,+\infty),$ and (5.19) $\\{q_{2},q_{m-1}\\}\subset S^{\prime},$ where $S^{\prime}$ is the open hemisphere inside the great circle determined by $[0,+\infty]$, then the curve $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}=\overline{q_{1}q_{2}\dots q_{m}q_{1}}$ is a convex polygonal Jordan curve, $q_{m}\leq q_{1}$ and $\Gamma$ is strictly convex at $q_{j},j=1,2,\dots,m.$ ###### Proof. We first assume $q_{1}=q_{m}.$ Then $\Gamma=\gamma_{0}=\overline{q_{1}q_{2}}+\dots+\overline{q_{m-1}q_{1}}$ is a locally convex Jordan path, and then $m\geq 4$ and, by (a), $\Gamma$ is strictly convex at $q_{2},\dots,q_{m-1}$, and considering that in this case, (5.8) is reduced to (5.4), we can conclude by Lemma 5.4 that the closure $\overline{T_{\Gamma}}$ of the domain $T_{\Gamma}$ enclosed $\Gamma$ is contained in some open hemisphere of $S.$ On the other hand, by (5.8), (5.18) and (5.19) and the assumption that $q_{1}=q_{m},$ it is easy to see that, if $\overline{q_{m-1}q_{1}q_{2}}$ is not convex at $q_{1},$ then $[0,+\infty]\backslash\\{q_{1}\\}$ will be contained in $T_{\Gamma}$, and then $T_{\Gamma}$ can not be contained in any open hemisphere of $S.$ This is a contradiction. Thus, by (5.18) and (5.19), $\Gamma$ is strictly convex at $q_{1},$ and then by (a), $\Gamma$ is strictly convex at $q_{j},j=1,2,\dots,m.$ Now, we assume $q_{1}\neq q_{m}.$ Then by Lemma 5.5, $\Gamma$ is convex at $q_{1}$ or $q_{m}.$ If $q_{1}<q_{m},$ then $\Gamma$ is neither convex at $q_{1},$ nor at $q_{m}.$ Thus, we must have $q_{m}<q_{1}.$ Then, by (5.18) and (5.19), $\Gamma$ is strictly convex at $q_{1}$ and $q_{m},$ and then by (a), $\Gamma$ is strictly convex at $q_{j},j=1,2,\dots,m.$ ∎ ## 6\. Lifting Lemmas for normal mappings In this section, we prove Theorem 6.1 that is used to prove Theorem 7.1. Theorem 7.1 is the second key step to prove the main theorem. ###### Lemma 6.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let $D$ be a polygonal Jordan domain in $S$ such that $f^{-1}$ has a univalent branch191919”univalent branch” always means that the branch is a homeomorphism. $g$ defined on $D.$ Then $g$ can be extended to be a homeomorphism $\widetilde{g}$ from $\overline{D}$ onto $\widetilde{g}(\overline{D})$. ###### Proof. There is a simple and standard way to prove this by Lemma 3.3. ∎ The following result is obvious but useful. ###### Lemma 6.2. Let $D_{1}$ and $D_{2}$ be Jordan domains in $\mathbb{C}$ and let $f:\overline{D_{1}}\rightarrow\overline{D_{2}}$ be a mapping such that $f:\overline{D_{1}}\rightarrow f(\overline{D_{1}})$ is a homeomorphism. If $f(\partial D_{1})\subset\partial D_{2},$ Then $f(\overline{D_{1}})=\overline{D_{2}}$. ###### Lemma 6.3. Let $p_{1}$ and $p_{2}$ be two distinct points in $\partial\Delta,$ let $\alpha$ be the section202020Recall that $\partial\Delta$ is always orientated anticlockwise, and a section of a curve inherits the orientation of the curve. of $\partial\Delta$ from $p_{1}$ to $p_{2}$ and let $\beta$ be a Jordan path in $\overline{\Delta}$ from $p_{2}$ to $p_{1}$ such that $\alpha$ and $\beta$ have a common point $p_{0}$ with $p_{0}\neq p_{1},p_{2}.$ Assume that $f:\overline{\Delta}\rightarrow S$ is a normal mapping such that the followings hold. (a) The curve $\Gamma_{\alpha}=f(z),z\in\alpha,$ and $\Gamma_{\beta}=f(z),z\in\beta,$ are polygonal paths and are both convex at $p_{0}$. (b) $f$ is regular212121This means that $f$ is homeomorphic in a neighborhood of $p_{0}.$ at $p_{0}.$ Then $p_{0}$ has a neighborhood $\beta^{\prime}$ in $\beta$ such that $\beta^{\prime}\subset\alpha\subset\partial\Delta$ and $f$ restricted to $\beta^{\prime}$ is a line segment in $S$. ###### Proof. By the assumption, $p_{0}$ has a neighborhood $\alpha^{\prime\prime}$ in $\alpha$ and a neighborhood $\beta^{\prime\prime}$ in $\beta,$ such that the curves $f(\alpha^{\prime\prime})$ and $f(\beta^{\prime\prime})$ intersect ”tangently”. ∎ ###### Lemma 6.4. Let $p_{j}=e^{i\theta_{j}}$ be a number of $m$ distinct points in $\partial\Delta$ with $\theta_{1}<\theta_{2}<\dots<\theta_{m}<\theta_{1}+2\pi,$ let $\alpha_{j}$ be the section of $\partial\Delta$ from $p_{j}$ to $p_{j+1},j=1,\dots,m-1,$ let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let (6.1) $q_{j}=f(p_{j}),j=1,\dots m.$ Assume that the followings hold. (a) The section $\Gamma_{0}=f(z),z\in\alpha_{0}=\alpha_{1}+\dots+a_{m}$ of the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is a polygonal Jordan path and each section $\Gamma_{j}=f(\alpha_{j})$ of $\Gamma_{0}$ is a natural edge of $\Gamma_{0}$ with (6.2) $L(\Gamma_{j})<\pi,j=1,\dots,m.$ (b) $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}},j=1,\dots,m-2,$ are generic convex triangles in $S$, the triangle domains $T_{j}$ enclosed by $L_{j}$ are disjoint each other, and $\Gamma=\Gamma_{0}+\overline{q_{m}q_{1}}$ is a polygonal Jordan curve. (c) For the domain $T$ enclosed by $\Gamma,$ $f$ has no branched point in $\overline{T}\backslash\overline{q_{m}q_{1}}.$ (d) The boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $T.$ Then, the followings hold true. (i) $f^{-1}$ has a univalent branch $g$ defined on $\overline{T}$ such that $g$ maps $\Gamma_{0}=\overline{q_{1}q_{2}\dots q_{m}}$ onto $\alpha_{0}=\alpha_{1}+\dots+\alpha_{m-1}$ with $g(q_{j})=p_{j},j=1,2,\dots,m.$ (ii) If in addition, for some _open_ interval $\gamma$ of $\overline{q_{m}q_{1}},$ $f$ has no branched point in $\gamma$ and $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $\gamma,$ then either $g(\gamma)\subset\partial\Delta$ or $g(\gamma)\subset\Delta.$ We first prove the following lemma under the same assumption as that in Lemma 6.4. Note that by (6.1) and (6.2), we can write $\Gamma_{j}=\overline{q_{j}q_{j+1}},j=1,2,\dots,m-1.$ ###### Lemma 6.5. (i). $f^{-1}$ has a univalent branch $g_{1}$ defined on $\overline{T_{1}},$ such that $g_{1}$ restricted to $\overline{q_{1}q_{2}q_{3}}$ is a homeomorphisms onto $\alpha_{1}+\alpha_{2}$ with $g_{1}(q_{j})=p_{j},j=1,2,3.$ (ii). If $m>3,$ then $\beta_{1}=g_{1}(\overline{q_{1}q_{3}})$ is a Jordan path in $\overline{\Delta}$ from $p_{1}$ to $p_{3}$ and the interior of $\beta_{1}$ is contained in $\Delta.$ (iii). If $m=3$ and for some _open_ interval $\gamma$ contained $\overline{q_{m}q_{1}},$ $f$ has no branched point in $\gamma$ and $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $\gamma,$ then either $g(\gamma)\subset\partial\Delta$ or $g(\gamma)\subset\Delta.$ ###### Proof. Write $c_{0}=\alpha_{1}+\alpha_{2}$, $\gamma_{0}=\Gamma_{1}+\Gamma_{2}=\overline{q_{1}q_{2}q_{3}}$ and $\gamma_{1}=\overline{q_{1}q_{3}}$ . Let $v_{1}$ be an interior point of $\gamma_{1}=\overline{q_{1}q_{3}}$ and let $v=v_{s}=v(s)$, $s\in[0,1],$ be a Jordan path that represents the straight path from $q_{2}$ to $v_{1}$ in the closed triangle domain $\overline{T_{1}}$ enclosed by the triangle $L_{1}=\overline{q_{1}q_{2}q_{3}q_{1}}=\gamma_{0}-\gamma_{1}$ . Then, by (b) and Lemma 5.1, for each $s\in(0,1),$ the polygonal Jordan path $\gamma_{s}=\overline{q_{1}v_{s}q_{3}}$ in $\overline{T_{1}}$ is strictly convex at $v_{s}$, and $\gamma_{s},s\in[0,1],$ is a family of curves exhausting the closed domain $\overline{T_{1}}$ and satisfying the following condition (e). (e) For each $s\in(0,1],$ the domain $T_{s}$ inside $\gamma_{0}-\gamma_{s}$ is a (spherical) quadrilateral domain contained in $T_{1}$ and for any pair $s_{1},s_{2}\in(0,1]$ with $s_{1}<s_{2},$ $T_{s_{1}}\cup(\gamma_{s_{1}}\backslash\\{q_{1},q_{3}\\})=\overline{T_{s_{1}}}\backslash\gamma_{0}\subset T_{s_{2}}.$ Since $f$ is normal, by the definition, there exists a point $q_{1}^{\prime}$ in the interior of $\Gamma_{1}=\overline{q_{1}q_{2}}$ and there exists a point $q^{\prime}$ in the domain $T_{1}$ such that $f^{-1}$ has a univalent branch defined on the closure of the triangle domain inside the triangle $\overline{q_{1}q_{1}^{\prime}q^{\prime}q_{1}}\subset\overline{T_{1}}$ and this branch restricted to $\overline{q_{1}q_{1}^{\prime}}$ is a homeomorphism onto a section of $\alpha_{1}\ $from $p_{1}$ to some interior point of $\alpha_{1}.$ At $q_{3}$ we can do this similarly. On the other hand, considering that $\overline{q_{1}q_{2}q_{3}}$ is simple and $f$ is a normal mappings, by (b) and (c), we can conclude that for each $q_{0}$ contained in the interior222222Note that the interior of $\gamma_{0}$ does not intersects $\overline{q_{m}q_{1}},$ and thus $f$ has no branched point in the interior of $\gamma_{0}.$ of $\gamma_{0}=\Gamma_{1}+\Gamma_{2}=\overline{q_{1}q_{2}q_{3}},$ there exists a disk $V_{q_{0}}$ in $S$ such that $f^{-1}$ has a univalent branch defined on $V_{q_{0}}\cap\overline{T_{1}}$ and this branch maps $\gamma_{0}\cap V_{q_{0}}$ onto a section of $c_{0}.$ Summarizing these discussion, we conclude that, for sufficiently small $\delta>0,$ $\delta$ satisfies the following property: (f) $f^{-1}$ has a univalent branch $g_{\delta}$ defined on $\overline{T_{\delta}}$ with $g_{\delta}(q_{j})=p_{j},j=1,2,3,$ $g_{\delta}$ restricted to $\gamma_{0}=\overline{q_{1}q_{2}q_{3}}$ is a homeomorphism onto $c_{0}=\alpha_{1}+\alpha_{2}$ and $c_{\delta}=g_{\delta}(\gamma_{\delta})$ is a Jordan path from $p_{1}$ to $p_{3}$ whose interior is contained in $\Delta.$ If $\delta$ satisfies (f) and $\delta<1$, then $c_{0}-c_{\delta}$ is a Jordan curve, the domain $\widetilde{\Delta}_{\delta}$ inside $c_{0}-c_{\delta}$ is a Jordan domain, $\overline{\Delta}\backslash\widetilde{\Delta}_{\delta}$ is a closed Jordan domain232323By (f), $\alpha_{\delta}$ divides $\Delta$ into two Jordan domains. and $f$ restricted $\overline{\Delta}\backslash\widetilde{\Delta}_{\delta}$ is a normal mapping (note that $f(\partial(\overline{\Delta}\backslash\widetilde{\Delta}_{\delta}))$ is polygonal). In this case, replacing $\overline{\Delta}$ by $\overline{\Delta}\backslash\widetilde{\Delta}_{\delta},$ $c_{0}$ by $c_{\delta},$ $\gamma_{0}$ by $\gamma_{\delta}$ and applying the above argument once more, we can also prove the following property for $\delta:$ (g) For each $\delta\in(0,1),$ if $\delta$ satisfies (f), then for sufficiently small $\varepsilon>0$, $\delta+\varepsilon$ satisfies (f) as well. On the other hand, it is clear that, if $\delta$ satisfies (f), then each positive number $\delta^{\prime}<\delta$ satisfies (f) as well. Thus, for $\delta_{0}=\sup\\{\delta\in(0,1);\ \delta\ \mathrm{satisfies}\ \mathrm{(f)}\\},$ we have (h) Each $\delta\in(0,\delta_{0})$ satisfies (f). To show $\delta_{0}=1,$ we first show that $\delta_{0}$ satisfies (f) if $\delta_{0}<1$. By (e), (f) and (h), $f^{-1}$ has a univalent branch $\widetilde{g}_{\delta_{0}}$ defined on $T_{\delta_{0}}\cup\gamma_{0}$. By Lemma 6.1, $\widetilde{g}_{\delta_{0}}$ can be extended to be a homeomorphism $g_{\delta_{0}}$ defined on $\overline{T_{\delta_{0}}}.$ Thus, $\gamma_{\delta_{0}}$ has a lift $c_{\delta_{0}}=g_{\delta_{0}}(w),w\in\gamma_{\delta_{0}},$ by $f,$ and $c_{\delta_{0}}$ is a Jordan path from $p_{1}$ to $p_{3}$ in $\overline{\Delta}.$ Let $\overline{\widetilde{\Delta}_{\delta_{0}}}=g_{\delta_{0}}(\overline{T_{\delta_{0}}}),$ then $f$ restricted to $\overline{\widetilde{\Delta}_{\delta_{0}}}$ is a homeomorphism onto $\overline{T_{\delta_{0}}}$, and maps $c_{\delta_{0}}$ onto $\gamma_{\delta_{0}}$. Now, we show that the following hold. (j) If $\delta_{0}<1,$ then the interior of $c_{\delta_{0}}$ is contained in $\Delta.$ Assume $\delta_{0}<1$ and let $p_{0}\in c_{\delta_{0}}$ be any interior point of $c_{\delta_{0}}\ $with $p_{0}\in\partial\Delta.$ Then $p_{0}\in\alpha:=\left(\partial\Delta\right)\backslash c_{0}$ and $f(p_{0})$ is in the interior of $\gamma_{\delta_{0}},$ and then $f(p_{0})\in T_{1}.$ Thus, by (d), the curves $\Gamma_{\alpha}=f(z),z\in\alpha=\left(\partial\Delta\right)\backslash c_{0},$ and $\Gamma_{\beta}=f(z),z\in\beta=c_{\delta_{0}},$ are both convex at $p_{0}$ (note that $\Gamma_{\beta}$ is the path $\gamma_{\delta_{0}})$. Therefore, by (c) and Lemma 6.3, $p_{0}$ has a neighborhood $\beta^{\prime}$ in $\beta=c_{\delta_{0}}$ such that $\beta^{\prime}\subset\alpha=\left(\partial\Delta\right)\backslash c_{0}$ and $f(\beta^{\prime})$ is straight. But then, with a continuation argument, we can prove that the whole of $f(c_{\delta_{0}})$ is also straight, which contradicts the fact that $\gamma_{\delta_{0}}=f(c_{\delta_{0}})$ is not straight if $\delta_{0}<1.$ Thus, the interior of $c_{\delta_{0}}$ must be in $\Delta$ and (j) is proved. (j) implies that $\delta_{0}$ satisfies (f) if $\delta_{0}<1.$ This, with (g), implies that if $\delta_{0}<1,$ then $\delta_{0}+\varepsilon$ satisfies (f) for sufficiently small $\varepsilon>0$. This contradicts the definition of $\delta_{0}.$ Thus we have proved $\delta_{0}=1.$ Now that $\delta_{0}=1,$ by (e)–(h), $f^{-1}$ has a univalent branch $\widetilde{g}_{1}$ defined on $T_{1}\cup\gamma_{0},$ and by Lemma 6.1, $\widetilde{g}_{1}$ can be extended to be a homeomorphism $g_{1}$ defined on $\overline{T_{1}}$. Thus, (i) holds. (ii) can be proved as the proof of (j), by (i) and Lemma 6.3, and (iii) can be proved similarly. ∎ ###### Proof of Lemma 6.4. If $m=3,$ then Lemma 6.4 follows from (i) and (iii) of Lemma 6.5. So we may assume $m\geq 4.$ But, without loss of generality, we complete the proof only for the case $m=4.$ We continue the proof of Lemma 6.5. Let $\beta_{1}=g_{1}(\overline{q_{1}q_{3}}).$ Then by Lemma 6.5 (ii), $\beta_{1}^{\circ}\subset\Delta,$ where $\beta_{1}^{\circ}$ is the interior of $\beta_{1}.$ Then $\beta_{1}$ divides $\Delta$ into two Jordan domains. We denote by $\Delta_{1}$ the component of $\Delta\backslash\beta_{1}$ that is on the left hand side of $\beta_{1},$ i.e. $\Delta_{1}=\Delta\backslash g_{1}(\overline{T_{1}}).$ Then, by the assumption $m=4,$ $\Delta_{1}$ is enclosed by $\beta_{1}+\alpha_{3}+\alpha^{\ast}$ where $\alpha^{\ast}$ is the section of $\partial\Delta$ from $p_{m}=p_{4}$ to $p_{1}.$ Again by (a)–(d) and Lemma 6.5 (i), $f^{-1}$ has a univalent branch $g_{2}$ defined on $\overline{T_{2}}$ such that $g_{2}:\overline{T_{2}}\rightarrow g_{2}(\overline{T_{2}})$ is a homeomorphism, restricted to $\overline{q_{1}q_{3}q_{4}}$ is a homeomorphism onto $\beta_{1}+\alpha_{3}$ and $g_{2}(q_{j})=p_{j},j=1,3,4.$ Since $f$ has no branched point in $\overline{T}\backslash\overline{q_{4}q_{1}}$ (note that $m=4),$ $f$ has no branched point on $\overline{q_{3}q_{1}}\backslash\\{q_{1}\\}.$ Thus, $g_{1}$ and $g_{2}$ must be identical on $\overline{q_{3}q_{1}}.$ Then $g_{1}$ and $g_{2}$ make up a univalent branch $g$ of $f^{-1},$ such that $g:\overline{T}=\overline{T_{1}\cup T_{2}}\rightarrow g(\overline{T})$ is a homeomorphism with $g(\overline{q_{1}q_{2}q_{3}q_{4}})=\alpha_{1}+\alpha_{2}+\alpha_{3}$. (i) is proved. (ii) can be proved as the proof of (j). This completes the proof of Lemma 6.4. ∎ ###### Remark 6.1. Lemma 6.4 implies an interesting proposition: let $f:\overline{\Delta}\rightarrow\mathbb{C}$ be an open mapping that is orientation preserved and is locally homeomorphism. Then, $f$ is a homeomorphism, provided that the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex. Here “locally convex” means that when $z$ goes around $\partial\Delta$ anticlockwise, $f(z)$ always go straight or turn left. For example, if we assume that the curve $\Gamma_{f}$ is smooth and is locally straight, or locally on the left hand side of its tangent line, then $\Gamma_{f}$ is locally convex. For later use, we only prove this in a special version for normal mappings, which is the following corollary. ###### Corollary 6.1. Let $\alpha_{0}\ $be a section of $\partial\Delta$ from $p_{1}$ to $p_{m}$ with (6.3) $p_{1}\neq p_{m},$ let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that the section $\gamma_{0}=f(z),z\in\alpha_{0},$ is a closed Jordan path that has the natural partition (6.4) $\gamma_{0}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{1}},$ with $q_{1}=f(p_{1})=f(p_{m})$ and $\\{q_{2},\dots,q_{m-1}\\}\cap E=\emptyset.$ Assume that for the domain $T_{\gamma_{0}}\subset S$ enclosed by $\gamma_{0},$ the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\}.$ Then $f$ has a branched point in $\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\}.$ ###### Proof. Since $\gamma_{0}$ is a closed Jordan path, by (6.4) we have242424Note that (6.11) makes sense iff each term on the right hand side has spherical length $<\pi.$ $m\geq 4.$ Since $\Gamma_{f}$ is locally convex in $\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\},$ $\gamma_{0}$ is a locally convex path, and then by Lemma 5.4 and Remark 5.1 (1), for each $j=1,\dots,m-3,$ $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}}$ is a generic convex triangle such that the triangle domains $T_{j}$ enclosed by $L_{j}$ are disjoint each other and $\overline{T_{\gamma_{0}}}=\cup_{j=1}^{m-3}\overline{T_{j}}$. Assume $f$ has no branched point in $\overline{T_{\gamma_{0}}}\backslash\\{q\\}$. Then, Lemma 6.4 applies, i.e. $f^{-1}$ has a univalent branch $g$ defined on $\overline{T_{\gamma_{0}}}$ such that $g$ restricted to $\overline{q_{1}q_{2}\dots q_{m-1}}$ is a homeomorphism onto a section $\alpha_{0}^{\prime}$ of $\alpha_{0}$ from $p_{1}$ to some point $p_{m-1}^{\prime}\in\alpha_{0}^{\circ},$ here $\alpha_{0}^{\circ}$ is the interior $\alpha_{0}\backslash\\{p_{1},p_{2}\\}$ of $\alpha_{0}.$ Let $\alpha_{0}^{\prime\prime}$ be the section of $\alpha_{0}$ from $p_{m-1}^{\prime}$ to $p_{m},$ then, by the assumption, it is clear that $f$ maps $\alpha_{0}^{\prime\prime}$ homeomorphically onto $\overline{q_{m-1}q_{m}}=\overline{q_{m-1}q_{1}}.$ Since $f$ has no branched point on $\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\}$ and $q_{m-1}\in\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\},$ after an argument of uniqueness of the lifting, we have $g(\overline{q_{m-1}q_{1}})=\alpha_{0}^{\prime\prime}\subset\partial\Delta.$ Then we have $g(\gamma_{0})\subset\partial\Delta,$ and then $g(\gamma_{0})=\partial\Delta$ by Lemma 6.2. Thus $f$ is a homeomorphism, and $\gamma_{0}$ is the whole curve $\Gamma_{f},$ which contradicts (6.3). The proof is completed. ∎ In the rest of this section, let $p_{j}=e^{i\theta_{j}}$ be $m$ distinct points in $\partial\Delta,j=1,\dots,m,$ with $m\geq 3\ \mathrm{and\ }\theta_{1}<\theta_{2}<\dots<\theta_{m}\leq\theta_{1}+2\pi,$ let $\alpha_{j}$ be the section of $\partial\Delta$ from $p_{j}$ to $p_{j+1},j=1,\dots,m-1,$ and let $\alpha_{0}=\alpha_{1}+\alpha_{1}+\dots+\alpha_{m-1}.$ ###### Definition 6.1. The family $\mathcal{F}_{m}$ is defined to be the family of all normal mappings $f:\overline{\Delta}\rightarrow S$ that satisfies all the following conditions (A)–(E). (A) The section $\gamma_{0}=f(z),z\in\alpha_{0},$ of the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is a Jordan path. (B) $\gamma_{0}$ has the natural partition (6.5) $\gamma_{0}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{m}},$ with (6.6) $\gamma_{0}\cap[0,+\infty]=\\{q_{1},q_{m}\\},$ where, $q_{j}=f(p_{j}),$ $j=1,\dots,m,$ and $\overline{q_{j}q_{j+1}}$ is the section $\Gamma_{j}=f(z),z\in\alpha_{j},j=1,\dots,m-1.$ (C) The boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $S\backslash\\{0,\infty\\}.$ (D) $f$ has no ramification point in $\overline{\Delta}.$ (E) $f(\Delta)\cap[0,+\infty]=\emptyset.$ Each $f\in\mathcal{F}_{m}$ will be endowed with all the notations in the definition. By (A) and (B) the curve (6.7) $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}$ is a polygonal Jordan curve. Here it is permitted that $q_{1}=q_{m},$ and in this case $\Gamma=\gamma_{0}.$ Note that by (A), (B), (C) and Definition 2.9, we have (F) $\gamma_{0}$ is a locally convex polygonal Jordan path that is strictly convex at $q_{2},\dots,q_{m-1}.$ Then by (B) and Lemma 5.5 (ii), $\overline{q_{m}q_{1}}$ in (6.7) makes sense. On the other hand, if $q_{1}=q_{m},$ then, by (A) and (6.5), $m\geq 4.$ Therefore, by Lemma 5.4 (for the case $q_{1}=q_{m}$ here) and Lemma 5.5 (for the case $q_{1}\neq q_{m})$ the following holds true. (G) The closure $\overline{T_{\Gamma}}$ of the domain $T_{\Gamma}$ enclosed by $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}$ is contained in some open hemisphere of $S.$ ###### Theorem 6.1. Let $f\in\mathcal{F}_{m}$ and denote by $T_{\Gamma}$ the domain enclosed by $\Gamma.$ Then the followings hold. (i) The restriction $f|_{\Delta}:\Delta\rightarrow T_{\Gamma}\backslash[0,+\infty]$ is a homeomorphism. (ii) $f(\overline{\Delta})$ is contained in some open hemisphere of $S$. (iii) For $\alpha_{0}^{\circ}=\alpha_{0}\backslash\\{p_{1},p_{m}\\},$ (6.8) $f(\alpha_{0}^{\circ})\cap[0,+\infty]=\emptyset,$ (6.9) $f(\left(\partial\Delta\right)\backslash\alpha_{0}^{\circ})\subset[0,+\infty],$ and (6.10) $L(f,\alpha_{0})>L(f,\left(\partial\Delta\right)\backslash\alpha_{0}).$ ###### Proof. By (A) and (B), it is clear that (6.8) holds true. To complete the remained proof, it suffices to consider three cases. Case 1. (6.11) $0=q_{1}\leq q_{m}<+\infty.$ If $q_{1}=q_{m}=0,$ then by (G) we have $\overline{T_{\Gamma}}\cap[0,+\infty]=\\{0\\},$ and then by (C), (D) and Corollary 6.1 we have $p_{1}=p_{m},$ and then, by (A), $f$ maps $\alpha_{0}=\partial\Delta$ homeomorphically onto the closed Jordan curve $\Gamma=\gamma_{0},$ and since $f$ is normal we conclude that $f:\Delta\rightarrow T_{\Gamma}=T_{\Gamma}\backslash[0,+\infty]$ is a homeomorphism, and other conclusions of Theorem 6.1 is trivially hold with $\alpha_{0}=\partial\Delta$, by (G). If $q_{1}\neq q_{m},$ i.e. $q_{1}=0$ and $q_{m}\in(0,+\infty),$ then by Lemma 5.6 the triangles $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}}$ are generic convex for $j=1,2,\dots,m-2,$ the domains $T_{j}$ enclosed by $L_{j}$ are disjoint each other and for the domain $T_{\Gamma}$ enclosed by $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}$ we have $\overline{T_{\Gamma}}=\cup_{j}^{m-2}\overline{T_{j}},\ 0\notin\overline{T_{\Gamma}},$ and $\overline{T_{\Gamma}}\backslash\overline{q_{m}q_{1}}=\overline{T_{\Gamma}}\backslash\overline{q_{m}0}\subset S\backslash\\{0,\infty\\}.$ Then, by (C) and (D), Lemma 6.4 applies, and then, $f^{-1}$ has a univalent branch $g$ defined on $\overline{T_{\Gamma}}$ such that $g$ restricted to $\gamma_{0}$ is a homeomorphism onto $\alpha_{0}.$ Let $\alpha^{\ast}=g(\overline{q_{m}q_{1}}).$ Then $\alpha^{\ast}$ is a Jordan path in $\overline{\Delta}$ from $p_{m}$ to $p_{1}$ and by (E) we have $\alpha^{\ast}\subset\partial\Delta,$ and then $\alpha^{\ast}=\left(\partial\Delta\right)\backslash\alpha_{0}^{\circ}$. This implies that $g(\partial T_{\Gamma})=\partial\Delta,$ and then $f:\overline{\Delta}\rightarrow\overline{T_{\Gamma}}$ and $f:\Delta\rightarrow T_{\Gamma}=T_{\Gamma}\backslash[0,+\infty]$ are homeomorphisms, with $f(\left(\partial\Delta\right)\backslash\alpha_{0}^{\circ})=f(\alpha^{\ast})=\overline{q_{m}q_{1}}\subset[0,+\infty],$ and $L(f,\alpha_{0})=L(\gamma_{0})>L(\overline{q_{m}q_{1}})=L(f,\left(\partial\Delta\right)\backslash\alpha_{0}).$ Then, by (G), the proof is complete for Case 1. Case 2. (6.12) $\\{q_{1},q_{m}\\}\subset(0,+\infty),$ and (6.13) $\\{q_{2},q_{m-1}\\}\subset S^{\prime},$ where $S^{\prime}$ is the open hemisphere inside the great circle determined by $[0,+\infty].$ By (A), (B), (C), (6.12), (6.13) and Lemma 5.8, we have (H) $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}$ is a convex Jordan curve that is strictly convex at all vertices $q_{1},q_{2},\dots,q_{m}.$ We first assume $q_{1}=q_{m}.$ Then the closed curve $\Gamma=\gamma_{0}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{1}}$ is strictly convex at all its vertices $q_{1},\dots,q_{m-1},$ and, by Lemma 5.3 (ii) $\overline{T_{\gamma_{0}}}\backslash\\{q_{1}\\}\subset S^{\prime},$ where $T_{\gamma_{0}}$ is the domain enclosed by $\gamma_{0}.$ Then by (C), (D) and Corollary 6.1, $\alpha_{0}=\alpha_{1}+\alpha_{1}+\dots+\alpha_{m-1}=\partial\Delta,$ i.e. $p_{1}=p_{m}.$ This implies that $f$ restricted to $\partial\Delta$ is a homeomorphism onto $\gamma_{0}$ and then $f$ is a homeomorphism, and the other conclusions are trivial in this setting. Now, we assume $q_{1}\neq q_{m}.$ Then $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}}$ has the following natural partition $\Gamma=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{m}}+\overline{q_{m}q_{1}},$ and by (H) and Lemma 5.3 (ii), $\overline{T_{\Gamma}}\subset S^{\prime}\cup\overline{q_{m}q_{1}},$ which, with (6.12), implies that (6.14) $\overline{T_{\Gamma}}\cap\\{0,\infty\\}=\emptyset\ \mathrm{and\ }\overline{T_{\Gamma}}\cap[0,+\infty]=\overline{q_{m}q_{1}}.$ Then again by (H), the triangles $L_{j}=\overline{q_{1}q_{j+1}q_{j+2}q_{1}}$ are all generic convex triangles and the domains $T_{j}$ enclosed by $L_{j}$ are disjoint each other, and $\overline{T_{\Gamma}}=\cup_{j}^{m-2}\overline{T_{j}}.$ By (C) and (6.14), $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $\overline{T_{\Gamma}}$ and by (D), $f$ has no branched point in $\overline{T_{\Gamma}}.$ Thus, by Lemma 6.4, $f^{-1}$ has a univalent branch $g$ defined on $\overline{T_{\Gamma}}$ such that $g$ maps $\gamma_{0}=\overline{q_{1}q_{2}\dots q_{m}}$ onto $\alpha_{0}$. Let $\alpha^{\ast}=g(\overline{q_{m}q_{1}}).$ Then $\alpha^{\ast}$ is a Jordan path in $\overline{\Delta}$ from $p_{m}$ to $p_{1}.$ By (E), we have $\alpha^{\ast}\subset\partial\Delta,$ and then we have $\alpha^{\ast}=\partial\Delta\backslash\alpha_{0}^{\circ}$ and $g(\partial T_{\Gamma})=g(\Gamma)\subset\partial\Delta$, which, with Lemma 6.2, implies that $g(\overline{T_{\Gamma}})=\overline{\Delta},$ and then $f:\overline{\Delta}\rightarrow\overline{T_{\Gamma}}$ is a homeomorphism. Thus $f:\Delta\rightarrow T_{\Gamma}=T_{\Gamma}\backslash[0,+\infty]$ is a homeomorphism $f(\left(\partial\Delta\right)\backslash\alpha_{0})=\overline{q_{m}q_{1}}\subset[0,+\infty],$ and, by the fact that $L(\gamma_{0})>L(\overline{q_{m}q_{1}}),$ we have $L(f,\alpha_{0})>L(f,\alpha^{\ast})=L(f,\left(\partial\Delta\right)\backslash\alpha_{0}).$ Then, by (G), The proof is complete for Case 2. Case 3. (6.15) $\\{q_{1},q_{m}\\}\subset(0,+\infty),$ and (6.16) $q_{2}\in S^{\prime},q_{m-1}\in S\backslash\overline{S^{\prime}}.$ By (A), (B), (C), (6.15) and (6.16), Lemma 5.7 apply to $\gamma_{0}$, and then we have the following. (I) $0$ is contained in the domain $T_{\Gamma}$, $L_{j}=\overline{0q_{j}q_{j+1}0}$ is a generic convex triangle for $j=1,\dots,m-1$; and for the triangle domain $T_{j}$ enclosed by $L_{j},$ $\overline{T_{j}}\cap[0,+\infty]=\\{0\\},\ \mathrm{for\ }j=2,\dots,m-2,$ $\overline{T_{1}}\cap[0,+\infty]=\overline{0q_{1}},\ \overline{T_{m-1}}\cap[0,+\infty]=\overline{q_{m}0}.$ By (I), we can extend $\overline{q_{1}0}$ past $0$ to some point $q^{\prime}\in\Gamma$ such that the open line segment $\overline{q^{\prime}0}^{\circ}$ is contained in $T_{\Gamma}$ (note that by (G) the notations $\overline{q^{\prime}0}$ and $\overline{q^{\prime}q_{1}}=\overline{q^{\prime}0}+\overline{0q_{1}}$ make sense, i.e. $d(q^{\prime},q_{1})<\pi).$ By (G) and (I), $\overline{q^{\prime}q_{1}}$ divides $T_{\Gamma}$ into two polygonal Jordan domains $T_{1}^{\ast}$ and $T_{2}^{\ast}$ with $q_{2}\in\partial T_{1}^{\ast}$ and $q_{m-1}\in\partial T_{2}^{\ast}$, both $T_{1}^{\ast}$ and $T_{2}^{\ast}$ are strictly convex at $q^{\prime},$ $T_{1}^{\ast}$ is on the left hand side of $\overline{q^{\prime}q_{1}}$ and $T_{2}^{\ast}$ is on the right hand side of $\overline{q^{\prime}q_{1}},$ $q_{1}$ is a strictly convex vertex of of $T_{1}^{\ast}$ and $q_{m}$ is a strictly convex vertex of $T_{2}^{\ast}$. Thus, by (F), both $T_{1}^{\ast}$ and $T_{2}^{\ast}$ are polygonal convex Jordan domains. Considering that $q^{\prime}$, $q_{1}$ and $q_{2}$ are strictly convex vertices of $T_{1}^{\ast},$ by Lemma 5.3, we have (6.17) $\overline{T_{1}^{\ast}}\backslash\overline{q^{\prime}q_{1}}\subset S^{\prime}.$ Let $\gamma_{1}$ be the section of $\gamma_{0}$ from $q_{1}$ to $q^{\prime}$, $p^{\prime}$ the unique point in $\alpha_{0}$ such that $f(p^{\prime})=q^{\prime}$, $\alpha_{0}^{1}$ the section of $\alpha_{0}$ from $p_{1}$ to $p^{\prime}$ and let $\alpha_{0}^{2}$ be the section of $\alpha_{0}$ from $p^{\prime}$ to $p_{m}.$ We may assume $q^{\prime}\in\overline{q_{s}q_{s+1}}^{\circ}$ (in the case $q^{\prime}=q_{s}$ or $q_{s+1},$ the proof is the same). Then $\partial T_{1}^{\ast}=\gamma_{1}+\overline{q^{\prime}q_{1}}=\overline{q_{1}q_{2}}+\dots+\overline{q_{s}q^{\prime}}+\overline{q^{\prime}q_{1}},$ and $T_{1}^{\ast}$ is strictly convex at $q_{1},q_{2},\dots,q_{s},q^{\prime}$, and then $\overline{q_{1}q_{2}q_{3}q_{1}},\dots,\overline{q_{1}q_{s-1}q_{s}q_{1}},$ $\overline{q_{1}q_{s}q^{\prime}q_{1}}$ are generic convex triangles that triangulate $\overline{T_{1}^{\ast}}$. Hence, by (C), (D), (6.17), Lemma 6.4 applies to $\overline{T_{1}^{\ast}}$, and then $f^{-1}$ has a univalent branch $g_{1}$ defined on $\overline{T_{1}^{\ast}}$ such that $g_{1}$ restricted to $\gamma_{1}$ is a homeomorphism onto $\alpha_{0}^{1}$ with $g_{1}(q_{1})=p_{1}\text{{and\ }}g_{1}(q^{\prime})=p^{\prime}.$ For the same reason, $f^{-1}$ has a univalent branch $g_{2}$ defined on $\overline{T_{2}^{\ast}}$ such that $g_{2}$ restricted to $\gamma_{2}=\overline{q^{\prime}q_{s+1}}+\dots+\overline{q_{m-1}q_{m}}$ is a homeomorphism onto $\alpha_{0}^{2}$ with $g_{2}(q_{m})=p_{m}\mathrm{\ and\ }g_{2}(q^{\prime})=p^{\prime}.$ Considering that $f$ has no branched point in $S$ and $g_{1}(q^{\prime})=g_{2}(q^{\prime}).$ We have (6.18) $g_{1}(w)=q_{2}(w),w\in\overline{q^{\prime}0},$ and we denote by $\alpha=g_{1}(\overline{q^{\prime}0})=g_{2}(\overline{q^{\prime}0}).$ By (E) we have $g_{1}(0)=g_{2}(0)\in\partial\Delta,$ and thus, the initial and terminal points of $\alpha$, the points $p^{\prime}$ and $g_{1}(0)=g_{2}(0),$ are contained in $\partial\Delta.$ Then we can glue $g_{1}$ and $g_{2}$ along $\overline{q^{\prime}0}$ to be a multivalent function $G$ such that $G$ restricted to $T_{\Gamma}\backslash\left(\overline{0q_{1}}\cap\overline{0q_{m}}\right)$ is a homeomorphism and restricted to $\overline{T_{j}^{\ast}}$ is the homeomorphism $g_{j}$, $j=1,2.$ Then, it is clear that the interior of $\alpha=g_{1}(\overline{q^{\prime}0})=g_{2}(\overline{q^{\prime}0})$ is contained in $\Delta,$ and thus $\alpha$ divides $\Delta$ into two Jordan domains $\Delta_{1}$ and $\Delta_{2},$ and we assume $\Delta_{1}$ is on the left hand side of $\alpha.$ Let $\alpha^{\prime}=g_{2}(\overline{q_{m}0})$ and $\alpha^{\prime\prime}=g_{1}(\overline{0q_{1}}).$ Then by (E), $\alpha^{\prime}$ is a section of $\partial\Delta$ from $p_{m}$ to $g_{2}(0)$ and $\alpha^{\prime\prime}$ is a section of $\partial\Delta$ from $g_{1}(0)=g_{2}(0)$ to $p_{1}$, since $g_{1}(q_{1})=p_{1}$ and $g_{2}(q_{m})=p_{m}.$ Thus, we can conclude that $f$ maps $\alpha_{0},\alpha^{\prime},\alpha^{\prime\prime}$ homeomorphically onto $\gamma_{0},\overline{q_{m}0},\overline{0q_{1}},$ respectively, and $\partial\Delta=\alpha_{0}+\alpha^{\prime}+\alpha^{\prime\prime}\text{{with\ }}\alpha_{0}^{\circ}\cap\left(\alpha^{\prime}+\alpha^{\prime\prime}\right)=\emptyset.$ This implies that $f$ maps $\Delta$ homeomorphically onto $T_{\Gamma}\backslash\overline{0q_{1}}=T_{\Gamma}\backslash\overline{0q_{m}},$ since $f$ is normal. On the other hand, it is clear that $L(\gamma_{1})>L(\overline{0q_{1}})$ and $L(\gamma_{2})>L(\overline{q_{m}0}).$ Thus, we have $\displaystyle L(f,\alpha_{0})$ $\displaystyle=$ $\displaystyle L(f(\alpha_{0}))=L(\gamma_{0})=L(\gamma_{1})+L(\gamma_{2})>L(\overline{0q_{1}})+L(\overline{q_{m}0})$ $\displaystyle=$ $\displaystyle L(f,\alpha^{\prime\prime}+\alpha^{\prime})=L(f,(\partial\Delta)\backslash\alpha_{0}).$ By (G), $f(\overline{\Delta})\subset\overline{T_{\Gamma}}$ is contained in some open hemisphere of $S$ and it is clear that $f((\partial\Delta)\backslash\alpha_{0}^{\circ})=\overline{q_{m}0}\cup\overline{0q_{1}}\subset[0,+\infty].$ This completes the proof for Case 3, and we have finally proved Theorem 6.1. ∎ ## 7\. Cutting Riemann surfaces along $[0,+\infty]$ In this section we prove the following theorem, which is the second key step to prove the main theorem in Section 14 and is also used to prove Theorem 13.1. Recall that we denote by $[0,+\infty]$ the line segment in $S$ from $0$ to $\infty$ that passes through $1.$ ###### Theorem 7.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that the followings hold. (a) Each natural edge of the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ has length strictly less than $\pi$. (b) $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in252525See Definition 2.5. $S\backslash E,E=\\{0,1,\infty\\}.$ (c) $f$ has no branched point in $S\backslash E.$ (d) $\Gamma_{f}\cap[0,+\infty]$ contains at most finitely many points. Then, in the case $\Delta\cap f^{-1}\left([0,+\infty]\right)=\emptyset,$ $f(\overline{\Delta})$ is contained in some open hemisphere of $S,$ $f:\overline{\Delta}\rightarrow f(\overline{\Delta})$ is a homeomorphism and $\left(\partial\Delta\right)\cap f^{-1}([0,+\infty])$ contains at most one point; and in the case $\Delta\cap f^{-1}\left([0,+\infty]\right)\neq\emptyset,$ the following (i)–(v) hold: (i) Each component of $f^{-1}\left([0,+\infty]\right)\cap\Delta$ is a Jordan path with distinct endpoints contained in $\partial\Delta$ and divides $\Delta$ into two Jordan domains. (ii) Any pair of two distinct components of $f^{-1}([0,+\infty])\cap\Delta$ have at most one common endpoint. (iii) For each component $D$ of $\Delta\backslash f^{-1}\left([0,+\infty]\right),$ $D$ is a Jordan domain and $f$ restrict to $D$ is a homeomorphism. (iv) For each component $D$ of $\Delta\backslash f^{-1}\left([0,+\infty]\right),$ $\left(\partial D\right)\cap(\partial\Delta)$ is consisted of a connected open subset $\alpha_{0}$ and a number of finite points such that $f(\alpha_{0})\cap[0,+\infty]=\emptyset\ \mathrm{and\ }f(\partial D\backslash\alpha_{0})\subset[0,+\infty],$ and $f$ restricted to $\alpha_{0}$ is a homeomorphism. (v) For $\alpha_{0}$ in (iv), if $\alpha_{0}\neq\emptyset$, then $f(\overline{D})$ is contained in some hemisphere of $S$ and $L(f(\alpha_{0}))>L(f,\partial D\backslash\alpha_{0}),$ that is $L(f,\partial D\cap(\partial\Delta))>L(f,\left(\partial D\right)\backslash(\partial\Delta)).$ This theorem has very simple geometrical explanation: when we cut the Riemann surface of $f$ along $[0,+\infty]$ in the case $\Delta\cap f^{-1}\left([0,+\infty]\right)\neq\emptyset,$ we obtain a finite number of pieces, each of which is either the whole sphere $S$ with folded boundary $[0,+\infty],$ or is contained in some open hemisphere of $S$ such that the length of the boundary located in $S\backslash[0,+\infty],$ which is a part of the original boundary of the Riemann surface of $f,$ is larger than the length of the boundary located in $[0,+\infty],$ which is a part of the the new boundary, the cut edges. This geometrical understand of the mapping in the theorem plays an important role in this paper. We first prove the following lemma. ###### Lemma 7.1. Let $g:\overline{\Delta}\rightarrow S$ be a normal mapping that satisfies (a)–(c) of the previous theorem and (7.1) $g(\Delta)\subset S\backslash[0,+\infty].$ Then, (i) $g$ restricted to $\Delta$ is a homeomorphism onto $g(\Delta).$ (ii) $\partial\Delta$ has an open connected subset $\alpha_{0}$ of $\partial\Delta,$ such that $g(\alpha_{0})\cap[0,+\infty]=\emptyset\ \mathrm{and\ }g(\partial\Delta\backslash\alpha_{0})\subset[0,+\infty].$ (iii) If in (ii) $\alpha_{0}\neq\emptyset$, then $g$ restricted to $\alpha_{0}$ is a homeomorphism onto the curve $g(\alpha_{0})$ in $S$ and $L(g(\alpha_{0}))>L(g,\partial\Delta\backslash\alpha_{0})$. (iv) If in (ii), $\alpha_{0}\neq\emptyset,$ then $g(\overline{\Delta})$ is contained in some open hemisphere of $S$. ###### Proof. By condition (c) and (7.1) we have (e) $g$ has no ramification point in $\overline{\Delta}$. Let $p$ be any point in $\partial\Delta$ such that $f(p)=1\in(0,+\infty)\subset S.$ If $\Gamma_{g}=g(z),z\in\partial\Delta,$ is not convex at $p,$ then, since $f$ is normal, there is an open interval $I\subset(0,+\infty)$ whose one endpoint is $1$ such that $I\subset g(\Delta),$ which contradicts (7.1). Thus, $\Gamma_{g}$ is convex at262626This means that $\Gamma_{g}=g(z),z\in\partial\Delta,$ is convex at each point $p\in\left(\partial\Delta\right)\cap g^{-1}(1),$ by Definition 2.5. $1,$ and then by (b), we have (f) $\Gamma_{g}$ is locally convex in $S\backslash\\{0,\infty\\}.$ If $g(\partial\Delta)\cap[0,+\infty]=\emptyset,$ then by (f) $\Gamma_{g}$ is locally convex everywhere, which implies that $\Gamma_{g}$ is locally simple by the definition, and then by Corollary 6.1 and (e), $\Gamma_{g}$ is a simple curve and then $g$ is a homeomorphism from $\overline{\Delta}$ onto $g(\overline{\Delta}).$ On the other hand, in this case, by (a), (f) and Definition 2.5, $\Gamma_{g}$ is a locally convex curve and has at least three natural vertices, at each of which $\Gamma_{g}$ is strictly convex. Thus, by Lemma 5.4 (ii), the closure $\overline{T_{\Gamma_{g}}}$ of the domain $T_{\Gamma_{g}}$ enclosed by $\Gamma_{g}$ is contained in some open hemisphere of $S,$ and thus, $g(\overline{\Delta})\subset\overline{T_{\Gamma_{g}}}$ is contained in some open hemisphere of $S.$ Hence, putting $\alpha_{0}=\partial\Delta,$ (i)–(iv) hold. Consider the case $g(\partial\Delta)\subset[0,+\infty].$ Then $g(\partial\Delta)$ must be a closed interval in $[0,+\infty]$. If $g(\partial\Delta)\neq[0,+\infty],$ then by the fact that $g$ is normal, $g(\Delta)$ contains $0$ or $\infty,$ but this contradicts the assumption. Thus, $g(\partial\Delta)=[0,+\infty],$ and then by (7.1), $g$ restricted to $\Delta$ is a covering onto $S\backslash[0,+\infty]$, which, together with (e), implies that $g$ restricted to $\Delta$ is a homeomorphism, and putting $\alpha_{0}=\emptyset$, we have (ii). Then, in the case $g(\partial\Delta)\cap[0,+\infty]=\emptyset\ \mathrm{or\ }g(\partial\Delta)\subset[0,+\infty],$ the lemma is proved. Now, we assume that $g(\partial\Delta)\cap[0,+\infty]\neq\emptyset$ and $g(\partial\Delta)\backslash[0,+\infty]\neq\emptyset$. Then by (a), $\Gamma_{g}$ has a section (7.2) $\gamma_{0}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{m-1}q_{m}},m\geq 3,$ such that each $q_{2},\dots,q_{m-1}$ are natural vertices of $\Gamma_{g},$ the edges $\overline{q_{2}q_{3}},\dots,\overline{q_{m-2}q_{m-1}}$ are natural edges of $\Gamma_{g}$, (7.3) $\left[\\{q_{2},\dots,q_{m-1}\\}\cup\cup_{j=2}^{m-2}\overline{q_{j}q_{j+1}}\right]\cap[0,+\infty]=\emptyset$ and (7.4) $\\{q_{1},q_{m}\\}\subset[0,+\infty]\ \mathrm{but\ }\gamma_{0}\backslash\\{q_{1},q_{m}\\}\subset S\backslash[0,+\infty].$ By (f) and (7.2)–(7.4), $\gamma_{0}$ is locally simple, i.e. $\overline{q_{j}q_{j+1}}\cap\overline{q_{j+1}q_{j+2}}=\\{q_{j+1}\\}$ for $j=1,\dots,m-2.$ Then, by (7.2)–(7.4), in the case that $\gamma_{0}$ is not simple, there exist integers $s$ and $t$ with $1\leq s<s+1<t\leq m-1$ and a point $q_{s}^{\prime}\in\left(\overline{q_{s}q_{s+1}}\cap\overline{q_{t}q_{t+1}}\right)\backslash\\{q_{1},q_{m}\\}$ such that $\Gamma^{\prime}=\overline{q_{s}^{\prime}q_{s+1}}+\overline{q_{s+1}q_{s+2}}+\dots+\overline{q_{t-1}q_{t}}+\overline{q_{t}q_{s}^{\prime}}$ is a section of $\gamma_{0}$ that is a simple path from $q_{s}^{\prime}$ to $q_{s}^{\prime},$ and $\Gamma^{\prime}\cap[0,+\infty]=\emptyset.$ Therefore, by (f) and Definition 2.9, $\Gamma^{\prime}$ is a locally convex Jordan path272727This does not mean that as a closed curve $\Gamma^{\prime\prime}$ is convex at $q_{s}^{\prime},$ by the definition of locally convex path and locally convex closed curves. that is strictly convex at $q_{s+1},q_{s+2},\dots,q_{t}$, and then, by (a), $\Gamma^{\prime}$ has at least three strictly convex vertices. Therefore, by Lemma 5.4 (ii), $\Gamma^{\prime}$ is contained in some open hemisphere, which implies that $[0,+\infty]\cap\overline{T_{\Gamma^{\prime}}}=\emptyset,$ where $T_{\Gamma^{\prime}}$ is the domain inside $\Gamma^{\prime},$ and then by (f), $\Gamma_{g}=g(z),z\in\partial\Delta,$ is locally convex in $\overline{T_{\Gamma^{\prime}}}.$ Then, $g$ and $\Gamma^{\prime}$ satisfies the assumption of Corollary 6.1, and then $g$ has a branched point in $\overline{T_{\Gamma^{\prime}}}$, which contradicts (e). Thus we have proved (g) $\gamma_{0}$ is a Jordan path. Then $\partial\Delta$ has an open section $\alpha_{0}$ such that $g$ restricted to $\alpha_{0}$ is a homeomorphism onto $\gamma_{0}^{\circ}.$ Then, by (e), (f), (g), (7.1), (7.2) and (7.4), we have $g\in\mathcal{F}_{m},$ and Theorem 6.1 applies. Then $g$ restricted to $\Delta$ is a homeomorphism onto the domain $T_{\Gamma}\backslash[0,+\infty]\subset S,$ where $T_{\Gamma}$ is the domain enclosed by $\Gamma=\gamma_{0}+\overline{q_{m}q_{1}},$ $g(\left(\partial\Delta\right)\backslash\alpha_{0})\subset[0,+\infty],$ $L(g,\alpha_{0})>L(g,\left(\partial\Delta\right)\backslash\alpha_{0}),$ and $g(\overline{\Delta})$ is contained in some open hemisphere of $S.$ Thus, (i)–(v) hold, and the proof is complete. ∎ ###### Proof of Theorem 7.1. We first assume (7.5) $\Delta\cap f^{-1}([0,+\infty])=\emptyset.$ Then Lemma 7.1 applies, and then $f:\Delta\rightarrow f(\Delta)$ is a homeomorphism, $f(\overline{\Delta})$ is contained in some open hemisphere of $S$ and there exists a connected open subset $\alpha_{0}\subset\partial\Delta$ such that (7.6) $f(\alpha_{0})\cap[0,+\infty]=\emptyset,$ (7.7) $f(\left(\partial\Delta\right)\backslash\alpha_{0})\subset[0,+\infty],$ and $f$ restricted to $\alpha_{0}$ is also a homeomorphism onto some curve in $S.$ Then, $\left(\partial\Delta\right)\backslash\alpha_{0}$ is also a connected section of $\partial\Delta$, and $f$ restricted to $\Delta\cup\alpha_{0}$ is also a homeomorphism. By (d) and (7.7), $f(\left(\partial\Delta\right)\backslash\alpha_{0})\subset f(\partial\Delta)\cap[0,+\infty]$ is a finite set. Then, since $\left(\partial\Delta\right)\backslash\alpha_{0}$ is connected, $f(\left(\partial\Delta\right)\backslash\alpha_{0})$ is a singleton, or is empty, which implies that $\left(\partial\Delta\right)\backslash\alpha_{0}$ is a singleton, or is empty, which, with (7.6) and the above argument, implies that $\left(\partial\Delta\right)\cap f^{-1}([0,+\infty])$ contains at most one point and $f:\overline{\Delta}\rightarrow f(\overline{\Delta})$ is a homeomorphism. The theorem is proved under the assumption (7.5). Now, we assume $f(\Delta)\cap[0,+\infty]\neq\emptyset.$ Then by (c) and (d) and the assumption that $f$ is normal, each component of $f^{-1}([0,+\infty])\cap\Delta$ is a simple path in $\Delta$ whose endpoints are distinct and contained in $\partial\Delta,$ i.e. (i) holds true, and $f^{-1}([0,+\infty])\cap\Delta$ has only a finite number of components. This implies that $\Delta\backslash f^{-1}([0,+\infty])$ has a finite number of components, each of which is a Jordan domain. (ii) follows from Lemma 3.5. Let $D$ be any component of $\Delta\backslash f^{-1}([0,+\infty]).$ Then by (i), $D$ is a Jordan domain. Let $g$ be the restricted mapping $g=f|_{\overline{D}}.$ Then $g$ is a normal mapping and each natural edge of $\Gamma_{g}=g(z),z\in\partial D,$ is either a natural edge of $\Gamma_{f}=f(z),z\in\partial\Delta,$ or a section of some natural edge of $\Gamma_{f},$ or an interval contained in $\overline{0,1}$ or $\overline{1,\infty}.$ Thus (a) is satisfied by $g.$ By (b) and (c), $g$ also satisfies (b) and (c), and it is clear that $g(D)\cap[0,+\infty]=\emptyset.$ Thus $g$ satisfies all the assumption of Lemma 7.1, by ignoring a coordinate transform that maps $\overline{D}$ homeomorphically onto $\overline{\Delta}.$ Thus, Lemma 7.1 applies to $g$ and (iii) follows. By Lemma 7.1, $\partial D$ has a connected open subset $\alpha_{0}$ of $\partial D,$ such that (7.6) and (7.7) still hold. It is clear, by (7.6) and (7.7), that $\alpha_{0}=(\partial D)\backslash f^{-1}([0,+\infty]),$ and, by (i) and (ii), that $\left(\partial D\right)\cap\Delta\subset f^{-1}([0,+\infty].$ Then, we have $\alpha_{0}=\left((\partial D)\backslash\Delta\right)\backslash f^{-1}([0,+\infty]),$ and, considering that $(\partial D)\backslash\Delta=\left(\partial D\right)\cap(\partial\Delta),$ we have $\alpha_{0}=\left[\left(\partial D\right)\cap(\partial\Delta)\right]\backslash f^{-1}([0,+\infty]).$ Then, considering that, by (d), $(\partial\Delta)\cap f^{-1}([0,+\infty])$ is a finite set, we conclude that $\left(\partial D\right)\cap(\partial\Delta)\backslash\alpha_{0}$ is a finite set, and thus $\alpha_{0}$ is the interior of $\left(\partial D\right)\cap(\partial\Delta)$ in $\partial\Delta.$ Therefore, by (7.6) and (7.7), we have (iv). (v) follows from (iv) and Lemma 7.1. This completes the proof. ∎ In the above two proofs, we have also proved that: ###### Corollary 7.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that satisfies all assumptions of Theorem 7.1 and let $\Delta_{1}$ be any component of $\Delta\backslash f^{-1}([0,+\infty]).$ Then the restriction $g=f|_{\overline{\Delta_{1}}}$ satisfies all the assumptions of Lemma 7.1, and, furthermore, if $g(\partial\Delta_{1})\subset[0,+\infty],$ then $g(\partial\Delta_{1})=[0,+\infty]$ and $g$ restricted to $\Delta_{1}$ is a homeomorphism onto $S\backslash[0,+\infty].$ The condition (d) in Theorem 7.1 may be removed by the following lemma. ###### Lemma 7.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping satisfying the conditions (a)–(c) of Theorem 7.1. Then for any $\varepsilon>0,$ there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $A(g,\Delta)\geq A(f,\Delta),L(g,\partial\Delta)<L(f,\partial\Delta)+\varepsilon,$ and $g$ satisfies all conditions (a)–(d) of Theorem 7.1. ###### Proof. This can be proved by perturb the natural edges of $f$ lying on $[0,+\infty]$ slightly. Let $\Gamma_{1}$ be any natural edge of $\Gamma_{f}$ such that $\Gamma_{1}\cap[0,+\infty]$ contains more that one point. Then since $\Gamma_{1}$ is a natural edge, it is either contained in the interval $[0,1]$ in $S$, or in the interval $[1,\infty].$ Without loss of generality we assume $\Gamma_{1}\subset[0,1]$ and the orientation of $\Gamma_{1}$ is the same as $\overline{0,1}.$ Then there are four cases: (i) $\Gamma_{1}=\overline{0,1}.$ (ii) $\Gamma_{1}=\overline{0,t_{0}}$ for some $t_{0}\in(0,1).$ (iii) $\Gamma_{1}=\overline{t_{0},t_{1}}$ for some $t_{0},t_{1}\in(0,1).$ (iv) $\Gamma_{1}=\overline{t_{0},1}$ for some $t_{0}\in(0,1).$ In these cases, we can extend the Riemann surface of $f$ by patching a closed triangle domain along $\Gamma_{1}$ so that the vertex $p_{1}^{\prime}$ is very close the middle point of $\Gamma_{1}$ and is on the right hand side of $\Gamma_{1}.$ By Lemma 3.2, the new Riemann surface can be realized by a normal mapping $f_{1}:\overline{\Delta}\rightarrow S.$ It is clear that when $p_{1}^{\prime}$ is sufficiently close to $\frac{1}{2}$ in case (i), or $\frac{t_{0}}{2}$ in case (ii), or $\frac{t_{0}+t_{1}}{2}$ in case (iii), or $\frac{t_{0}+1}{2}$ in case (iv), $f_{1}$ satisfies (a)–(c) of the lemma and $\left|L(f_{1},\partial\Delta)-L(f,\partial\Delta)\right|<\frac{\varepsilon}{V(f)},A(f_{1},\Delta)\geq A(f,\Delta),$ while the number of natural edges that lie on $[0,+\infty]$ is dropped by one. Then repeating the above argument for $f_{1},$ and so on, and finally we can obtain the desired mapping. ∎ ## 8\. Deformation of edges of normal mappings with length larger than $\pi$ In this section we will prove the following theorem, which is prepared for proving Theorem 10.1 and Theorem 11.1. ###### Theorem 8.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping whose boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ has the natural partition $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n},n=V(f),$ that satisfies one of the following conditions (a)–(d). (a) $\pi\leq L(\Gamma_{1})<2\pi,$ $L(\Gamma_{j})<\pi$ for all $j\geq 2,$ and $\Gamma_{1}$ has an endpoint contained in $E=\\{0,1,\infty\\}.$ (b) $\pi\leq L(\Gamma_{1})<2\pi,$ $L(\Gamma_{j})<\pi$ for all $j\geq 2,$ and $\Gamma_{1}$ has no endpoint contained in $E.$ (c) $\pi\leq L(\Gamma_{1})<2\pi$ and $\pi\leq L(\Gamma_{j_{0}})<2\pi$ for some $j_{0}\geq 2,$ $L(\Gamma_{j})<\pi$ for each $j\neq 1,j_{0};$ $\Gamma_{1}$ has an endpoint contained in $E,$ and so does $\Gamma_{j_{0}}$. (d) $2\pi\leq L(\Gamma_{1})<3\pi,$ while $L(\Gamma_{j})<\pi$ for all $j\geq 2.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (i) $L(g,\partial\Delta)\leq L(f,\partial\Delta)$ and $A(g,\Delta)\geq A(f,\Delta)$ (ii) Each natural edge of $g$ has spherical length strictly less than $\pi,$ (iii) In case (a), $V_{NE}(g)\leq V_{NE}(f),\mathrm{\ }V_{E}(g)\geq V_{E}(f)+1,$ and $V(g)\leq V(f)+1;$ In case (b), $V_{NE}(g)\leq V_{NE}(f),\mathrm{\ }V_{E}(g)\geq V_{E}(f)+1,$ and $V(g)\leq V(f)+2;$ In case (c), $V_{NE}(g)\leq V_{NE}(f),\mathrm{\ }V_{E}(g)\geq V_{E}(f)+2,$ and $V(g)\leq V(f)+2;$ In case (d), $V_{NE}(g)=V_{NE}(f)+2,V_{E}(g)=V_{E}(f)+1,\ $and $V(g)=V(f)+3.$ The proof is divided into four parts: Lemmas 8.3–8.6. ###### Lemma 8.1. Let $\Gamma$ be a line segment in $S$ with endpoints $q_{1}$ and $q_{2}$ and $\pi\leq L(\Gamma)<2\pi,$ and let $q_{0}$ be any point in $S\backslash\Gamma.$ Then (8.1) $d(q_{0},q_{1})<\pi,d(q_{0},q_{2})<\pi,$ and $L(\overline{q_{1}q_{0}})+L(\overline{q_{0}q_{2}})\leq L(\Gamma).$ By the first two inequalities, $\overline{q_{1}q_{0}}$ and $\overline{q_{0}q_{2}}$ make sense, which is the shortest paths. ###### Proof. Since $L(\Gamma)\geq\pi,$ the antipodal points of $q_{1}$ and $q_{2}$ are both contained in $\Gamma,$ and thus, neither $q_{1}$, nor $q_{2},$ can be an antipodal point of $q_{0}\in S\backslash\Gamma.$ This implies (8.1). Let $q_{1}^{\prime}$ be the antipodal point of $q_{1}$ in $S$. Then $q_{1}^{\prime}\in\Gamma.$ Let $\Gamma_{1}^{\prime}$ be the section of $\Gamma$ from $q_{1}$ to $q_{1}^{\prime}$ and let $\Gamma_{1}^{\prime\prime}$ be the section of $\Gamma$ from $q_{1}^{\prime}$ to $q_{2}.$ Then it is clear that $\overline{q_{1}q_{0}}+\overline{q_{0}q_{1}^{\prime}}$ is a straight path in $S$ from $q_{1}$ to $q_{1}^{\prime}.$ Thus we have $\displaystyle L(\Gamma)$ $\displaystyle=$ $\displaystyle L(\Gamma_{1}^{\prime})+L(\Gamma_{1}^{\prime\prime})=\pi+L(\Gamma_{1}^{\prime\prime})$ $\displaystyle=$ $\displaystyle L(\overline{q_{1}q_{0}}+\overline{q_{0}q_{1}^{\prime}})+L(\Gamma_{1}^{\prime\prime})$ $\displaystyle=$ $\displaystyle L(\overline{q_{1}q_{0}})+L(\overline{q_{0}q_{1}^{\prime}}+\Gamma_{1}^{\prime\prime})$ $\displaystyle\geq$ $\displaystyle L(\overline{q_{1}q_{0}})+L(\overline{q_{0}q_{2}}),$ and equality holds if and only if $q_{1}$ and $q_{2}$ are a pair of antipodal points of $S.$ ∎ ###### Lemma 8.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that $\Gamma_{f}$ has a natural partition (8.2) $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n},n=V(f),$ such that $L(\Gamma_{1})\geq\pi$ and the initial point of $\Gamma_{1}$ is in $E.$ Then, there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $L(f_{1},\partial\Delta)\leq L(f,\partial\Delta),A(f_{1},\Delta)\geq A(f,\Delta),$ and the boundary curve $\Gamma_{f_{1}}$ has a permitted partition (8.3) $\Gamma_{f_{1}}=\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n},$ such that the end point of $\Gamma_{1}^{\prime}$, which is also the initial point of $\Gamma_{1}^{\prime\prime},$ is contained in $E,$ and $L(\Gamma_{1}^{\prime})<\pi,L(\Gamma_{1}^{\prime\prime})<\pi.$ See definitions in Section 2 for the terms _natural partition_ and _permitted partition_. Since (8.2) is a natural partition and the initial point of $\Gamma_{1}$ is in $E,$ it is clear by (8.3) that the initial point of $\Gamma_{1}^{\prime},$ which is the terminal point of $\Gamma_{n},$ is still the initial point of $\Gamma_{1},$ and then $\Gamma_{3},\dots,\Gamma_{n}$ are still natural edges of $\Gamma_{f_{1}}.$ Then the two endpoints of $\Gamma_{1}^{\prime}$ are both in $E,$ and so $\Gamma_{1}^{\prime}$ is a natual edge. But $\Gamma_{2}$ may not be a natural edge of $\Gamma_{f_{1}}$ and $\Gamma_{2}$ is a natural edge if and only if $\Gamma_{1}^{\prime}$ is. In the case $\Gamma_{2}$ is not a natural edge of $\Gamma_{f_{1}},$ $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ must be a natural edge. ###### Proof. Let $q_{1}$ and $q_{2}$ be the initial and terminal point of $\Gamma_{1},$ respectively. Then, $\Gamma_{1}$ contains the antipodal point $q_{1}^{\prime}$ of $q_{1}.$ Let $C$ be the great circle determined282828Recall that this means that $C$ contains $\Gamma_{1}$ and is oriented by $C.$ by $\Gamma_{1}$ and let $S^{\prime}$ be the open hemisphere outside292929Recall that this means $S^{\prime}$ is on the right hand side of $C.$ $C$. There are only two cases (note that we assumed $q_{1}\in E$ in the lemma): Case 1. $q_{1}\in E,$ $q_{1}^{\prime}\notin E.$ Case 2. $q_{1}\in E,q_{1}^{\prime}\in E.$ Assume the first case occurs. Then we must have $q_{1}=1$ and $q_{1}^{\prime}=-1.$ Then $C$ must separate $0$ and $\infty.$ Without loss of generality, we assume $0\in S^{\prime}.$ Let $\Gamma_{1}^{\prime}=\overline{q_{1}0}=\overline{1,0},$ which is the shortest path in $S$ from $q_{1}=1$ to $0$ and let $\Gamma_{1}^{\prime\prime}=\overline{0q_{2}}.$ Then the curve $\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}$ is a simple path from $q_{1}=1$ to $q_{2}$ and $\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}-\Gamma_{1}$ is a Jordan curve that encloses a domain $T$ in $S^{\prime}$ such that $T$ is on the right hand side of $\Gamma_{1},$ $T\cap E=\emptyset,$ $L(\Gamma_{1}^{\prime})=\frac{\pi}{2},$ and by Lemma 8.1, $L(\Gamma_{1}^{\prime\prime})<\pi\ \mathrm{and\ }L(\Gamma_{1}^{\prime})+L(\Gamma_{1}^{\prime\prime})\leq L(\Gamma_{1}).$ Let $\partial\Delta=\alpha_{1}+\dots+\alpha_{n}$ be a natural partition of $\partial\Delta$ for $\Gamma_{f},$ corresponding303030See Definition 2.3 and Remark 2.1 (2). to (8.2), let $V$ be a Jordan domain outside $\Delta$ with $\left(\partial V\right)\cap\partial\Delta=\alpha_{1},$ and let $g$ be a homeomorphism from $\overline{V}$ onto $\overline{T}$ such that $f|_{\alpha_{1}}=g|_{\alpha_{1}}.$ Then, by Lemma 3.2, $g_{1}=\left\\{\begin{array}[]{l}f(z),z\in\overline{\Delta},\\\ g(z),z\in\overline{V}\backslash\overline{\Delta},\end{array}\right.$ is a normal mapping defined on the closure of the Jordan domain $D=\Delta\cup\alpha_{1}^{\circ}\cup V,$ where $\alpha_{1}^{\circ}$ is the interior of $\alpha_{1}.$ Then the boundary curve $\Gamma_{g_{1}}$ of $g_{1}$ has the permitted partition (8.4) $\Gamma_{g_{1}}=\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n}$ and $A(g_{1},D)=A(f,\Delta)+A(T).$ Then we have $L(g_{1},\partial D)\leq L(f,\partial\Delta)\ \mathrm{and\ }A(g_{1},D)>A(f,\Delta).$ Let $h$ be any homeomorphism from $\overline{D}$ onto $\overline{\Delta}.$ Then $f_{1}=g_{1}\circ h^{-1}$ satisfies all the desired conditions in (ii). Assume Case 2 occur. Then $q_{1}$ and $q_{1}^{\prime}$ must be the pair $\\{0,\infty\\}$, $q_{1}^{\prime}=q_{2},$ and there is no point in $E$ located in the interior of $\Gamma_{1},$ for $\Gamma_{1}$ is a natural edge of $f$. Without loss of generality, we assume that $q_{1}=0$ and $q_{2}=q_{1}^{\prime}=\infty.$ Let $L$ be the straight path from $0$ to $\infty$ that passes through $1.$ Then, the domain $T$ enclosed by $\Gamma_{1}$ and $L$ that is on the right hand side of $\Gamma_{1}$ does not contains point in $E\ $and $\\{\Gamma_{1}\cup T\\}\cap E=\\{0,\infty\\}.$ Let $\Gamma_{1}^{\prime}$ be the section of $L$ from $0$ to $1$ and $\Gamma_{1}^{\prime\prime}$ be the section of $L$ from $1$ to $\infty.$ Then $L(\Gamma^{\prime})=\frac{\pi}{2},L(\Gamma_{1}^{\prime\prime})=\frac{\pi}{2},$ and repeating the process in Case 1, we can obtain a desired $f_{1}$ satisfies all the conditions. ∎ ###### Lemma 8.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, and let (8.5) $\Gamma_{f}=\Gamma_{1}+\dots+\Gamma_{n},n=V(f),$ be the natural partition of $\Gamma_{f}=f(z),z\in\partial\Delta.$ Assume that (a) At least one endpoint of $\Gamma_{1}$ is contained in $E.$ (b) $\pi\leq L(\Gamma_{1})<2\pi,$ but $L(\Gamma_{j})<\pi,j=2,\dots,n.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (i) $L(g,\partial\Delta)\leq L(f,\partial\Delta)$ and $A(g,\Delta)\geq A(f,\Delta)$ (ii) Each natural edge of $g$ has spherical length strictly less than $\pi,$ (iii) $V_{NE}(g)\leq V_{NE}(f)$ and $V_{E}(g)\geq V_{E}(f)+1.$ (iv) $V(g)\leq V(f)+1.$ ###### Proof. Without loss of generality, we assume the initial point $q_{1}$ of $\Gamma_{1}$ is in $E.$ Then by Lemma 8.2, there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that (8.6) $L(f_{1},\partial\Delta)\leq L(f,\partial\Delta),A(f_{1},\Delta)\geq A(f,\Delta),$ and the boundary curve $\Gamma_{f_{1}}$ has a permitted partition (8.7) $\Gamma_{f_{1}}=\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n}$ such that (8.8) $L(\Gamma_{1}^{\prime})=\frac{\pi}{2},L(\Gamma_{1}^{\prime\prime})<\pi,$ the end point of $\Gamma_{1}^{\prime}$, which is also the initial point of $\Gamma_{1}^{\prime\prime},$ is contained in $E.$ It is clear that the initial points of $\Gamma_{1}^{\prime}$ and $\Gamma_{1}$ are the same point and so is in $E,$ for they are both the terminal point of $\Gamma_{n},$ by (8.5) and (8.7), and thus, $\Gamma_{1}^{\prime}$ is a natural edge of $\Gamma_{f_{1}}$ whose two endpoints are in $E,$ the terminal point of $\Gamma_{1}^{\prime\prime}$ is a natural vertex of $\Gamma_{f}$, which may not be a natural vertex of $\Gamma_{f_{1}}$. On the other hand, by (8.5) and (8.7), the terminal points of $\Gamma_{2},\dots,\Gamma_{n}$ are still natural vertices of $\Gamma_{f_{1}}.$ Then we have (8.9) $V_{NE}(f_{1})\leq V_{NE}(f),V_{E}(f_{1})=V_{E}(f)+1,V(f_{1})\leq V(f)+1.$ Case 1. If the terminal point of $\Gamma_{1}$ is also in $E,$ then both $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ have initial and terminal points in $E,$ and then they are natural edges of $f_{1}$ and then (8.7) is a natural partition; therefore, by (8.6)–(8.9) and (b), $g=f_{1}$ is the desired mapping. Case 2. Now assume that the terminal point of $\Gamma_{1}$ is not in $E.$ If $\Gamma_{1}^{\prime\prime}$ is still a natural edge, then (8.7) is still a natural partition, and $g=f_{1}$ is the desired mapping by (b) and (8.9). Assume $\Gamma_{1}^{\prime\prime}$ is not a natural edge. Then $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ will be a natural edge, and then $\Gamma_{f_{1}}$ has the natural partition (8.10) $\Gamma_{f_{1}}=(\Gamma_{1}^{\prime\prime}+\Gamma_{2})+\Gamma_{3}+\dots+\Gamma_{n}+\Gamma_{1}^{\prime},$ the initial point of $\Gamma_{2},$ which is also the terminal point of $\Gamma_{1}^{\prime\prime}$ is now in the interior of the the natural edge $\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)$ and then we have by (8.10) (8.11) $V_{NE}(f_{1})=V_{NE}(f)-1,V_{E}(f_{1})=V_{E}(f)+1,V(f_{1})=V(f).$ On the other hand, by (b) and (8.8) we have (8.12) $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<2\pi.$ If $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<\pi,$ then $g=f_{1}$ is the desired mapping. If $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})\geq\pi,$ then $f_{1}$ satisfies all the assumption of the lemma with natural partition (8.10), and the above argument applies to $f_{1}.$ By (8.10)–(8.12), if we repeat the above argument once, and if we do not arrive at the desired mapping, then $V_{NE}(\cdot)$ drops by one, $V_{E}(\cdot)$ increases by one and $V(\cdot)$ keep invariant. But $V_{NE}(\cdot)\geq 0$ in any case, and so we can reach the desired mapping by repeating the above argument finitely many times. This completes the proof. ∎ ###### Lemma 8.4. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, and let $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n},n=V(f),$ be a natural partition of $\Gamma_{f}=f(z),z\in\partial\Delta.$ Assume that for some positive integer $k_{0}$ with $1<k_{0}\leq n$ the followings hold. (a) $\Gamma_{1}$ has an endpoint contained in $E,$ and so does $\Gamma_{k_{0}}$. (b) $\pi\leq L(\Gamma_{1})<2\pi,\pi\leq L(\Gamma_{k_{0}})<2\pi,$ but $L(\Gamma_{j})<\pi,j\neq 1,k_{0}.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (i) $L(g,\partial\Delta)\leq L(f,\partial\Delta)$ and $A(g,\Delta)\geq A(f,\Delta)$ (ii) Each natural edge of $g$ has spherical length strictly less than $\pi,$ (iii) $V_{NE}(g)\leq V_{NE}(f)$ and $V_{E}(g)\geq V_{E}(f)+2.$ (iv) $V(g)\leq V(f)+2.$ ###### Proof. Without loss of generality, we assume that the initial point $q_{1}$ of $\Gamma_{1}$ is in $E.$ By Lemma 8.2, there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that (8.13) $L(f_{1},\partial\Delta)\leq L(f,\partial\Delta)\ \mathrm{and\ }A(f_{1},\Delta)\geq A(f,\Delta),$ and the boundary curve $\Gamma_{f_{1}}$ has a permitted partition (8.14) $\Gamma_{f_{1}}=\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n}$ such that (8.15) $L(\Gamma_{1}^{\prime})=\frac{\pi}{2},L(\Gamma_{1}^{\prime\prime})<\pi,$ and the end point of $\Gamma_{1}^{\prime}$, which is also the initial point of $\Gamma_{1}^{\prime\prime},$ is contained in $E.$ Then, $\Gamma_{1}^{\prime}$ is a natural edge of $\Gamma_{f_{1}},$ because its endpoints are both in $E.$ If $\Gamma_{1}^{\prime\prime}$ is a natural edge of $f_{1},$ then (8.14) is a natural partition and by (a), (b), (8.14) and (8.15), $f_{1}$ satisfies all assumptions of Lemma 8.3, with $V_{NE}(f_{1})=V_{NE}(f),V_{E}(f_{1})=V_{E}(f)+1,V(f_{1})=V(f)+1,$ and then, by (8.13), we can apply Lemma 8.3 to deform $f_{1}$ to be another normal mapping $g$ satisfying (i)–(iv) with $\left\\{\begin{array}[]{l}V_{NE}(g)\leq V_{NE}(f_{1})=V_{NE}(f),\\\ V_{E}(g)\geq V_{E}(f_{1})+1=V_{E}(f)+2,\\\ V(g)\leq V(f_{1})+1=V(f)+2.\end{array}\right.$ Now, assume that (c) $\Gamma_{1}^{\prime\prime}$ is not a natural edge of $\Gamma_{f_{1}}$. We complete the proof by induction on $k_{0}\geq 2.$ We first assume $k_{0}=2.$ Then by the assumption (c), $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ must be a natural edge, $\Gamma_{f_{1}}$ has the natural partition (8.16) $\Gamma_{f_{1}}=\Gamma_{1}^{\prime}+\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)+\Gamma_{3}+\dots+\Gamma_{n},$ with (8.17) $V_{NE}(f_{1})=V_{NE}(f)-1,V_{E}(f_{1})=V_{E}(f)+1,V(f_{1})=V(f),$ and the initial point of $\Gamma_{2}$ is not contained in $E,$ for, otherwise, $\Gamma_{1}^{\prime\prime}$ has two endpoints in $E$, which implies that $\Gamma_{1}^{\prime\prime}$ is a natural edge. Therefore, by (a), the initial and terminal points of the natural edge $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ of $\Gamma_{f_{1}}$ are both contained in $E.$ By the definition, each natural edge of a closed polygonal curve with initial and terminal points in $E$ is simple and has length $\frac{\pi}{2},$ $\pi,$ or $2\pi.$ Then by (b) and the fact that $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})>L(\Gamma_{2})\geq\pi$ we have $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})=2\pi.$ Note that we are in the situation that $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ is a natural edge of $\Gamma_{f_{1}}$ and a natural edge never contains any point of $E$ in its interior, and then we conclude that $C=\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ is a great circle passing through $1$ with $C\cap E=\\{1\\}$ (so, $1$ is the initial and terminal point of $C).$ Then $C$ separates $0$ and $\infty,$ without loss of generality we assume $0$ is on the right hand side of $C.$ Let $\partial\Delta=\alpha_{1}+\alpha_{2}+\dots+\alpha_{n}$ be a natural partition of $\partial\Delta$ corresponding to (8.16) (see Definition 2.3). Then $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ is the section of $\Gamma_{f_{1}}$ restricted to $\alpha_{2}$. Let $V$ be a bounded Jordan domain in $\mathbb{C}$ that is outside $\Delta$ with $\left(\partial\Delta\right)\cap\left(\partial V\right)=\alpha_{2}$, let $p_{1}$ and $p_{2}$ be the initial and terminal points of $\alpha_{2},$ respectively, and let $T$ be the hemisphere on the right hand side of $C$ with the path $\overline{0,1}$ being removed. Then, there exists a continuous mapping $\tau$ from $\overline{V}$ onto $\overline{T}$ such that $\tau|_{\alpha_{2}}=f_{1}|_{\alpha_{2}},$ $\tau$ restricted to $\alpha_{2}\cup V$ is a homeomorphism onto $(\Gamma_{1}^{\prime\prime}+\Gamma_{2})\cup T$ with $\tau(\alpha_{2})=\Gamma_{1}^{\prime\prime}+\Gamma_{2},$ and $\tau$ restricted to $\left(\partial V\right)\backslash\alpha_{2}=\left(\partial V\right)\backslash\overline{\Delta}$ is a folded $2$ to $1$ mapping onto $\overline{0,1}$. Then by Lemma 3.2, the mapping $f^{\ast}=\left\\{\begin{array}[]{l}f_{1}(z),z\in\overline{\Delta},\\\ \tau(z),z\in\overline{V}\backslash\overline{\Delta},\end{array}\right.$ is a normal mapping defined on the closure of the Jordan domain $\Delta^{\ast}=\Delta\cup V\cup\alpha_{2}\backslash\\{p_{1},p_{2}\\},$ with $A(f^{\ast},\Delta^{\ast})=A(f_{1},\Delta)+A(T),\ $ and $\displaystyle L(f^{\ast},\partial\Delta^{\ast})$ $\displaystyle=$ $\displaystyle L(f_{1},\left(\left(\partial\Delta\right)\backslash\alpha_{2}\right))+L(f,\left(\partial V\right)\backslash\alpha_{2})$ $\displaystyle=$ $\displaystyle L(f_{1},\partial\Delta)-L(f_{1},\alpha_{2})+L(f,\left(\partial V\right)\backslash\alpha_{2})$ $\displaystyle=$ $\displaystyle L(f_{1},\partial\Delta)-L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})+L(\overline{1,0})+L(\overline{0,1})$ $\displaystyle=$ $\displaystyle L(f_{1},\partial\Delta)-2\pi+\frac{\pi}{2}+\frac{\pi}{2}$ $\displaystyle<$ $\displaystyle L(f_{1},\partial\Delta),$ and the boundary curve $\Gamma_{f^{\ast}}$ has a natural partition $\Gamma_{f^{\ast}}=\Gamma_{1}^{\prime}+\Gamma_{2}^{\prime}+\Gamma_{2}^{\prime\prime}+\Gamma_{3}+\dots+\Gamma_{n},$ and we have $V_{E}(f^{\ast})=V_{E}(f_{1})+1$ and $V(f^{\ast})=V(f_{1})+1,$ and then by (8.17) we have $V_{E}(f^{\ast})\geq V_{E}(f)+2,V(f^{\ast})\leq V(f)+2.$ Considering that $V(f^{\ast})=V_{E}(f^{\ast})+V_{NE}(f^{\ast})$ and regarding $\Delta^{\ast}$ as a disk, we obtained the desired mapping $g=f^{\ast}$ that satisfies (i)–(iv). The proof is complete for the case $k_{0}=2$ under the assumption (c). Then we have in fact prove the lemma in the case $k_{0}=2.$ Now, assume that for some positive integer $m$ with $2\leq m<n=V(f),$ Lemma 8.4 holds true for all $k_{0}$ with $2\leq k_{0}\leq m.$ We prove that Lemma 8.4 holds true for $k_{0}=m+1.$ To prove the lemma for $k_{0}=m+1,$ it is suffices to prove the lemma under the assumption (c). By the assumption (c), $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ is still a natural edge of $\Gamma_{f_{1}}$ and since $k_{0}=m+1\geq 3$ we have, by (b) and (8.15), that $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<2\pi,$ the initial point of $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ is in $E$, and (8.17) still holds. If $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<\pi,$ then $f_{1}$ also satisfies all assumptions of Lemma 8.3 and by (8.17) we can again deform $f_{1}$ to be another normal mapping $g$ such that (i)–(iv) hold. If $\pi\leq L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<2\pi,$ then, considering that by (8.14) $\Gamma_{f_{1}}$ also has the following natural partition $\Gamma_{f_{1}}=\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)+\Gamma_{3}+\dots+\Gamma_{n}+\Gamma_{1}^{\prime},$ $f_{1}$ satisfies all the assumption of Lemma 8.4, with $k_{0}=m.$ Then by the induction hypothesis, the proof is complete. ∎ ###### Lemma 8.5. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let $\Gamma_{f}=\Gamma_{1}+\dots+\Gamma_{n},n=V(f),$ be a natural partition of $\Gamma_{f}=f(z),z\in\partial\Delta.$ Assume that the following hold. (a) $\pi\leq L(\Gamma_{1})<2\pi$ but $L(\Gamma_{j})<\pi$ for all $j=2,\dots,n.$ (b) The two endpoints of $\Gamma_{1}$ are outside $E.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (i) $L(g,\partial\Delta)\leq L(f,\partial\Delta)$ and $A(g,\Delta)\geq A(f,\Delta)$ (ii) Each natural edge of $g$ has spherical length strictly less than $\pi,$ (iii) $V_{NE}(g)\leq V_{NE}(f)\ \mathrm{and\ }V_{E}(g)\geq V_{E}(f)+1.$ (iv) $V(g)\leq V(f)+2.$ ###### Proof. Let $C$ be the great circle determined by $\Gamma_{1}.$ Then there are two cases: Case 1. $C\cap E\neq\emptyset.$ Case 2. $C\cap E=\emptyset.$ Assume Case 1 occurs. Then by (a), $C$ contains only one point $p_{0}$ in $E$ and this point must be $1.$ Otherwise, $C$ contains the antipodal points $0$ and $\infty,$ and either $0$ or $\infty$ is in the interior of $\Gamma_{1}$ by (a) and (b), which contradicts the assumption that $\Gamma_{1}$ is a natural edge. Then $C$ must separates $0$ and $\infty,$ without loss of generality, assume $0$ is on the right hand side of $C.$ Let $q_{j}$ be the initial point of $\Gamma_{j},j=1,\dots,n.$ Then $q_{j+1}$ is the endpoint of $\Gamma_{j},j=1,\dots,n,$ where $q_{n+1}=q_{1}.$ Let (8.18) $\Gamma_{1}^{\prime}=\overline{q_{1}0}\ \mathrm{and\ }\Gamma_{1}^{\prime\prime}=\overline{0q_{2}}.$ Then, by Lemma 8.1, $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ make sense and (8.19) $L(\Gamma_{1}^{\prime})<\pi,L(\Gamma_{1}^{\prime\prime})<\pi\ \mathrm{and\ }L(\Gamma_{1}^{\prime})+L(\Gamma_{1}^{\prime\prime})\leq L(\Gamma_{1}),$ and $\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}-\Gamma_{1}$ encloses a domain $T$ that is on the right hand side of $C$ and $(\Gamma_{1}\cup T)\cap E=\emptyset.$ By Lemma 3.2, ignoring a coordinate transform, there exists a normal mapping $g_{1}:\overline{\Delta}\rightarrow S$, which will be regarded as an extension of $f,$ such that $\Gamma_{g_{1}}$ has the permitted partition $\Gamma_{g_{1}}=\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n}$ and (8.20) $L(g_{1},\partial\Delta)\leq L(f,\partial\Delta),A(g_{1},\Delta)\geq A(f,\Delta).$ It is clear that we have (8.21) $V_{NE}(g_{1})\leq V_{NE}(f),V_{E}(g_{1})=V_{E}(f)+1,V(g_{1})\leq V(f)+1,$ and we can rewrite the permitted partition of $\Gamma_{g_{1}}$ as $\Gamma_{g_{1}}=\Gamma_{n}+\Gamma_{1}^{\prime}+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n-1}.$ Then there are three cases: Case 1.1. Both $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ are natural edges of $\Gamma_{g_{1}}.$ Case 1.2. One of $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ is a natural edge, while the other is not. Case 1.3. Neither $\Gamma_{1}^{\prime}$ nor $\Gamma_{1}^{\prime\prime}$ is a natural edge. In Case 1.1, it is clear that $g=g_{1}$ satisfies all the desired conclusions with (8.22) $V_{NE}(g_{1})=V_{NE}(f),\mathrm{\ }V_{E}(g_{1})=V_{E}(f)+1,V(g_{1})=V(f)+1.$ Assume Case 1.2 occurs. Without loss of generality, assume that $\Gamma_{1}^{\prime\prime}$ is a natural edge. Then $\Gamma_{g_{1}}$ has the natural partition $\Gamma_{g_{1}}=\left(\Gamma_{n}+\Gamma_{1}^{\prime}\right)+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n-1}$ where $\left(\Gamma_{n}+\Gamma_{1}^{\prime}\right)\ $is a natural edge, and (8.21) becomes (8.23) $V_{NE}(g_{1})=V_{NE}(f)-1,\mathrm{\ }V_{E}(g_{1})=V_{E}(f)+1\ \mathrm{and\ }V(g_{1})=V(f).$ Then, in the case $L(\Gamma_{n}+\Gamma_{1}^{\prime})<\pi,$ by (a) and (8.19), $g=g_{1}$ satisfies (i)–(iv) with (8.23); and in the case $L(\Gamma_{n}+\Gamma_{1}^{\prime})\geq\pi,$ by (a), (8.18) and (8.19), $\pi\leq L(\Gamma_{n}+\Gamma_{1}^{\prime})<2\pi$ and $g_{1}$ satisfies the assumption of Lemma 8.3 with (8.23), and then, by (8.20), there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ that satisfies (i) and (ii), and $V_{NE}(g)\leq V_{NE}(g_{1}),\mathrm{\ }V_{E}(g)\geq V_{E}(g_{1})+1\ \mathrm{and\ }V(g)\leq V(g_{1})+1,$ and so by (8.23), (iii) and (iv) are satisfied by $g\ $with (8.24) $V_{NE}(g)\leq V_{NE}(f)-1,\mathrm{\ }V_{E}(g)\geq V_{E}(f)+2\ \mathrm{and\ }V(g)\leq V(f)+1.$ Assume Case 1.3 occurs. Then both $\Gamma_{n}+\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ are natural edges of $g_{1},$ $\Gamma_{g_{1}}$ has the natural partition $\Gamma_{g_{1}}=\left(\Gamma_{n}+\Gamma_{1}^{\prime}\right)+\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)+\Gamma_{3}+\dots+\Gamma_{n-1}$ and (8.21) becomes (8.25) $V_{NE}(g_{1})=V_{NE}(f)-2,V_{E}(g_{1})=V_{E}(f)+1,V(g_{1})=V(f)-1.$ By (a) and (8.19) we have (8.26) $L(\Gamma_{n}+\Gamma_{1}^{\prime})<2\pi\ \mathrm{and\ }L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<2\pi.$ Then, by (a), in the case (8.27) $L(\Gamma_{n}+\Gamma_{1}^{\prime})<\pi\ \mathrm{and\ }L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<\pi,$ $g=g_{1}$ is the desired mapping satisfying (i)–(iv) with (8.25); and in the case that (8.27) fails, by (a), (8.18) and (8.26), Lemma 8.3 or Lemma 8.4 applies, and then there exists a normal mapping $g$ satisfies (i), (ii) and $V_{NE}(g)\leq V_{NE}(g_{1}),V_{E}(g)\geq V_{E}(g_{1})+1,V(g)\leq V(g_{1})+2,$ which, with (8.25), implies $V_{NE}(g)\leq V_{NE}(f),V_{E}(g)\geq V_{E}(f)+1,V(g)\leq V(f)+1,$ i.e. (iii) and (iv) hold. This completes the proof in Case 1.3. Now, assume Case 2 occurs. Then the hemisphere $S^{\prime}$ outside $C$ contains one or two points of $E.$ If $S^{\prime}$ contains only one point of $E,$ the proof is exactly the same as the above arguments. So, we assume that $S^{\prime}$ contains two points $q_{0}$ and $q_{0}^{\prime}$ of $E.$ Then either $\\{q_{0},q_{0}^{\prime}\\}=\\{0,1\\}$ or $\\{1,\infty\\},$ and then there are two cases: Case 2.1. The great circle of $S$ containing $q_{0}$ and $q_{0}^{\prime}$ intersects $C\backslash\Gamma_{1}$ . Case 2.2. The great circle containing $q_{0}$ and $q_{0}^{\prime}$ does not intersects $C\backslash\Gamma_{1}$. In Case 2.1, the argument for Case 1 exactly applies. In Case 2.2, it is easy to show that the exists two points $r_{1}$ and $r_{1}^{\prime}$ on $\Gamma_{1}$ such that $r_{1}$ close to $q_{1}$ and $r_{1}^{\prime}$ close to $q_{2}$ (in $\Gamma_{1}),$ and $r_{1},q_{0},q_{0}^{\prime},r_{1}^{\prime}$ or $r_{1},q_{0}^{\prime},q_{0},r_{1}^{\prime}$ are in order on the geodesic path from $r_{1}$ to $r_{1}^{\prime}$ in $S^{\prime},$ (then $r_{1}$ and $r_{1}^{\prime}$ are antipodal). We assume $r_{1},q_{0},q_{0}^{\prime},r_{1}^{\prime}$ is ordered in the orientation of the geodesic path from $r_{1}$ to $r_{1}^{\prime}$ in $S^{\prime}.$ It is clear that the notations $\Gamma_{1}^{\prime}=\overline{q_{1}q_{0}},\gamma=\overline{q_{0}q_{0}^{\prime}},\Gamma_{1}^{\prime\prime}=\overline{q_{0}^{\prime}q_{2}}.$ make sense. Then (8.28) $L(\Gamma_{1}^{\prime})<\pi,L(\Gamma_{1}^{\prime\prime})<\pi,L(\gamma)=\frac{\pi}{2},$ and it is also clear that (8.29) $L(\Gamma_{1}^{\prime})+L(\gamma)+L(\Gamma_{1}^{\prime\prime})=L(\Gamma_{1}^{\prime})+\frac{\pi}{2}+L(\Gamma_{1}^{\prime\prime})<L(\Gamma_{1})<2\pi,$ and $\Gamma_{1}^{\prime}+\gamma+\Gamma_{1}^{\prime\prime}-\Gamma_{1}$ encloses a Jordan domain $T$ in $S^{\prime}$ with $\left(\Gamma_{1}\cup T\right)\cap E=\emptyset.$ By Lemma 3.2, there exists a normal mapping $g_{1}$, such that $\Gamma_{g_{1}}$ has the permitted partition $\Gamma_{g_{1}}=\Gamma_{1}^{\prime}+\gamma+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n}$ and by (8.29), $L(g_{1},\partial\Delta)\leq L(f,\partial\Delta),A(f,\Delta)\geq A(g_{1},\Delta).$ It is clear that we have (8.30) $V_{NE}(g_{1})\leq V_{NE}(f),V_{E}(g_{1})=V_{E}(f)+2\ \mathrm{and\ }V(g_{1})\leq V(f)+2$ and we rewrite the permitted partition of $\Gamma_{g_{1}}$ as (8.31) $\Gamma_{g_{1}}=\Gamma_{n}+\Gamma_{1}^{\prime}+\gamma+\Gamma_{1}^{\prime\prime}+\Gamma_{2}+\dots+\Gamma_{n-1}.$ Note that $\gamma$ is always a natural edge of $\Gamma_{g_{1}},$ because the endpoints of $\gamma$ are both in $E.$ Then there are three cases: Case 2.2.1. Both $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ are natural edges of $\Gamma_{g_{1}}$. Case 2.2.2. One of $\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}$ is a natural edge, while the other is not. Case 2.2.3. Neither $\Gamma_{1}^{\prime}$ nor $\Gamma_{1}^{\prime\prime}$ is a natural edge. In Case 2.2.1, (8.31) is a natural partition, and by (8.28), $g=g_{1}$ satisfies (i)–(iv) with (8.30). In Case 2.2.2, we may assume $\Gamma_{1}^{\prime}$ is a natural edge, and then by (8.31), $\Gamma_{g_{1}}$ has the natural partition $\Gamma_{g_{1}}=\Gamma_{n}+\Gamma_{1}^{\prime}+\gamma+\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)+\Gamma_{3}\dots+\Gamma_{n-1}.$ Then, by (8.30) and (8.31), (8.32) $V_{NE}(g_{1})\leq V_{NE}(f),V_{E}(g_{1})=V_{E}(f)+2\ \mathrm{and\ }V(g_{1})=V(f)+1.$ Then, by (a) and (8.28), in the case $L\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)<\pi,$ $g=g_{1}$ satisfies (i)–(iv) with (8.30), and otherwise, Lemma 8.3 applies to $g_{1},$ and then there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ satisfying (i)–(iv), by (8.32), with (8.33) $\left\\{\begin{array}[]{l}V_{NE}(g)\leq V_{NE}(g_{1})\leq V_{NE}(f),\\\ V_{E}(g)\geq V_{E}(g_{1})+1=V_{E}(f)+3,\\\ V(g)\leq V(g_{1})+1=V(f)+2.\end{array}\right.$ In Case 2.2.3, $\Gamma_{n}+\Gamma_{1}^{\prime}$ and $\Gamma_{1}^{\prime\prime}+\Gamma_{2}$ are two natural edges of $\Gamma_{g_{1}}$ with $L(\Gamma_{n}+\Gamma_{1}^{\prime})<2\pi\text{ and }L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<2\pi;$ $\Gamma_{g_{1}}$ has the natural partition $\Gamma_{g_{1}}=\left(\Gamma_{n}+\Gamma_{1}^{\prime}\right)+\gamma+\left(\Gamma_{1}^{\prime\prime}+\Gamma_{2}\right)+\Gamma_{3}+\dots+\Gamma_{n-1}.$ and (8.30) becomes (8.34) $V_{NE}(g_{1})\leq V_{NE}(f),V_{E}(g_{1})=V_{E}(f)+2\ \mathrm{and\ }V(g_{1})=V(f).$ Then, by (a) and (8.28), in the case $L(\Gamma_{n}+\Gamma_{1}^{\prime})<\pi$ and $L(\Gamma_{1}^{\prime\prime}+\Gamma_{2})<\pi,$ $g=g_{1}$ satisfies (i)–(iv) with (8.34), and in other cases, Lemma 8.3 or Lemma 8.4 applies to $g_{1},$ and then there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ satisfying (i)–(iv) with (8.35) $\left\\{\begin{array}[]{l}V_{NE}(g)\leq V_{NE}(g_{1})\leq V_{NE}(f),\\\ V_{E}(g)\geq V_{E}(g_{1})+1=V_{E}(f)+3,\\\ V(g)\leq V(g_{1})+2=V(f)+2.\end{array}\right.$ This completes the proof. ∎ ###### Lemma 8.6. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, and let (8.36) $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}+\dots+\Gamma_{n},n=V(f),$ be a natural partition of $\Gamma_{f}=f(z),z\in\partial\Delta.$ Assume that (8.37) $2\pi\leq L(\Gamma_{1})<3\pi,$ and (8.38) $L(\Gamma_{j})<\pi\ \mathrm{for\ }j=2,\dots,n.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (i) $L(g,\partial\Delta)\leq L(f,\partial\Delta)$ and $A(g,\Delta)\geq A(f,\Delta)$ (ii) Each natural edge of $g$ has spherical length strictly less than $\pi,$ (iii) $V_{NE}(g)=V_{NE}(f)+2$, $V_{E}(g)=V_{E}(f)+1$ and $V(g)=V(f)+3.$ ###### Proof. Let $C$ be the great circle determined by $\Gamma_{1}.$ Then by (8.37) we have $C\subset\Gamma_{1},$ and by the definition of natural edges, in the case that $L(\Gamma_{1})=2\pi,$ the only possible point of $E=\\{0,1,\infty\\}$ contained in $C$ is $1,$ and in the case that $2\pi<L(\Gamma_{1})<3\pi,$ $C$ does not intsects $E,$ for otherwise the interior $\alpha_{1}^{\circ}$ of $\alpha_{1}$ contains at least one point of $f^{-1}(E).$ Let $S^{\prime}$ be the hemisphere outside313131This means that $S^{\prime}$ is on the right hand side of $C.$ Note that $C$ is oriented by $\Gamma_{1}.$ $C$. Then (8.39) $1\leq\\#\left(S^{\prime}\cap E\right)\leq 2.$ Let $\partial\Delta=\alpha_{1}+\dots+\alpha_{n}$ be a natural partition of $\partial\Delta$ corresponding the partition (8.36) and let $p_{1}$ and $p_{4}$ be the initial and terminal point of $\alpha_{1}$, respectively. Then by (8.37) and (8.39), summarizing what we have, there exists $p_{2}$ and $p_{3}$ in the interior of $\alpha_{1}$ such that $p_{1},p_{2},p_{3},p_{4}$ are in order anticlockwise and the followings hold. (a) $f$ restricted to each section $\alpha_{j}^{\prime}$ of $\alpha_{1}$ from $p_{j}$ and $p_{j+1}$ is a homeomorphism, $j=1,2,3.$ (b) For the sections $\Gamma_{j}^{\prime}=f(z),z\in\alpha_{j},j=1,2,3$ $L(\Gamma_{2}^{\prime})=\pi,\ L(\Gamma_{1}^{\prime})<\pi,\ L(\Gamma_{3}^{\prime})<\pi.$ (c) Any shortest path from $q_{2}\mathrm{\ }$to $q_{3}\ $contains at most one point of $E$. Then by the definition of natural edges, $\Gamma_{2}^{\prime}\cap E=\emptyset,$ and by (b), $q_{2}$ and $q_{3}\ $are antipodal. Therefore, by (8.39) and (c), there exists a unique shortest path $L$ from $q_{2}$ to $q_{3}$ such that $L-\Gamma_{2}^{\prime}$ enclose a domain $T$ such that $\overline{T}\cap E$ contains exactly one point $q\in E$, which lies in $L\cap S^{\prime}.$ We denote by $\Gamma^{\prime}$ the section of $L$ from $q_{2}=f(p_{2})$ to $q=f(q)$ and by $\Gamma^{\prime\prime}$ the section of $L$ from $q$ to $q_{3}=f(p_{3}).$ Then we can extend the Riemann surface of $f$ to be a new Riemann surface so that in the new Riemann surface, $\overline{T}$ is patched along $\Gamma_{2}^{\prime}.$ By Lemma 3.2, this can be realized by a normal mapping $g:\overline{\Delta}\rightarrow S.$ Then the boundary curve $\Gamma_{g}=g(z),\in\partial\Delta,$ has the following natural partition (8.40) $\Gamma_{g}=\Gamma_{1}^{\prime}+\Gamma^{\prime}+\Gamma^{\prime\prime}+\Gamma_{3}^{\prime}+\Gamma_{2}+\dots+\Gamma_{n},$ because $\Gamma_{1}^{\prime},\Gamma_{3}^{\prime}$ is in $\Gamma_{1}$ and $\Gamma^{\prime}$ and $\Gamma^{\prime\prime}$ are clearly natural edges. It is clear that $\Gamma_{g}$ satisfies (ii) and (8.41) $L\left(\Gamma_{1}^{\prime}\right)+L\left(\Gamma^{\prime}\right)+L\left(\Gamma^{\prime\prime}\right)+L\left(\Gamma_{3}^{\prime}\right)=L\left(\Gamma_{1}^{\prime}\right)+L(\Gamma_{2}^{\prime})+L\left(\Gamma_{3}^{\prime}\right)=L(f,\alpha_{1}),$ and then by (8.40) we have $L(g,\partial\Delta)=L(f,\partial\Delta).$ On the other hand, it is also clear that $A(g,\Delta)=A(f,\Delta)+A(T)>A(f,\Delta).$ Thus, $g$ satisfies (i). On the other hand, by (8.40), considering that all the natural vertices of $\Gamma_{f}$ are natural vertices of $\Gamma_{g}$ and $q_{2}^{\prime},q_{3}^{\prime}$ and $q^{\prime}$ are the three new natural vertices of $g,$ we have $V_{NE}(g)=V_{NE}(f)+2,V_{E}(g)=V_{E}(f)+1,V(g)=V(f)+3.$ Thus, (iii) is satisfied by $g.$ This completes the proof. ∎ ## 9\. Movement of branched points This section is prepared for prove Theorem 10.1. ###### Lemma 9.1. Let $f:\overline{\Delta^{+}}\rightarrow\overline{\Delta}$ be an orientation preserved open mapping that satisfies the following conditions: (a) f restricted to the upper half circle $\left(\partial\Delta\right)^{+}=\\{z\in\partial\Delta;\mathrm{Im}z\geq 0\\}$ is given by $f(e^{i\theta})=e^{\phi(\theta)i},$ where $\phi$ is a strictly increasing function defined on $[0,\pi]$ with $\phi(0)=0$ and $\phi(\pi)=(2d+1)\pi$, where $d$ is a positive integer. (b) $f$ maps the interval $[-1,-1]$ homeomorphically onto the interval $[-1,1].$ (c) $p_{0}\in\Delta^{+}$ is the unique ramification point of $f$ in $\overline{\Delta^{+}}.$ Then there exists an orientation preserved open mapping $g:\overline{\Delta^{+}}\rightarrow\overline{\Delta}$ such that the followings hold. (I) $z=0$ is the unique ramification point of $g$ in $\overline{\Delta^{+}}$ and $g(0)=0.$ (II) $g|_{\left(\partial\Delta\right)^{+}}=f|_{\left(\partial\Delta\right)^{+}}$ and $g$ restricted to the interval $[-1,1]$ is a homeomorphism onto the interval $[-1,1].$ ###### Remark 9.1. $g$ acts as an orientation preserved open mapping that moves the unique ramification point $p_{0}$ of $f$ into the boundary of $\Delta^{+}$ with the same branched number, while none other ramification points appear. ###### Proof. There exists an orientation preserved homeomorphism $f_{1}$ from $\overline{\Delta^{-}}$ onto $\overline{\Delta^{-}}$ such that $f_{1}|_{[-1,1]}=f|_{[-1,1]}.$ Then $f_{2}(z)=\left\\{\begin{array}[]{l}f(z),z\in\overline{\Delta^{+}},\\\ f_{1}(z),z\in\overline{\Delta^{-}}\backslash\overline{\Delta^{+}},\end{array}\right.$ is an orientation preserved $d+1$ to $1$ covering mapping from $\overline{\Delta}$ onto $\overline{\Delta}$ such that $p_{0}$ is the unique ramification point of $f_{2},$ and then there exists another covering mapping $f_{3}:\overline{\Delta}\rightarrow\overline{\Delta}$ such that $f_{3}|_{\partial\Delta}=f_{2}|_{\partial\Delta}$ and that $0$ is the unique ramification point of $f_{3}$ with $f_{3}(0)=0.$ It is clear that the path $\beta=\beta(t),t\in[-1,1]$ in $\overline{\Delta}$ has a unique lift $\alpha=\alpha(t),t\in[-1,1],$ in $\overline{\Delta}$ such that $\alpha(-1)=-1,\alpha(1)=1,$ $f_{3}$ restricted to $\alpha$ is a homeomorphism with $f_{3}(\alpha(t))=\beta(t)=t,t\in[-1,1],$ and $\alpha$ is a Jordan path and the interior of $\alpha$ is contained in $\Delta.$ Thus $\alpha$ divides $\Delta$ into two Jordan domains and one of these domains is enclosed by $\left(\partial\Delta\right)^{+}$ and $\alpha,$ and we denote this domain by $U^{+}.$ Then $f_{3}$ restricted to $\overline{\Delta^{+}\backslash U^{+}}$ is a homeomorphism. Now consider the restriction $f_{3}|_{\overline{U^{+}}}.$ Let $h$ be a homeomorphism from $\overline{\Delta^{+}}$ onto $\overline{U^{+}}$ such that $h$ restricted to $\left(\partial\Delta\right)^{+}$ is an identity mapping, restricted to the interval $[-1,1]$ is a homeomorphism onto $\alpha$ with $h(0)=0$ (note that $0\in\alpha),$ and finally let $g=f_{3}\circ h(z),z\in\overline{\Delta^{+}}.$ Then $g$ satisfies all the desired conditions. ∎ ###### Remark 9.2. By the proof we may construct that $g$ such that $g(0)=t$ for any fixed $t\in(-1,1)$, $0$ is the unique ramification point of $g$ and all other conclusions hold. ###### Lemma 9.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, let $p_{0}\in\Delta$ be a ramification point of $f$ with $v_{f}(p_{0})=d+1,$ and assume that $\beta=\beta(t),t\in[0,1],$ is a polygonal Jordan path in $S$ that satisfies the followings: (a) $\beta(0)=f(p_{0}),$ $\beta(0)\neq\beta(1)$ and $\beta$ has a number of $d+1$ lifts $\alpha_{j}=\alpha_{j}(t),t\in[0,1],$ by $f$ in $\overline{\Delta},$ such that $\cup_{j=2}^{d+1}\alpha_{j}\subset\Delta,$ $f(\alpha_{j}(t))=\beta(t),t\in[0,1],j=1,\dots,d+1,$ and $\alpha_{j}(0)=p_{0},\mathrm{\ }j=1,\dots,d+1,$ (b) $\alpha_{1}(t)\in\Delta$ for all $t\in[0,1)\ $but $p_{1}=\alpha_{1}(1)\in\partial\Delta.$ (c) $f$ has no ramification point on $\cup_{j=1}^{d+1}\alpha_{j}(0,1],$ where $\alpha_{j}(0,1]$ is the curve $\alpha_{j}(t),t\in(0,1],$ which is the curve $\alpha_{j}$ without initial point, $j=1,2,\dots d+1.$ (d) $f$ restricted to a neighborhood of $p_{1}=\alpha_{1}(1)$ in $\overline{\Delta}$ is a homeomorphism. Then, there exist a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $A(g,\Delta)=A(f,\Delta),L(g,\partial\Delta)=L(f,\partial\Delta),$ and the followings hold. (I) The ramification point $p_{0}$ of $f$ is no longer a ramification point of $g,$ while the regular point $p_{1}$ of $f$ is a regular point of $g$ with $g(p_{1})=\beta(1)=f(p_{1})\mathrm{\ and\ }v_{f}(p_{0})=v_{g}(p_{1}).$ (II) The boundary curves $\Gamma_{f}=f(e^{i\theta}),\theta\in[0,2\pi],$ and $\Gamma_{g}=g(e^{i\theta}),\theta\in[0,2\pi],$ are the same curves after a parameter transformation. (III) The ramification point sets of $f$ and $g$ in $\overline{\Delta}\backslash\\{p_{0},p_{1}\\}$ are the same, and $f$ and $g$ coincide in a neighborhood of this ramification point set. . ###### Remark 9.3. $g$ acts as a normal mapping that moves the ramification point $p_{0}$ of $f$ into the boundary $\partial\Delta$ with the same branched number, while all other ramification points, as well as their branched number, remain unchanged, and no other new ramification point appear, and the length and the area also remains unchanged. ###### Proof. Let $\delta<\frac{1}{2}$ be a positive number, let $D_{\delta}$ be the disk $|z-p_{1}|<\delta$ in $\mathbb{C},$ let $c=\left(\partial\Delta\right)\cap\overline{D_{\delta}}$, which will be regarded as a path from $p_{2}\in\partial\Delta$ to $p_{3}\in\partial\Delta$ (anticlockwise). Then $p_{1}$ is the middle point of $c$. We write $q_{j}=f(p_{j}),j=1,2,3;$ $D_{\delta}^{+}=D_{\delta}\backslash\overline{\Delta},$ $\Delta^{\ast}=\Delta\cup D_{\delta}\cup c\backslash\\{p_{2},p_{3}\\};$ $\gamma=f(c);$ $e=\partial\Delta^{\ast}\cap\overline{D_{\delta}}=\left(\partial D_{\delta}\right)\backslash\Delta,$ which is the boundary of $\Delta^{\ast}$ outside $\Delta,$ and is the boundary of $\partial D_{\delta}$ outside $\Delta$ as well. It is clear that $\Delta^{\ast}$ is a Jordan domain (note that $\delta<\frac{1}{2})$ and $\partial\Delta^{\ast}=e\cup\left(\left(\partial\Delta\right)\backslash c\right),\ e\cap\overline{\left(\partial\Delta\right)\backslash c}=\\{p_{2},p_{3}\\}.$ Since $f$ is normal and $\alpha_{2}\subset\Delta$ (by (a)), we have that $f(p_{1})=f(\alpha_{1}(1))=f(\alpha_{2}(1))\notin E.$ On the other hand, by (c) and (d), we may take the number $\delta$ sufficiently small such that the following conditions (e)–(f) are satisfied. (e) $f$ restricted to $c$ is a homeomorphism onto $\gamma=f(c)=\overline{q_{2}q_{1}q_{3}},$ i.e., $\gamma$ is a polygonal Jordan path with only one possible vertex at $q_{1}.$ (f) There exists a point $q_{1}^{\prime}$ in $S\backslash\gamma$ such that $q_{1}^{\prime}$ is very close to $\gamma$ and is on the right hand side of $\gamma,$ and the quadrangle $\overline{q_{2}q_{1}^{\prime}q_{3}q_{1}q_{2}}$ encloses a domain $T$ that is on the right hand side of $\gamma,$ with $\overline{T}\cap E=\emptyset,$ and $f^{-1}(\overline{T})$ has $d$ components $A_{j}$ with $f(\alpha_{j}(1)\in A_{j}$ and $f$ restricted to each $A_{j}$ is a homeomorphism onto $\overline{T},$ for $j=2,\dots,d+1.$ (g) $\beta$ intersects $\overline{T}$ only at $q_{1}=f(p_{1}).$ Let $f_{1}$ be an orientation preserved homeomorphism from $\overline{D_{\delta}^{+}}$ onto $\overline{T}$ such that $f_{1}$ and $f$ restricted to $c$ are equal to each other. Then $f_{2}(z)=\left\\{\begin{array}[]{l}f(z),z\in\overline{\Delta},\\\ f_{1}(z),z\in\overline{D_{\delta}^{+}}\backslash\overline{\Delta},\end{array}\right.$ is a normal mapping defined on $\overline{\Delta^{\ast}}$. The above argument show that $T$ can be extended to be a polygonal Jordan domain $T^{\ast}$ such that the followings hold. (h) $\beta\subset T^{\ast}$, the path $\gamma^{\prime}=\overline{q_{2}q_{1}^{\prime}q_{3}}$ is still a section of $\partial T^{\ast},$ and $(\gamma\cup T)\backslash\\{q_{2},q_{3}\\}\subset T^{\ast}.$ (i) $f_{2}$ restricted to the component $\overline{U}$ of $f_{2}^{-1}(\overline{T^{\ast}})$ with $p_{0}\in U$ is a $d+1$ to $1$ covering with the unique ramification point $p_{0},$ and $f_{2}(\overline{U})=\overline{T^{\ast}}.$ (j) The boundary of $U$ is composed of $e$ and a Jordan path $\alpha$ in $\overline{\Delta}$ whose interior is in $U\ $and endpoints are $p_{2}$ and $p_{3}.$ Then $V=U\cap\Delta$ is also a Jordan domain. Let $h_{1}$ be a homeomorphism from $\overline{V}$ onto $\overline{\Delta^{+}}$ such that $h_{1}$ maps $\alpha$ homeomorphically onto $\left(\partial\Delta\right)^{+},$ maps $c$ homeomorphically onto the interval $[-1,1]\ $with $h_{1}(p_{1})=0;$ let $h_{2}$ be a homeomorphism from $\overline{T^{\ast}}$ onto $\overline{\Delta}$ such that $h_{2}$ maps $\left(\partial T^{\ast}\right)\backslash\\{\gamma^{\prime}\backslash\\{q_{2},q_{3}\\}\\}$ homeomorphically onto $\left(\partial\Delta\right)^{+}$, maps $\gamma^{\prime}$ homeomorphically onto $\left(\partial\Delta\right)^{-},$ and maps $\gamma$ homeomorphically onto the interval $[-1,1]$ with $h_{2}(q_{1})=0;$ and finally let $g_{1}=h_{2}\circ f_{2}|_{\overline{V}}\circ h_{1}^{-1}(\zeta):\overline{\Delta^{+}}\rightarrow\overline{\Delta}.$ Then $g_{1}$ is an orientation preserved open mapping that satisfies all the assumptions of Lemma 9.1, and then there exists an orientation preserved open mapping $g_{2}:\overline{\Delta^{+}}\rightarrow\overline{\Delta}$ such that the followings hold. (k) $0$ is the unique ramification point of $g_{2}$ in $\overline{\Delta^{+}}$ and $g_{2}(0)=0.$ (l) $g_{2}|_{\left(\partial\Delta\right)^{+}}=f|_{\left(\partial\Delta\right)^{+}}$ and both $f$ and $g_{2}$ restricted to the interval $[-1,1]$ are homeomorphisms onto the interval $[-1,1].$ Let $g_{3}=h_{2}^{-1}\circ g_{2}\circ h_{1}(z),z\in\overline{V}.$ Then $g_{3}$ restricted to a neighborhood of $\alpha$ in $\overline{V}$ is a homeomorphism, $g_{3}$ maps $c$ homeomorphically onto $\gamma$ and $g_{3}$ restricted to $\alpha$ equals the restriction of $f$ to $\alpha$ and $A(g_{3},V)=\left(d+1\right)A(T^{\ast})-A(T)=A(f,U)-A(f,D_{\delta}^{+})=A(f,V).$ Now, $g(z)=\left\\{\begin{array}[]{l}f(z),z\in\overline{\Delta}\backslash\overline{V},\\\ g_{3}(z),z\in\overline{V},\end{array}\right.$ is the desired mapping. ∎ ###### Lemma 9.3. Let $\alpha_{1}=\alpha_{1}(\theta)=e^{i\theta},\theta\in[\theta_{1},\theta_{2}]$ with $\theta_{1}<\theta_{2}<\theta_{1}+2\pi,$ be a section of $\partial\Delta$ and let $p_{j}=\alpha_{1}(e^{i\theta_{j}}),j=1,2;$ let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that $p_{1}$ is a ramification point of $f$ with $v_{f}(p_{1})=d.$ Assume that the section $\beta=\beta(\theta)=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{2}],$ of $\Gamma_{f}=f(z),z\in\partial\Delta,\ $is a Jordan path with $\beta\cap E=\emptyset,$ and $\beta$ has $d=v_{f}(p_{1})$ distinct lifts $\alpha_{j}=\alpha_{j}(\theta),\theta\in[\theta_{1},\theta_{2}],j=1,\dots,d$ in $\overline{\Delta}$ by $f,$ such that (a) For each $j=1,\dots,d,$ $f(\alpha_{j}(\theta))=f(\alpha_{1}(\theta))=\beta(\theta)$ for $\theta\in[\theta_{1},\theta_{2}]\ $and $\alpha_{j}(\theta_{1})=p_{1}.$ (b) For each $j=2,\dots,d,$ $\alpha_{j}(\theta)\in\Delta$ for $\theta\in(\theta_{1},\theta_{2}].$ (c) There is no ramification point of $f$ in $\cup_{j=1}^{d}\alpha_{j}$ other than $p_{1}.$ (d) $f$ restricted to a neighborhood of $p_{j}$ in $\partial\Delta$ is a homeomorphism, for $j=1,2.$ Then, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $A(g,\Delta)=A(f,\Delta),L(g,\partial\Delta)=L(f,\partial\Delta),$ and the followings hold. (I) The ramification point $p_{1}=e^{i\theta_{1}}$ of $f$ is no longer a ramification point of $g,$ while the regular point $p_{2}=e^{i\theta_{2}}$ of $f$ is a ramification point of $g$ with $g(p_{2})=\beta(\theta_{2})=f(p_{2})$ and $b_{f}(p_{1})=b_{g}(p_{2}).$ (II) The boundary curves $f(e^{i\theta})$ and $g(e^{i\theta})$ are the same after a parameter transform. (III) In $\overline{\Delta}\backslash\\{p_{1},p_{2}\\},$ $f$ and $g$ has the same set of ramification points and $f$ and $g$ coincide in a neighborhood of this ramification point set. ###### Proof. There are two ways to prove this lemma. One way is to use Remark 9.2. Here we use Lemma 9.2 to give another proof. We will first construct a normal mapping $f_{2}$ that is defined on some closed Jordan domain $\overline{\Delta^{\prime}}\ni p_{2}$ such that the length and the area concerned in the lemma unchanged, the boundary curve $\Gamma_{f_{2}}$ of $f_{2}$ is the same as that of $f,$ $f$ and $f_{2}$ have the same set $B$ of ramification points in $\overline{\Delta}\backslash\\{p_{1},p_{2}\\}$, $f_{2}$ and $f$ coincide in a neighborhood of this ramification point set, and $f_{2}$ has only one more ramification point $p_{1}^{\prime}$ outside $B,$ while $p_{1}^{\prime}$ is in the interior of the domain $\Delta^{\prime},$ and there is a path $\beta_{3}$ whose interior and initial point are located in $\Delta^{\prime}$ and the terminal point is $p_{2}\in\partial\Delta^{\prime},$ and $f_{2}$ and $\beta_{3}$ satisfies all assumptions of Lemma 9.2 if $\Delta^{\prime}$ is regarded as a disk. Then by applying Lemma 9.2, we obtain the desired conclusion. Let $\delta<\frac{1}{2}$ be a positive number, $D_{\delta}$ the disk $|z-p_{1}|<\delta,$ $c$ the section of $\partial\Delta$ that is contained in $\overline{D_{\delta}}$ and regarded as a path from $s_{1}$ to $s_{2}$ anticlockwise, $e$ the section of $\partial D_{\delta}$ that is outside $\Delta$ $V$ the part of $D_{\delta}$ outside $\Delta$ and write . $\displaystyle\gamma$ $\displaystyle=$ $\displaystyle f(c),$ $\displaystyle t_{1}$ $\displaystyle=$ $\displaystyle f(s_{1}),t_{2}=f(s_{2}),$ $\displaystyle q_{1}$ $\displaystyle=$ $\displaystyle f(p_{1}),q_{2}=f(p_{2}),$ $\displaystyle V^{\ast}$ $\displaystyle=$ $\displaystyle\Delta\cup D_{\delta},$ $\displaystyle\gamma$ $\displaystyle=$ $\displaystyle f(c),\gamma^{\prime}=f(e).$ By the assumption, we may assume that $\delta$ is sufficiently small such that the followings hold. (e) $f$ can be extended to be a normal mapping $f_{1}$ defined on $\overline{\Delta^{\ast}}.$ (f) $f_{1}$ restricted to $\overline{V}$ is a homeomorphism onto the closure of a polygonal Jordan domain $T.$ (g) $q_{1}=f(p_{1})$ has a neighborhood $T^{\ast}$ such that $T^{\ast}\supset T\cup\gamma\backslash\\{t_{1},t_{2}\\}$, $T^{\ast}$ is a polygonal Jordan domain and for the component $U$ of $f_{1}^{-1}(\overline{T^{\ast}})$ with $p_{1}\in U,$ $f_{1}$ restricted to $\overline{U}$ is a $d$ to $1$ covering mapping onto $\overline{T^{\ast}},$ with the unique ramification point at $p_{1}.$ (h) $\beta\cap\partial T^{\ast}=\\{t_{2}\\}$. Then there is another normal mapping $f_{2}:\overline{\Delta^{\ast}}\rightarrow S$ such that $f_{2}|_{\overline{\Delta^{\ast}}\backslash U}=f_{1}|_{\overline{\Delta^{\ast}}\backslash U},$ the restriction $f_{2}|_{\overline{U}}$ is also a $d$ to $1$ covering with a unique ramification point $p_{1}^{\prime}$ in $U$ such that $p_{1}^{\prime}\in\Delta$ and $q_{1}^{\prime}=f_{2}(p_{1}^{\prime})\in T^{\ast}\backslash\overline{T}.$ Consider the lift of the path $\gamma=f(c)=f_{1}(c)$ by $f_{2}$. Since $f_{2}|_{\overline{U}}$ is a covering with the unique ramification point $p_{1}^{\prime}$ with $f_{2}(p_{1}^{\prime})=q_{1}^{\prime}\notin\gamma,$ $\gamma=f(c)$ has a unique lift $\alpha$ in $\overline{U}$ by $f_{2}$ such that the interior of $\alpha$ is in $U$ with endpoints $s_{1}$ and $s_{2}$ (note that $\overline{T}$ can be lifted by $f_{2}|_{\overline{U}},$ because $\overline{T}$ is simple connected and there is no branched point in $T).$ Then $\alpha$ divides $\Delta^{\ast}$ in to two Jordan domains $\Delta^{\prime}$ and $\Delta^{\prime\prime}$ such that $f_{2}(\partial\Delta^{\prime\prime})=\gamma\cup\gamma^{\prime}=\partial T,$ and $f_{2}$ restricted to $\partial\Delta^{\prime\prime}=\alpha\cup e$ is a homeomorphism onto the boundary $\partial T.$ Then $f_{2}|_{\overline{\Delta^{\prime\prime}}}$ is a homeomorphism from $\Delta^{\prime\prime}$ onto $T.$ Then the restriction of $f_{2}$ to $\overline{\Delta^{\prime}}$ is a normal mapping such that $A(f_{2},\Delta^{\prime})=A(f_{2},\Delta^{\ast})-A(f_{2},\Delta^{\prime\prime})=A(f_{1},\Delta^{\ast})-A(T)=A(f,\Delta),$ and $\Gamma_{f}$ and $\Gamma_{f_{2}|_{\overline{\Delta^{\prime}}}}$ are the same, ignoring a parameter transformation. By (h), there exists a unique $\theta_{1}^{\prime}\in(\theta_{1},\theta_{2})$ such that $t_{2}=\beta(\theta_{1}^{\prime}),$ which is the unique point in $\beta\cap\partial T^{\ast}.$ Let $\beta_{1}(\theta),\theta\in[\theta_{1},\theta_{1}^{\prime}],$ be a polygonal Jordan path in $T^{\ast}\backslash T$ such that $\beta_{1}(\theta_{1})=q_{1}^{\prime},\beta_{1}(\theta_{1}^{\prime})=t_{2},$ and the interior of $\beta_{1}$ is contained in $T^{\ast}\backslash\overline{T}.$ Then since $f_{2}|_{\overline{U}}$ is a covering with the unique ramification point $p_{1}^{\prime}$ and $f_{2}(p_{1}^{\prime})=q_{1}^{\prime},$ $\beta_{1}$ has $d$ lifts $\alpha_{j}^{\ast}=\alpha_{j}^{\ast}(\theta),\theta\in[\theta_{1},\theta_{1}^{\prime}],j=1,\dots,d,$ by $f_{2}|_{\overline{U}},$ such that (i) $\cup_{j=2}^{d}\alpha_{j}^{\ast}\subset\Delta^{\prime},$ the interior of $\alpha_{1}^{\ast}$ is also contained in $\Delta^{\ast},$ while $\alpha_{1}^{\ast}(\theta_{1}^{\prime})=s_{2}=\alpha_{1}(\theta_{1}^{\prime})\in\partial\Delta^{\prime}.$ (j) $\alpha_{j}^{\ast}(\theta_{1}^{\prime})=\alpha_{j}(\theta_{1}^{\prime}),$and $\alpha_{j}^{\ast}(\theta_{1})=p_{1}^{\prime},j=1,\dots,d.$ Let $\beta_{2}(\theta)=\left\\{\begin{array}[]{c}\beta_{1}(\theta),\theta\in[\theta_{1},\theta_{1}^{\prime}],\\\ \beta(\theta),\theta\in[\theta_{1}^{\prime},\theta_{2}];\end{array}\right.$ and let $\alpha_{j}^{\prime\prime}=\left\\{\begin{array}[]{c}\alpha_{j}^{\prime}(\theta),\theta\in[\theta_{1},\theta_{1}^{\prime}],\\\ \alpha_{j}(\theta),\theta\in[\theta_{1}^{\prime},\theta_{2}].\end{array}\right.$ Then, by the assumption of the lemma, we have $f_{2}(\alpha_{j}^{\prime\prime}(\theta))=\beta_{2}(\theta),\theta\in[\theta_{1},\theta_{2}],j=1,\dots,d$ $\alpha_{j}^{\prime\prime}\subset\Delta^{\prime},j=2,\dots,d,$ and $f_{2}$ has no ramification point in $\cup_{j=1}^{d}\alpha_{j}^{\prime\prime}\backslash\\{p_{1}^{\prime}\\}.$ Since $\Gamma_{f_{2}|_{\overline{\Delta^{\prime}}}}=f_{2}(z),z\in\partial\Delta^{\prime}$, is polygonal, there exists another polygonal Jordan path $\beta_{3}(\theta),\theta\in[\theta_{1},\theta_{2}],$ such that $\beta_{3}\cap\beta=\\{q_{2}\\}$, $\beta_{3}$ is so close to $\beta_{2}$ that $\beta_{3}$ has a number of $d$ lifts $\gamma_{j}=\gamma_{j}(\theta),\theta\in[\theta_{1},\theta_{2}]$ such that $f_{2}(\gamma_{j}(\theta))=\beta_{3}(\theta),\theta\in[\theta_{1},\theta_{2}],j=1,\dots,d,$ $\gamma_{j}(\theta_{1})=p_{1}^{\prime},j=1,\dots,d,$ $\cup_{j=2}^{d}\gamma_{j}\subset\Delta^{\prime},\gamma\backslash\\{p_{2}\\}\subset\Delta^{\prime}$ and $f_{2}$ has no ramification point in $\cup_{j}^{d}\gamma_{j}\backslash\\{p_{1}^{\prime}\\}.$ Then by Lemma 9.2, there exists a normal mapping $f_{3}$ defined on $\Delta^{\prime}$ such that the followings hold. (k) $p_{2}=e^{i\theta_{2}}$ is a ramification point of $f_{3}$ with $f_{3}(p_{2})=q_{2}^{\prime}=\beta(\theta_{2}),\ $while $p_{1}$ is not a ramification point of $f_{3}$, and $b_{f_{2}}(p_{1})=b_{f_{3}}(p_{2}),$ (l) The boundary curves $f_{3}(e^{i\theta})$ and $f_{2}(e^{i\theta})$ are the same after a parameter transform. (m) In $\overline{\Delta^{\prime}}\backslash\\{p_{1}^{\prime},p_{2}\\},$ $f_{3}$ and $f_{2}$ has the same set of ramification points and $f$ and $g$ coincide in a neighborhood of this ramification point set. (n) $A(f_{3},\Delta^{\prime})=A(f_{2},\Delta^{\prime}).$ Let $B$ be the set of all ramification points of $f_{3},$ then it is clear that $B\backslash p_{2}\subset\Delta\cap\Delta^{\prime}.$ Let $h$ be a homeomorphism from $\overline{\Delta^{\prime}}$ to $\overline{\Delta},$ such that $h$ restricted to a neighborhood of $B\backslash p_{2}$ is an identity, and let $g=f_{2}\circ h^{-1}.$ Then $g$ is the desired mapping. ∎ ## 10\. Cutting and Gluing Riemann surfaces of normal mappings In this section, we will prove the following theorem, which is used in the proof of Theorem 12.1. ###### Theorem 10.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that each natural edge of $f$ has spherical length strictly less than $\pi$. If $f$ has a branched point in $S\backslash E$, then there exist two normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ such that the followings hold. (i) Each natural edge of $f_{j}$ has spherical length strictly less than $\pi,j=1,2.$ (ii) $\sum_{j=1}^{2}L(f_{j},\partial\Delta)\leq L(f,\partial\Delta),\sum_{j=1}^{2}A(f_{j},\Delta)\geq A(f,\Delta)$. (iii) $V_{NE}(f_{1})+V_{NE}(f_{2})\leq V_{NE}(f)+2,$ $V_{E}(f_{1})+V_{E}(f_{2})\geq V_{E}(f).$ (iv) $V(f_{1})+V(f_{2})\leq V(f)+2.$ The proof will be put to the end of this section, after we establish some results for cutting and gluing the Riemann surface of $f.$ ###### Lemma 10.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, let $p_{0}\in\Delta$ be a ramification point of $f$ and let $\beta=\beta(t),t\in[0,1],$ be a polygonal Jordan path in $S$ with distinct endpoints. Assume that the followings hold. (a) Each natural edge $f$ has spherical length strictly less that $\pi.$ (b) $\beta(0)=f(p_{0}),$ $\beta$ has two lifts $\alpha_{j}=\alpha_{j}(t),t\in[0,1],$ in $\overline{\Delta}$ by $f,$ with (10.1) $\alpha_{j}(0)=p_{0}\ \text{{and\ }}f(\alpha_{j}(t))=\beta(t),t\in[0,1],j=1,2.$ (c) $\alpha_{j}(t)\in\Delta$ for all $t\in[0,1),$ $j=1,2,$ but $\\{\alpha_{1}(1),\alpha_{2}(1)\\}\subset\partial\Delta.$ (d) $f$ has no ramification point in the interior $\alpha_{j}(0,1)=\\{\alpha_{j}(t),t\in(0,1)\\},j=1,2.$ Then there exist normal mappings $f_{1},f_{2}:\overline{\Delta}\rightarrow S,$ such that the following conditions hold. (i) Each natural edge $f_{j}$ has spherical length strictly less that $\pi,$ $j=1,2$. (ii) $L(f,\Delta)\geq L(f_{1},\Delta)+L(f_{2},\Delta)$ and $A(f,\Delta)\leq A(f_{1},\Delta)+A(f_{2},\Delta).$ (iii) $V_{NE}(f_{1})+V_{NE}(f_{2})\leq V_{NE}(f)+2$ and $V_{E}(f_{1})+V_{E}(f_{2})\geq V_{E}(f).$ (iv) $V(f_{1})+V(f_{2})\leq V(f)+2.$ ###### Proof. By Lemma 3.5, we have $\alpha_{1}(1)\neq\alpha_{2}(1),$ and by (b) and (d), $\alpha_{1}$ and $\alpha_{2}$ are Jordan paths that intersect only at $p_{0}.$ Then by the assumption, $\alpha=\alpha_{2}^{-}+\alpha_{1}$ compose a Jordan path in $\overline{\Delta}$ from $\alpha_{2}(1)$ to $\alpha_{1}(1),$ such that the interior of $\alpha$ is contained in $\Delta.$ Thus, $\alpha$ divides the disk $\overline{\Delta}$ into two parts, of which one is on the left hand side of $\alpha$ and is denoted by $\Delta_{1},$ and the other, denoted by $\Delta_{2},$ is on the right hand side of $\alpha$. Now, we consider the restrictions $f|_{\overline{\Delta_{j}}}:\overline{\Delta}\rightarrow S,j=1,2.$ By Lemma 3.4, these two normal mapping can be regarded as two normal mappings $g_{1}$ and $g_{2}$ defined on $\overline{\Delta}$ as follows. Let $\gamma_{j}=\partial\Delta\cap\partial\Delta_{j},$ which is the section of the boundary of $\Delta_{j}$ that is on the circle $\partial\Delta,$ and let $h_{j}:\overline{\Delta_{j}}\rightarrow\overline{\Delta}$ be a continuous mapping such that $h_{j}|_{\Delta}$ is a homeomorphism onto $\Delta_{[0,1]}=\Delta\backslash[0,1],$ in which $[0,1]$ is the interval of the real numbers, $h_{j}\ $maps the interior of $\gamma_{j}$ homeomorphically onto $\left(\partial\Delta\right)\backslash\\{1\\},$ and $h_{j}(\alpha_{j}(t))=t,t\in[0,1].$ Then define $g_{j}=f_{j}\circ h_{j}^{-1},$ and this is the glued mappings from $\overline{\Delta}\ $into $S$. Then the followings hold. (e) The boundary curves of $g_{1}$ and $g_{2}$ compose the boundary curve of $f,$ i.e. the curve $\Gamma_{g_{1}}=g(z),z\in\partial\Delta,$ and the section of the curve $\Gamma_{f}=f(z),$ in which $z$ runs on $\partial\Delta$ from $\alpha_{1}(1)$ to $\alpha_{2}(1)$ are the same and the curve $\Gamma_{g_{2}}=g_{2}(z),z\in\partial\Delta,$ and the the section of the curve $\Gamma_{f}=f(z),$ in which $z$ runs on $\partial\Delta$ from $\alpha_{2}(1)$ to $\alpha_{1}(1)\ $are the same; and (10.2) $A(f,\Delta)=A(g_{1},\Delta)+A(g_{2},\Delta)\ \mathrm{and\ }L(f,\Delta)=L(g_{1},\Delta)+L(g_{2},\Delta).$ Let $p_{j}=e^{i\theta_{j}},j=1,\dots,n,$ be an enumeration of all natural vertices of $f$ that are in order anticlockwise, let $c_{j}=e^{i\theta},\theta\in[\theta_{j},\theta_{j+1}]$ ($\theta_{n+1}=\theta_{1}+2\pi$) be the section of $\partial\Delta$ from $p_{j}$ to $p_{j+1}$ and write $q_{j}=f(p_{j}).$ Then $\displaystyle\Gamma_{f}$ $\displaystyle=$ $\displaystyle\Gamma_{1}+\Gamma_{2}+\Gamma_{3}+\dots+\Gamma_{n}$ $\displaystyle=$ $\displaystyle\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{n-1}q_{n}}+\overline{q_{n}q_{1}}$ is a natural partition of the boundary curve $\Gamma_{f}=f(e^{i\theta}),\theta\in[0,2\pi],$ with (by (a)) $L(\Gamma_{j})<\pi,j=1,2,\dots,n,$ and $n=V(f).$ Without loss of generality, assume $\alpha_{1}(1)\in c_{1}$ and $\alpha_{2}(1)\in c_{j_{0}}$ for some $j_{0}\leq n.$ Let $q^{\prime}=f(\alpha_{1}(1))=f(\alpha_{2}(1)).$ Then, it is clear that the boundary curves $\Gamma_{g_{j}}(z),z\in\partial\Delta,j=1,2,$ have the permitted partitions $\displaystyle\Gamma_{g_{1}}$ $\displaystyle=$ $\displaystyle\overline{q_{j_{0}}q^{\prime}}+\overline{q^{\prime}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{j_{0}-1}q_{j_{0}}}$ $\displaystyle=$ $\displaystyle\Gamma_{11}+\Gamma_{12}+\Gamma_{2}+\dots+\Gamma_{j_{0}-1},$ and $\displaystyle\Gamma_{g_{2}}$ $\displaystyle=$ $\displaystyle\overline{q_{1}q^{\prime}}+\overline{q^{\prime}q_{j_{0}+1}}+\overline{q_{j_{0}+1}q_{j_{0}+2}}+\dots+\overline{q_{n-1}q_{n}}+\overline{q_{n}q_{1}}$ $\displaystyle=$ $\displaystyle\Gamma_{21}+\Gamma_{22}+\Gamma_{j_{0}+1}+\dots+\Gamma_{n},$ respectively, such that $L(\Gamma_{ij})<\pi,i,j=1,2,$ where (10.6) $\Gamma_{11}=\overline{q_{j_{0}}q^{\prime}},\Gamma_{12}=\overline{q^{\prime}q_{2}},\Gamma_{21}=\overline{q_{1}q^{\prime}},\Gamma_{22}=\overline{q^{\prime}q_{j_{0}+1}}.$ If $\alpha_{1}(1)$ (or $\alpha_{2}(1))$ is one of the endpoint of $c_{1}$ (or $c_{j_{0}}),$ then the discussion is similar and easier than the followings, since in this case some of edges in (10.6) reduce to points, and the discussion is left to the reader. So, we assume $\alpha_{1}(1)$ is in the interior of $c_{1}$ and $\alpha_{2}(1)$ is in the interior of $c_{2}.$ Then $q^{\prime}\notin E.$ and it is clear that (10.7) $\left\\{\begin{array}[]{l}V_{NE}(g_{1})+V_{NE}(g_{2})\leq V_{NE}(f)+2,\\\ V_{E}(g_{1})+V_{E}(g_{2})=V_{E}(f),\\\ V(f_{1})+V(f_{2})\leq n+2,\end{array}\right.$ and $\displaystyle L(\Gamma_{1})+L(\Gamma_{j_{0}})$ $\displaystyle=$ $\displaystyle L(\Gamma_{11}+\Gamma_{12})+L(\Gamma_{21}+\Gamma_{22})$ $\displaystyle=$ $\displaystyle L(\Gamma_{11}+\Gamma_{22})+L(\Gamma_{21}+\Gamma_{12}).$ Now, there are two cases need to discuss. Case 1. $\Gamma_{1}^{\prime}=\Gamma_{11}+\Gamma_{12}=\overline{q_{j_{0}}q^{\prime}}+\overline{q^{\prime}q_{2}}$ is not a natural edge of $\Gamma_{g_{1}}.$ Case 2. $\Gamma_{1}^{\prime}=\Gamma_{11}+\Gamma_{12}=\overline{q_{j_{0}}q^{\prime}}+\overline{q^{\prime}q_{2}}$ is a natural edge of $\Gamma_{g_{1}}.$ In Case $1,$ $\Gamma_{2}^{\prime}=\Gamma_{21}+\Gamma_{22}=\overline{q_{1}q^{\prime}}+\overline{q^{\prime}q_{j_{0}+1}}$ not a natural as well. Then the partitions (10) and (10) are natural partitions, since (10) is a natural partition, and then $g_{1},g_{2}$ are the two desired mappings by (10.2) and (10.7). In Case 2, $\Gamma_{2}^{\prime}=\Gamma_{21}+\Gamma_{22}$ is a natural edge as well. Then $\Gamma_{g_{1}}=\Gamma_{1}^{\prime}+\Gamma_{2}+\dots+\Gamma_{j_{0}-1},$ and $\Gamma_{g_{2}}=\Gamma_{2}^{\prime}+\Gamma_{j_{0}+1}+\dots+\Gamma_{n},$ are natural partition of $\Gamma_{g_{1}}$ and $\Gamma_{g_{2}},$ respectively, and then (10.7) changes into (10.9) $\left\\{\begin{array}[]{l}V_{NE}(g_{1})+V_{NE}(g_{2})\leq V_{NE}(f),\\\ V_{E}(g_{1})+V_{E}(g_{2})=V_{E}(f),\\\ V(f_{1})+V(f_{2})=n.\end{array}\right.$ If $L(\Gamma_{1}^{\prime})<\pi$ and $L(\Gamma_{2}^{\prime})<\pi,$ then $g_{1}$ and $g_{2}$ are the desired mappings with (10.9). If $L(\Gamma_{1}^{\prime})\geq\pi,$ then by (10) and the assumption of the lemma, $L(\Gamma_{2}^{\prime})<\pi$. This is because that by the assumption of the lemma, $L(\Gamma_{1}^{\prime})+L(\Gamma_{2}^{\prime})=L(\Gamma_{1})+L(\Gamma_{j_{0}})<2\pi.$ Then applying Theorem 8.1, there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $L(f_{1},\Delta)\leq L(g_{1},\partial\Delta),\mathrm{\ }A(f_{1},\Delta)=A(g_{1},\Delta),$ and $V_{NE}(f_{1})\leq V_{NE}(g_{1}),\mathrm{\ }V_{E}(f_{1})\geq V_{E}(g_{1})+1,V(f_{1})\leq V(g_{1})+2,$ and each natural edges of $\Gamma_{f_{1}}$ has spherical length strictly less than $\pi.$ Then we have by (10.2) and (10.9) that $L(f_{1},\partial\Delta)+L(g_{2},\partial\Delta)\leq L(f,\partial\Delta),A(f_{1}.\Delta)+A(g_{2},\Delta)=A(f,\Delta)$ $V_{NE}(f_{1})+V_{NE}(g_{2})\leq V_{NE}(g_{1})+V_{NE}(g_{2})\leq V_{NE}(f),$ $V_{E}(f_{1})+V_{E}(g_{2})\geq V_{E}(g_{1})+1+V_{E}(g_{2})=V_{E}(f)+1,$ and $V(f_{1})+V(g_{2})\leq V(g_{1})+2+V(g_{2})\leq V(f)+2.$ Thus, $f_{1}$ and $g_{2}$ is the desired mappings. This completes the proof. ∎ ###### Corollary 10.1. Assume that $f,\beta,\alpha_{1}$ and $\alpha_{2}$ satisfy all the assumptions in Lemma 10.1 and, in addition, $\beta(1)\in E.$ Then there exist normal mappings $g_{1},g_{2}:\overline{\Delta}\rightarrow S,$ such that the followings hold. (i) Each natural edge of $\Gamma g_{j}$ is a natural edge of $\Gamma_{f},j=1,2,$ and each natural edge of $\Gamma_{f}$ is a natural edge of either $g_{1}$ or $g_{2}$. (ii) $L(g_{1},\Delta)+L(g_{2},\Delta)=L(f,\Delta)$ and $A(g_{1},\Delta)+A(g_{2},\Delta)=A(f,\Delta).$ (iii) $V_{NE}(g_{1})+V_{NE}(g_{2})=V_{NE}(f),V_{E}(g_{1})+V_{E}(g_{2})=V_{E}(f),$ $V(g_{1})+V(g_{2})=V(f).$ (iv) (10.10) $\sum_{p\in\overline{\Delta}\backslash g_{1}^{-1}(E)}b_{g_{1}}(p)+\sum_{p\in\overline{\Delta}\backslash g_{2}^{-1}(E)}b_{g_{2}}(p)\leq\sum_{p\in\overline{\Delta}\backslash f^{-1}(E)}b_{f}(p).$ ###### Proof. By repeating the above proof from the beginning to (10.6) and considering that, in current situation, $q^{\prime}=f(\alpha(1))=f(\alpha_{2}(1))$ must be a natural vertex of $f,g_{1}$ and $g_{2},$ we can conclude that all the conclusion follows, except the inequality (iv). By the assumption and the definition of $g_{j}$s, it is clear that (10.11) $b_{g_{1}}(0)+b_{g_{2}}(0)=b_{f}(p_{0})-1.$ Next, we show that (10.12) $b_{g_{1}}(1)+b_{g_{2}}(1)\leq b_{f}(\alpha_{1}(1))+b_{f}(\alpha_{2}(1))+1.$ Let $l_{j}$ be the circular arc of the circle $C_{j}:|z-\alpha_{j}(1)|=\varepsilon$ inside $\overline{\Delta}$ and $\gamma_{j}$ be the section of $\partial\Delta$ inside $C_{j},j=1,2;$ let $l$ be the circular arc of the circle $C:|z-1|$ inside $\overline{\Delta}$ and $\gamma^{\prime}$ be the section of $\partial\Delta$ inside $C,j=1,2;$ where $\varepsilon$ is a sufficiently small positive number. Let $s_{1},s_{2},s_{1}^{\prime},s_{2}^{\prime}$ be smooth and orientation preserved diffeomorphisms from neighborhoods of $f(a_{1}(1))$, $f(\alpha_{2}(1)),g_{1}(1)$ and $g_{2}(1)$ onto the disk $\Delta$ with $s_{j}(f(\alpha_{j}(1))=0,s_{j}^{\prime}(g_{j}(1))=0,$ such that they keep the angles at $f(a_{1}(1))$, $f(\alpha_{2}(1)),g_{1}(1)$ and $g_{2}(1)$ and maps $f(\gamma_{1}),f(\gamma_{2}),g_{1}(\gamma_{1}^{\prime})$ and $g_{2}(\gamma_{2}^{\prime})$ onto angles (broken lines) with vertices $f(a_{1}(1))$, $f(\alpha_{2}(1)),g_{1}(1)$ and $g_{2}(1),$ respectively, in $\mathbb{C}$. Then we can define the rotation numbers $\tau_{j}=\frac{1}{2\pi}\int_{l_{j}}\frac{d\left(s_{j}\circ f(z)\right)}{s_{j}\circ f(z)}\ \mathrm{and\ }\tau_{j}^{\prime}=\frac{1}{2\pi}\int_{l}\frac{d\left(s_{j}^{\prime}\circ g_{j}(z)\right)}{s_{j}^{\prime}\circ g_{j}(z)},$ which is invariant for sufficiently small $\varepsilon$, independent of $s_{j}$s and $s_{j}^{\prime}$s by the assumption and all are positive because $s_{j}$s and $s_{j}^{\prime}$s are orientation preserved and $g_{j}$s and $f$ are normal. It is clear that (10.13) $\tau_{1}^{\prime}+\tau_{2}^{\prime}=\tau_{1}+\tau_{2}.$ Then there exists $k_{j}$ and $k_{j}^{\prime},j=1,2,$ such that $k_{j}^{\prime}<\tau_{j}^{\prime}\leq k_{j}^{\prime}+1,k_{j}<\tau_{j}\leq k_{j}+1,j=1,2,$ and then we have $\displaystyle b_{g_{1}}(1)+b_{g_{2}}(1)$ $\displaystyle=$ $\displaystyle k_{1}^{\prime}+k_{2}^{\prime}$ $\displaystyle<$ $\displaystyle\tau_{1}^{\prime}+\tau_{2}^{\prime}=\tau_{1}+\tau_{2}\leq k_{1}+k_{2}+2$ $\displaystyle=$ $\displaystyle b_{f}(\alpha(1))+b_{f}(\alpha_{2}(1))+2,$ but branched numbers are integers, we have (10.12). It is clear that, by the definition of $g_{j}$s $\sum_{p\in\overline{\Delta}\backslash\\{\alpha_{1}(1),\alpha_{2}(1)\\}}b_{f}(p)=\sum_{j=1}^{2}\sum_{p\in\overline{\Delta}\backslash\\{1\\}}b_{g_{j}}(p),$ which, together (10.11) and (10.12), implies (10.10). ∎ ###### Lemma 10.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping, let $\alpha_{1}=\alpha_{1}(\theta)=e^{i\theta},\theta\in[\theta_{1},\theta_{2}],$ be a section of $\partial\Delta$ and denote $\beta=\beta(\theta)=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{2}].$ Assume that the followings hold: (a) Each natural edge $f_{j}$ has spherical length strictly less that $\pi.$ (b) $\beta$ is a Jordan path with distinct endpoints and $\beta(\theta)\notin E\ \mathrm{for\ each\ }t\in[\theta_{1},\theta_{2}).$ (c) $\beta$ has a lift $\alpha_{2}=\alpha_{2}(\theta),\theta\in[\theta_{1},\theta_{2}],$ in $\overline{\Delta},$ with $\alpha_{2}(\theta_{1})=\alpha_{1}(\theta_{1})=e^{i\theta_{1}},$ and $f(e^{i\theta})=f(\alpha_{1}(\theta))=\beta(\theta),\theta\in[\theta_{1},\theta_{2}].$ (d) $f$ has no ramification point in the interior of $\alpha_{1}$ and $\alpha_{2}.$ (e) The interior of $\alpha_{2},$ which means the open curve $\alpha_{2}(\theta),\theta\in(\theta_{1},\theta_{2}),$ is contained in $\Delta,\ $but $\\{\alpha_{2}(\theta_{2})\\}\subset\partial\Delta.$ Then there exist two normal mappings $f_{1},f_{2}:\overline{\Delta}\rightarrow S,$ such that the followings hold. (i) Each natural edge $f_{j}$ has spherical length strictly less that $\pi,$ $j=1,2$. (ii) $A(f,\Delta)\leq A(f_{1},\Delta)+A(f_{2},\Delta)\ \mathrm{and\ }L(f,\Delta)\geq L(f_{1},\Delta)+L(f_{2},\Delta).$ (iii) $V_{NE}(f_{1})+V_{NE}(f_{2})\leq V_{NE}(f)+2,$ and $V_{E}(f_{1})+V_{E}(f_{2})\geq V_{E}(f).$ (iv) $V(f_{1})+V(f_{2})\leq V(f)+2.$ ###### Proof. By Lemma 3.5, we have $\alpha_{1}(\theta_{2})\neq\alpha_{2}(\theta_{2}).$ $\alpha_{2}$ divides the disk $\overline{\Delta}$ into two parts, one of which denoted by $\Delta_{1},$ is on the left hand side of $\alpha_{2},$ and the other, denoted by $\Delta_{2},$ is on the right hand side. Then, $\alpha_{1}$ is a section of $\partial\Delta_{2}.$ By ignoring a coordinate transform, we may regard the restriction $f|_{\overline{\Delta_{1}}}$ as a normal mapping $g_{1}$ defined on $\overline{\Delta}.$ Consider the Jordan domain $\Delta_{2}.$ By Lemma 3.4, we can glue the $\alpha_{1}$ and $\alpha_{2}$ so that the restriction $f|_{\overline{\Delta_{2}}}$ can be regarded as a normal mapping $g_{2}:\overline{\Delta}\rightarrow S,$ as we did in the proof of Lemma 10.1. Then the followings hold: (e) The boundary curves of $g_{1}$ and $g_{2}$ compose the boundary curve of $f,$ i.e. the curve $\Gamma_{g_{1}}=g(z),z\in\partial\Delta,$ and the section of the curve $\Gamma_{f}=f(z),$ in which $z$ runs on $\partial\Delta$ from $\alpha_{1}(1)$ to $\alpha_{2}(1)$ are the same and the curve $\Gamma_{g_{2}}=g_{2}(z),z\in\partial\Delta,$ and the the section of the curve $\Gamma_{f}=f(z),$ in which $z$ runs on $\partial\Delta$ from $\alpha_{2}(1)$ to $\alpha_{1}(1)\ $are the same; and (10.14) $A(f,\Delta)=A(g_{1},\Delta)+A(g_{2},\Delta)\ \mathrm{and\ }L(f,\Delta)=L(g_{1},\Delta)+L(g_{2},\Delta).$ Then, as in the proof of Lemma 10.1, there exist normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ satisfied the conclusions. ∎ ###### Corollary 10.2. Assume that $f,\beta,\alpha_{1}$ and $\alpha_{2}$ satisfy all the assumptions in Lemma 10.2 and, in addition, $\beta(1)\in E.$ Then all the conclusions of Corollary 10.1 hold. ###### Proof. Repeat the above proof from the beginning to (10.14) and repeat the proof of Corollary 10.1. ∎ ###### Lemma 10.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that each natural edge of $f$ has spherical length strictly less than $\pi$. If $f$ has a ramification point in $\Delta,$ then, one of the following conditions (A) and (B) is satisfied. (A) There exists a normal mappings $f_{1}:\overline{\Delta}\rightarrow S$ such that, the followings hold. (i) The boundary curve $\Gamma_{f_{1}}=f_{1}(z),z\in\partial\Delta$, is the same as that of $f$. (ii) $L(f_{1},\partial\Delta)=L(f,\partial\Delta),A(f_{1},\Delta)=A(f,\Delta).$ (iii) $f_{1}$ has no ramification point in $\Delta.$ (iv) $f_{1}$ has at least one ramification point in $\left(\partial\Delta\right)\backslash f_{1}^{-1}(E).$ (B) There exist normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ such that the followings hold. (i) Each natural edge of $f_{j}$ has spherical length strictly less than $\pi,j=1,2$. (ii) $\sum_{j=1}^{2}L(f_{j},\partial\Delta)\leq L(f,\partial\Delta),\sum_{j=1}^{2}A(f_{j},\Delta)\geq A(f,\Delta).$ (iii) $V_{NE}(f_{1})+V_{NE}(f_{2})\leq E(f)+2,$ $V_{E}(f_{1})+V_{E}(f_{2})\geq V_{E}(f).$ (iv) $V(f_{1})+V(f_{2})\leq V(f)+2.$ ###### Proof. Let $p_{0}\in\Delta$ be any ramification point of $f$ and let $\beta=\beta(t),t\in[0,1],$ be a polygonal Jordan path in $S$ from $q_{0}=f(p_{0})$ to some point $q_{1}\in E=\\{0,1,\infty\\}$ such that the interior of $\beta$ does not contain any point in $E$. Then $\beta(0)\neq\beta(1),$ since $f$ is normal. We may assume that (a) There is no branched point of $f$ in the interior of $\beta$ (otherwise, we deform $\beta$ slightly$).$ Let $d=v_{f}(p_{0}).$ Then, by (a) and the fact that $f(\Delta)\cap E=\emptyset$ (note that $f$ is normal) we conclude that there are only two cases: Case 1. There exists a positive number $t_{1}\leq 1,$ such that the followings hold. (a1) The section $\beta[0,t_{1}]=\\{\beta(t);t\in[0,t_{1}]\\}$ of $\beta$ has two lifts $\alpha_{j}=\alpha_{j}(t),t\in[0,t_{1}],$ in $\overline{\Delta}$ by $f,$ such that $\alpha_{j}(0)=p_{0}\text{{and\ }}f(\alpha_{j}(t))=\beta(t),t\in[0,t_{1}];j=1,2.$ (b1) For $j=1$ and $2,$ $\alpha_{j}(t)\in\Delta$ for all $t\in[0,t_{1}],$ but $\\{\alpha_{1}(t_{1}),\alpha_{2}(t_{1})\\}\subset\partial\Delta.$ (c1) $f$ has no ramification point in the interior of $\alpha_{1}$ and $\alpha_{2},$ i.e. $f$ has no ramification point on $\alpha_{1}(0,1)\cup\alpha_{2}(0,1),$ where $\alpha_{j}(0,1)$ is the open curve $\alpha_{j}(t),t\in(0,1),$ which is the curve $\alpha_{j}$ without end points, $j=1,2.$ Case 2. There exists a positive number $t_{1}\leq 1,$ such that the followings hold. (a2) The section $\beta(t),t\in[0,t_{1}],$ of $\beta$ has a number of $d=v_{f}(p_{0})$ lifts $\alpha_{j}=\alpha_{j}(t),t\in[0,t_{1}],$ in $\overline{\Delta},$ such that (10.15) $\cup_{j=2}^{d}\alpha_{j}\subset\Delta,$ $f(\alpha_{j}(t))=\beta(t),t\in[0,t_{1}],\mathrm{\ }j=1,\dots,d,$ and $\alpha_{j}(0)=p_{0},\mathrm{\ }j=1,\dots,d.$ (b2) $\alpha_{1}(t)\in\Delta$ for all $t\in[0,t_{1})\ $but $p_{1}^{\prime}=\alpha_{1}(t_{1})\in\partial\Delta.$ In Case 1, by Lemmas 10.1, (B) is satisfied. Now, assume Case 2 occurs. Then, we must have $t_{1}<1.$ Otherwise, we have $f(\alpha_{2}(t_{1}))=\beta(1)=q_{1}\in E,$ and then by the fact $f(\Delta)\cap E=\emptyset,$ we have $\alpha_{2}(t_{1})\in\partial\Delta,$ contradicting (10.15). Thus by (a) we have: (c2) $f$ has no ramification point on $\cup_{j=1}^{d}\alpha_{j}(0,t_{1}],$ where $\alpha_{j}(0,t_{1}]$ is the curve $\alpha_{j}(t),t\in(0,t_{1}],$ which is the curve $\alpha_{j}$ without initial point, $j=1,2,\dots d.$ Then, by (a2), (b2) and (c2), Lemma 9.2 applies, and then, there exists a normal mapping $g_{1}:\overline{\Delta}\rightarrow S$ such that (recall that $p_{1}^{\prime}=\alpha_{1}(t_{1}))$ (10.16) $\\#\\{p\in\Delta;b_{g_{1}}(p)>1\\}=\\#\\{p\in\Delta;b_{f}(p)>1\\}-1,$ (10.17) $b_{g_{1}}(p_{1}^{\prime})=b_{f}(p_{0})$ (10.18) $L(g_{1},\partial\Delta)=L(f,\partial\Delta),A(g_{1},\Delta)=A(f,\Delta),$ and (d) The boundary curve of $g_{1}$ is the same as that of $f.$ Then, $g_{1}$ satisfies (i), (ii) of condition (A). By (10.17), $p_{1}^{\prime}\in\partial\Delta$ is a ramification point of $g_{1}.$ On the other hand, by (b2) and (10.15) $g_{1}(\partial\Delta)\ni g_{1}(p_{1}^{\prime})=f(p_{1}^{\prime})=f(\alpha_{1}(t_{1}))=f(\alpha_{2}(t_{1}))\in f(\Delta),$ ,i.e. $g_{1}(p_{1}^{\prime})\in g_{1}(\partial\Delta)\cap f(\Delta),$ and then $g_{1}(p_{1}^{\prime})\notin E$ since $f$ is normal. Thus, (iv) of (A) hold. If $g_{1}$ does not satisfies (iii) in (A), then $g_{1}$ satisfies all assumptions of the lemma under proving, but the number of ramification points of $g_{1}$ located in $\Delta$ is dropped by one (by (10.16)), and then apply the above argument, we again reach Case 1 or Case 2. Since there are finitely many ramification point of $f$ in $\Delta,$ after repeating the above arguments finitely many time, we can show that either (A) or (B) holds. ∎ ###### Lemma 10.4. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that (a) Each natural edge of $f$ has length strictly less than $\pi,$ and (b) $f$ has no ramification point in $\Delta$. Assume that there exist $\theta_{1}$ and $\theta_{3}$ with $\theta_{1}<\theta_{3}<\theta_{1}+2\pi$ such that the followings hold. (c) $p_{1}=e^{i\theta_{1}}\in\partial\Delta\backslash f^{-1}(E)$ is a ramification point of $f.\ $Note that $E=\\{0,1,\infty\\}.$ (d) $f(e^{i\theta_{3}})\in E\ $but $f(e^{i\theta})\notin E$ for each $\theta\in(\theta_{1},\theta_{3}).$ (e) Each point $e^{i\theta}\in\partial\Delta$ with $\theta\in(\theta_{1},\theta_{3})$ is not a ramification point of $f$. Then, there exist two normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ such that the followings holds. (i) Each natural edge of $f_{j}$ has length strictly less than $\pi$, $j=1,2.$ (ii) $\sum_{j=1}^{2}L(f_{j},\partial\Delta)\leq L(f,\partial\Delta),\sum_{j=1}^{2}A(f_{j},\Delta)\geq A(f,\Delta).$ (iii) $V_{NE}(f_{1})+V_{NE}(f_{2})\leq V_{NE}(f)+2,$ $V_{E}(f_{1})+V_{E}(f_{2})\geq V_{E}(f).$ (iv) $V(f_{1})+V(f_{2})\leq V(f)+2.$ ###### Proof. By the assumption, there are only two cases need to discuss. Case 1. There exist $\theta_{4},\theta_{5}\in(\theta_{1},\theta_{2})\ $with $\theta_{4}<\theta_{5}$ such that (f) $e^{i\theta_{4}}$ is a natural vertex of $f.$ (g) Both of the sections $\Gamma_{14}=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{4}],$ and $\Gamma_{45}=f(e^{i\theta}),\theta\in[\theta_{4},\theta_{5}]$ are Jordan paths with $\Gamma_{14}(\theta_{1})\neq\Gamma_{14}(\theta_{4})$ and $\Gamma_{45}(\theta_{4})\neq\Gamma_{45}(\theta_{5})$, but $\Gamma_{14}+\Gamma_{45}$ is not a Jordan curve. Case 2. The section $\Gamma_{13}=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{3}],$ is a Jordan path. Let $d=v_{f}(p_{0}).$ We first assume Case 1 occur. Then, there exists a positive number $\delta$ and there exist a number of $d$ Jordan paths $\alpha_{j,\delta}=\alpha_{j,\delta}(\theta),\theta\in[\theta_{1},\theta_{1+\delta}],j=1,\dots,d,$ such that $\alpha_{1,\delta}(\theta)=e^{i\theta},\theta\in[\theta_{1},\theta_{1+\delta}],$ $\alpha_{j,\delta}(\theta_{1})=p_{1},j=1,\dots,d,$ $\alpha_{j,\delta}(\theta)\in\Delta,\theta\in(\theta_{1},\theta_{1+\delta}),j=2,3,\dots d,$ and $f(\alpha_{j,\delta}(\theta))=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{1+\delta}],j=1,\dots,d.$ Since $f$ has no ramification point in $\Delta,$ there are only two further cases for Case 1. Case 1.1. Each $\alpha_{j,\delta}$ can be extended to be a Jordan path $\alpha_{j}=\alpha_{j}(\theta),\theta\in[\theta_{1},\theta_{4}],$ such that $\alpha_{j}(\theta)\in\Delta,\theta\in(\theta_{1},\theta_{4}],j=2,3,\dots,d,$ and $f(\alpha_{j}(\theta))=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{4}],j=2,3,\dots,d.$ Case 1.2. For some $j_{0}\in\\{2,3,\dots,d\\},$ there exists $\theta_{2}\in(\theta_{1},\theta_{4}]$ such that $\alpha_{j_{0},\delta}$ can be extended to be a Jordan path $\alpha_{j_{0}}=\alpha_{j_{0}}(\theta),\theta\in[\theta_{1},\theta_{2}],$ such that $\alpha_{j_{0}}(\theta_{2})\in\partial\Delta,$ $\alpha_{j_{0}}(\theta)\in\Delta,\theta\in(\theta_{1},\theta_{2}),$ $f(\alpha_{j_{0}}(\theta))=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{2}].$ In Case 1.1, since $f$ has no ramification point in $\Delta$, $f$ has no ramification point in the interior of each $\alpha_{j},j=2,\dots,d,$ and then $f,\alpha_{1},\dots,\alpha_{d}$ and $\beta=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{4}]$ satisfy all assumptions of Lemma 9.3 by (e). Then Lemma 9.3 apply, and then there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $g(e^{i\theta})=f(e^{i\theta}),\theta\in[0,2\pi],$ $b_{g}(p_{1})=0,b_{g}(p_{2})=b_{f}(p_{1}),$ $b_{g}(p)=b_{f}(p)\ \mathrm{for\ a}\text{{l}}\mathrm{l\ }p\in\overline{\Delta}\backslash\\{p_{1},p_{2}\\},$ and $L(g,\partial\Delta)=L(f,\partial\Delta),A(g,\Delta)=A(f,\Delta).$ Then $g$ satisfies all the assumptions in the lemma under proving by replacing $\theta_{1}$ with $\theta_{4}$. But now, the number of loops of the section $g(e^{i\theta}),\theta\in[\theta_{4},\theta_{3}],$ is dropped by one. Then, by repeating the same argument several times, we can find a number $\theta_{1}^{\prime}\in[\theta_{1},\theta_{3}),$ and a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $f_{1}(e^{i\theta})=f(e^{i\theta}),\theta\in[0,2\pi],$ $f_{1}$, $\theta_{1}=\theta_{1}^{\prime}$ and $\theta_{3}$ satisfy all assumptions of the lemma and fit case Case 2. In Case 1.2, $f$ also has no ramification point in the interior of each $\alpha_{j},j=1,j_{0}.$ Without loss of generality, we assume $j_{0}=2.$ Then, $f,\alpha_{1},\alpha_{2}=\alpha_{j_{0}}$ and $\beta=\beta=f(e^{i\theta}),\theta\in[\theta_{1},\theta_{2}]$, satisfy all assumptions of Lemma 10.2. Then by Lemmas 10.2, There exist two normal mappings $f_{1},f_{2}:\overline{\Delta}\rightarrow S,$ satisfying (i)–(ii). Now assume Case 2 occurs. Then since $f(\Delta)\cap E=\emptyset$ (note that $f$ is normal), by (a)–(e), there exists $\theta_{2}\in(\theta_{1},\theta_{3}]$ such that the sections $\alpha_{1}=e^{i\theta}$ and $\beta=f(e^{i\theta})$ with $\theta\in[\theta_{1},\theta_{2}]$ satisfy all assumptions of Lemma 10.2, and the arguments in Case 1.2 apply. This completes the proof. ∎ ###### Proof of Theorem10.1. Assume $f$ has a branched point in $f(\overline{\Delta})\backslash E.$ There are two cases: Case 1. $f$ has a ramification point in $\Delta.$ Case 2. $f$ has no ramification point in $\Delta,$ but has a ramification point in $\partial\Delta\backslash f^{-1}(E).$ In Case 1, Lemma 10.3 applies, and we have the following conclusions (A) or (B). (A) There exists a normal mappings $g_{1}:\overline{\Delta}\rightarrow S$ such that, the followings hold. (1) The boundary curve $\Gamma_{g_{1}}=g_{1}(z),z\in\partial\Delta$, is the same as that of $f$. (2) $L(g_{1},\partial\Delta)=L(f,\partial\Delta),A(g_{1},\Delta)=A(f,\Delta).$ (3) $g_{1}$ has no ramification point in $\Delta.$ (4) $g_{1}$ has at least one branched point in $f(\partial\Delta)\backslash E.$ (B) The conclusions of Theorem 10.1 hold true. If (A) occurs, then $g_{1}$ has a ramification point $p_{1}\in\left(\partial\Delta\right)\backslash f^{-1}(E),$ and then we can found $\theta_{1}$ and $\theta_{3}$ such that $g_{1}$, $\theta_{1}$ and $\theta_{3}$ satisfy all assumptions of Lemma 10.4, and then (B) holds. In Case 2, Lemma 10.4applies, and so, the conclusions of Theorem 10.1 hold true again. ∎ ## 11\. Deformation of normal mappings that have nonconvex vertices In this section we will prove the following theorem, which is used to prove Theorem 12.1. Theorem 12.1 is the first key step to prove the main theorem. ###### Theorem 11.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that each natural edge of $\Gamma_{f}$ has length strictly less than $\pi$. If $\Gamma_{f}$ is not convex at some natural vertex $q$ and $q\notin E.$ Then there exists a normal mapping $g:\overline{\Delta}\rightarrow S,$ such that $L(g,\partial\Delta)\leq L(f,\partial\Delta),A(g,\Delta)\geq A(f,\Delta),$ each natural edge of $g$ has spherical length strictly less than $\pi,$ and $V_{NE}(g)\leq V_{NE}(f)-1,\mathrm{\ }V_{E}(g)\geq V_{E}(f)\ \mathrm{and}\ V(g)\leq V(f)+1.$ ###### Proof. We divide the proof into four parts, which is the coming Lemmas 11.1–11.4. ∎ Before we introduce these lemmas, we first make some conventions. We fix the normal mapping $f:\overline{\Delta}\rightarrow S$ and assume (11.1) $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}+\Gamma_{3}+\dots+\Gamma_{n}$ is a natural partition of $\Gamma_{f},$ with $n=V(f)$, $\partial\Delta=\gamma_{1}+\dots+\gamma_{n}$ is the corresponding natural partition of $\partial\Delta$ for $f,$ and denote by $p_{j}=e^{i\theta_{j}},j=1,\dots,n,$ the initial point of $\gamma_{j},j=1,\dots,n$, with $\theta_{j+1}=\theta_{1}$ and $\theta_{1}<\theta_{2}<\dots<\theta_{n}<\theta_{1}+2\pi;$ and assume that (I) All natural edges of $f$ has spherical length strictly less than $\pi.$ Then, $q_{j}=f(p_{j})$ is the initial point of $\Gamma_{j}$ for each $j=1,2,\dots,n,$ and by (I), the notation $\overline{q_{j}q_{j+1}}$ makes sense, which is the unique shortest path from $q_{j}$ to $q_{j+1},$ and $\Gamma_{j}=\overline{q_{j}q_{j+1}},j=1,2,\dots,n.$ Therefore, the natural partition (11.1) can be written $\Gamma_{f}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{n-1}q_{n}}.$ We will also assume that (II) $\Gamma_{1}+\Gamma_{2}$ is not convex at $q_{2}\notin E.$ The assumption (II) means that either $\Gamma_{1}+\Gamma_{2}$ can be regarded as a perigon angle, or the oriented triangle $\overline{q_{1}q_{3}q_{2}q_{1}}$ is a convex triangle. When $\Gamma_{1}+\Gamma_{2}$ is a perigon angle, there is only one case need to discuss. Case A. $q_{3}\in\Gamma_{1}=\overline{q_{1}q_{2}}$ or $q_{1}\in\Gamma_{2}=\overline{q_{2}q_{3}}$. When $\overline{q_{1}q_{3}q_{2}q_{1}}$ is a convex triangle, it encloses a triangle domain $T$ that is on the right hand side of $\Gamma_{1}+\Gamma_{2},$ and there are only three cases need to discuss: Case B. $\left(\overline{\mathbf{T}}\backslash\\{q_{1},q_{3}\\})\cap E\right)=\emptyset.$ Case C. There is only one point $q_{1}^{\prime}$ in $E=\\{0,1,\infty\\}$ that is located in $\overline{T}\backslash\\{\Gamma_{1}+\Gamma_{2}\\}.$ Case D. There exist two points $q_{1}^{\prime}$ and $q_{1}^{\prime\prime}$ in $E=\\{0,1,\infty\\}$ that is located in the triangle domain $T.$ Under these settings, we can execute deformations of $f\ $which will be stated in the following Lemmas 11.1–11.4. ###### Lemma 11.1. In Case A, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (11.2) $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)\geq A(f,\Delta),$ each natural edge of $\Gamma_{g}$ has spherical length strictly less than $\pi,$ and (11.3) $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)\geq V_{E}(f),V(g)=V(f).$ ###### Proof. Assume Case A occurs. Then, without loss of generality, we may assume $q_{3}\in\Gamma_{1}.$ Let $p^{\prime}=e^{i\theta_{1}^{\prime}}$, $\theta_{1}^{\prime}\in(\theta_{1},\theta_{2}),$ such that $f(p^{\prime})=q_{3}.$ Then we can glue the section of $\partial\Delta$ from $p^{\prime}$ to $p_{2}$ and the section of $\partial\Delta$ from $p_{2}$ to $p_{3}$ and regard $f$ as a mapping $g$ of the glued closed set, which can be regard as a closed disk, such that the boundary curve of $g$ has a permitted partition (11.4) $\Gamma_{g}=\Gamma_{1}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n},$ where $\Gamma^{\prime}=\overline{q_{1}q^{\prime}}=\overline{q_{1}q_{3}}$ is the section of $\Gamma_{1}$ from $q_{1}=f(p_{1})$ to $q^{\prime}=f(p^{\prime})=q_{3},$ and (11.5) $L(g,\partial\Delta)<L(f,\partial\Delta),\ A(g,\Delta)=A(f,\Delta).$ By (11.4), we have (11.3). If (11.4) is a natural partition, then $g$ also satisfies (I) and then $g$ is the desired mapping. Assume that (11.4) is not a natural partition, which is only in the case that $\Gamma_{1}^{\prime\prime}=\Gamma_{1}^{\prime}+\Gamma_{3}=\overline{q_{1}q_{3}}+\overline{q_{3}q_{4}}$ is a natural edge of $\Gamma_{g}$ . But in this case, $\Gamma_{g}=\Gamma_{1}^{\prime\prime}+\Gamma_{4}+\dots+\Gamma_{n}$ is a natural partition, and then we have (11.6) $V_{NE}(g)=V_{NE}(f)-2,V_{E}(g)=V_{E}(f),\ V(g)=V(f)-2.$ By (I) we have $L(\Gamma_{1}^{\prime\prime})<2\pi.$ If $L(\Gamma_{1}^{\prime\prime})<\pi,$ then $g$ already satisfies all the conclusions of Lemma 11.1. If $L(\Gamma_{1}^{\prime\prime})\geq\pi,$ then $g$ satisfies (a) or (b) of Theorem 8.1, and then there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $L(f_{1},\partial\Delta)\leq L(g,\partial\Delta),A(f_{1},\Delta)\geq A(g,\Delta),$ each natural edge of $f_{1}$ has spherical length strictly less than $\pi,$ and $V_{NE}(f_{1})\leq V_{NE}(g),V_{E}(f_{1})\geq V_{E}(g)+1,V(f_{1})\leq V(g)+2.$ Then by (11.5) and (11.6) we have $L(f_{1},\partial\Delta)<L(f,\partial\Delta),A(f_{1},\Delta)\geq A(f,\Delta),$ and $V_{NE}(f_{1})\leq V_{NE}(f)-2,V_{E}(f_{1})\geq V_{E}(f)+1>V_{E}(f),V(f_{1})\leq V(f).$ Thus, $f_{1}$ satisfies all the conclusion of Lemma 11.1. ∎ ###### Lemma 11.2. In Case B, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)>A(f,\Delta),$ each natural edge of $\Gamma_{g}$ has spherical length strictly less than $\pi,$ and $V_{NE}(g)\leq V_{NE}(f)-1,\text{{\ }}V_{E}(g)\geq V_{E}(f),V(g)\leq V(f).$ ###### Proof. Putting $\Gamma_{1}^{\prime}=\overline{q_{1}q_{3}},$ by (I) and (II), we have (11.7) $L(\Gamma_{1}^{\prime})=L(\overline{q_{1}q_{3}})<\pi.$ as in the previous proof, by Lemma 3.2, there exists a normal mapping $g$, which will be regarded as an extension of $f,$ such that $\Gamma_{g}$ has the permitted partition (11.8) $\Gamma_{g}=\Gamma_{1}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n},$ and $L(g,\partial\Delta)<L(f,\partial\Delta),A(g,\Delta)>A(f,\Delta).$ Then $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)=V_{E}(f),V(g)\leq V(f)-1,$ and there are four cases: Case 1. Neither $\overline{q_{n}q_{1}q_{3}}$ nor $\overline{q_{1}q_{3}q_{4}}\ $is a natural edge of $\Gamma_{g}.$ Case 2. $\overline{q_{n}q_{1}q_{3}}\ $is a natural edge of $\Gamma_{g},$ while $\overline{q_{1}q_{3}q_{4}}\ $is not. Case 3. $\overline{q_{n}q_{1}q_{3}}$ is not a natural edge of $\Gamma_{g}$, while $\overline{q_{1}q_{3}q_{4}}$ is. Case 4. Both $\overline{q_{n}q_{1}q_{3}q_{4}}\ $is a natural edge of $\Gamma_{g}$. In Case 1, (11.8) is a natural partition, and $g$ is the desired mapping. In Case 2, $g$ has a natural partition $\Gamma_{g}=\Gamma_{1}^{\prime\prime}+\Gamma_{3}+\dots+\Gamma_{n-1},$ where $\Gamma_{1}^{\prime\prime}=\Gamma_{n}+\Gamma_{1}^{\prime}=\overline{q_{n}q_{1}q_{3}},$ and it is clear that $V_{NE}(g)=V_{NE}(f)-2,V_{E}(g)=V_{E}(f),V(g)=V(f)-2,$ and by (I) and (11.7), (11.9) $L(\Gamma_{1}^{\prime\prime})<2\pi.$ If $L(\Gamma_{1}^{\prime\prime})<\pi,$ the $g$ satisfies all the conclusions. If $L(\Gamma_{1}^{\prime\prime})\geq\pi,$ then by (I), (11.9) and Theorem 8.1 for the cases (a) and (b), there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $L(f_{1},\partial\Delta)\leq L(g,\partial\Delta),A(f_{1},\Delta)\geq A(g,\Delta),$ each natural edge of $f_{1}$ has spherical length strictly less than $\pi,$ and $V_{NE}(f_{1})\leq V_{NE}(g_{1}),\mathrm{\ }V_{E}(f_{1})\geq V_{E}(g)+1,V(f_{1})\leq V(g)+2.$ Then $f_{1}$ satisfies all the desired conditions in the lemma with $V_{NE}(f_{1})\leq V_{NE}(f)-2,V_{E}(f_{1})\geq V_{E}(f)+1\ \mathrm{and\ }V(f_{1})\leq V(f).$ Case $3$ can be treated as Case $2.$ In case $4$ we have (11.10) $V_{NE}(g)=V_{NE}(f)-3,V_{E}(g)=V_{E}(f),V(g)=V(f)-3,$ and $g$ has a natural partition (11.11) $\Gamma_{g}=\Gamma_{1}^{\prime\prime\prime}+\Gamma_{4}+\dots+\Gamma_{n-1},$ where $\Gamma_{1}^{\prime\prime\prime}=\overline{q_{n}q_{1}}+\overline{q_{1}q_{3}}+\overline{q_{3}q_{4}}=\Gamma_{n}+\Gamma_{1}^{\prime}+\Gamma_{3}.$ Then by (I) and (11.7) we have (11.12) $\Gamma_{1}^{\prime\prime\prime}<3\pi.$ If $L(\Gamma_{1}^{\prime\prime\prime})<\pi,$ then by (I), (11.10) and (11.11), $g$ is the desire mapping. If $L(\Gamma_{1}^{\prime\prime\prime})\geq\pi,$ then by (I), (11.11) and Theorem 8.1 (a), (b) and (d), there exists a normal mapping $g_{1}:\overline{\Delta}\rightarrow S$ such that $L(g_{1},\partial\Delta)\leq L(g,\partial\Delta),A(g_{1},\Delta)\geq A(g,\Delta),$ each natural edge of $g_{1}$ has spherical length strictly less than $\pi,$ and $V_{NE}(g_{1})\leq V_{NE}(g_{1})+2,\mathrm{\ }V_{E}(g_{1})\geq V_{E}(g)+1,V(g_{1})\leq V(g)+3.$ Then $g_{1}$ satisfies all the desired conditions in the lemma with (by (11.10)) $V_{NE}(g_{1})\leq V_{NE}(f)-1,V_{E}(g_{1})\geq V_{E}(f)+1\ \mathrm{and\ }V(g_{1})\leq V(f).$ This completes the proof. ∎ ###### Lemma 11.3. In Cases C, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)>A(f,\Delta),$ each natural edge of $\Gamma_{g}$ has spherical length strictly less than $\pi,$ and $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)\geq V_{E}(f)+1\ \mathrm{and}\ V(g)\leq V(f).$ ###### Proof. Assume Case C occurs and let $\Gamma_{1}^{\prime}=\overline{q_{1}q_{1}^{\prime}}$ and $\Gamma_{2}^{\prime}=\overline{q_{1}^{\prime}q_{2}}.$ Then, considering that $q_{1},q_{1}^{\prime},q_{2}$ are contained in the closure of the triangle domain $T$ which in on the left hand side of the convex triangle $\overline{q_{1}q_{3}q_{2}q_{1}},$ we have (11.13) $L(\Gamma_{1}^{\prime})<\pi,L(\Gamma_{2}^{\prime})<\pi,\ L(\Gamma_{1}^{\prime}+\Gamma_{2}^{\prime})<L(\Gamma_{1}+\Gamma_{2}),$ and it is clear that $\Gamma_{1}^{\prime}+\Gamma_{2}^{\prime}-\Gamma_{2}-\Gamma_{1}$ is a quadrilateral and encloses a domain $T^{\prime}$ in $T$ that is on the right hand side of $\Gamma_{1}+\Gamma_{2}.$ Then, by (11.13), replacing the the domain $T$ in the proof of Lemma 11.2 by $T^{\prime}$ and repeating the extension arguments, we can obtain a normal mapping $g:\overline{\Delta}\rightarrow S$ such that (11.14) $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)>A(f,\Delta),$ and the boundary curve $\Gamma_{g}$ of $g$ has the following permitted partition $\Gamma_{g}=\Gamma_{1}^{\prime}+\Gamma_{2}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n},$ which implies another permitted partition $\displaystyle\Gamma_{g}$ $\displaystyle=$ $\displaystyle\Gamma_{n}+\Gamma_{1}^{\prime}+\Gamma_{2}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n-1}.$ $\displaystyle=$ $\displaystyle\overline{q_{n}q_{1}}+\overline{q_{1}q_{1}^{\prime}}+\overline{q_{1}^{\prime}q_{2}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{n-1}q_{n}}.$ But here the terminal point $q_{1}^{\prime}$ of $\Gamma_{1}^{\prime}$, which is the initial point of $\Gamma_{2}^{\prime},$ is in $E,$ and so we have $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)=V_{E}(f)+1\ \mathrm{and\ }V(g)\leq V(f).$ Now, there are four cases need to discuss. Case 1. Neither $\Gamma_{n}+\Gamma_{1}^{\prime}=\overline{q_{n}q_{1}q_{1}^{\prime}}\ $nor $\Gamma_{2}^{\prime}+\Gamma_{3}=\overline{q_{1}^{\prime}q_{2}q_{3}}\ $is a natural edge of $\Gamma_{g}.$ Case 2. $\overline{q_{n}q_{1}q_{1}^{\prime}}$ is a natural edge of $\Gamma_{g},$ while $\overline{q_{1}^{\prime}q_{2}q_{3}}$ is not. Case 3. $\overline{q_{n}q_{1}q_{1}^{\prime}}$ is a natural edge of $\Gamma_{g}$, while $\overline{q_{1}^{\prime}q_{2}q_{3}}\ $is not. Case 4. Both $\overline{q_{n}q_{1}q_{1}^{\prime}}\ $and $\overline{q_{1}^{\prime}q_{2}q_{3}}\ $are natural edges of $\Gamma_{g}.$ In Case 1, (11) is a natural partition, and $g$ is the desired mapping. In Case 2, $g$ has the natural partition $\Gamma_{g}=\Gamma_{1}^{\prime\prime}+\Gamma_{2}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n-1},$ where $\Gamma_{1}^{\prime\prime}=\Gamma_{n}+\Gamma_{1}^{\prime}=\overline{q_{n}q_{1}q_{1}^{\prime}},$ and it is clear that (11.16) $V_{NE}(g)=V_{NE}(f)-2,V_{E}(g)=V_{E}(f)+1\ \mathrm{and\ }V(g)=V(f)-1.$ and by (I) and (11.13) $L(\Gamma_{1}^{\prime\prime})<2\pi.$ If $L(\Gamma_{1}^{\prime\prime})<\pi,$ then $g$ is the desired mapping with (11.16). If $\pi\leq L(\Gamma_{1}^{\prime\prime})<2\pi,$ then by (I) and Theorem 8.1 (a) (note that $q_{1}^{\prime}\in E$ is the terminal point of $\Gamma_{1}^{\prime\prime})$, there exists a normal mapping $g_{1}:\overline{\Delta}\rightarrow S$ such that $L(g_{1},\partial\Delta)\leq L(g,\partial\Delta),A(g_{1},\Delta)\geq A(g,\Delta),$ each natural edge of $g_{1}$ has spherical length strictly less than $\pi,$ and $V_{NE}(g_{1})\leq V_{NE}(g),\mathrm{\ }V_{E}(g_{1})\geq V_{E}(g)+1\ \mathrm{and\ }V(f_{1})\leq V(g)+1.$ Then, by (11.14) and (11.16), $g_{1}$ satisfies all the desired conclusions in Lemma 11.3 with $V_{NE}(f_{1})\leq V_{NE}(f)-2,\mathrm{\ }V_{E}(f_{1})\geq V_{E}(f)+2\ \mathrm{and\ }V(f_{1})\leq V(f).$ Case $3$ can be treated as Case $2.$ In case $4$ we have (11.17) $V_{NE}(g)=V_{NE}(f)-3,V_{E}(g)=V_{E}(f)+1\ \mathrm{and\ }V(g)\leq V(f)-3$ and $g$ has a natural partition (11.18) $\Gamma_{g}=\Gamma_{1}^{\prime\prime}+\Gamma_{2}^{\prime\prime}+\Gamma_{4}+\dots+\Gamma_{n-1},$ where $\Gamma_{1}^{\prime\prime}=\Gamma_{n}+\Gamma_{1}^{\prime}=\overline{q_{n}q_{1}q_{1}^{\prime}}\ $and $\Gamma_{2}^{\prime\prime}=\Gamma_{2}^{\prime}+\Gamma_{3}=\overline{q_{1}^{\prime}q_{2}q_{3}}.$ By (11.13) and (I), we have (11.19) $L(\Gamma_{1}^{\prime\prime})<2\pi,L(\Gamma_{2}^{\prime\prime})<2\pi.$ If (11.20) $L(\Gamma_{1}^{\prime\prime})<\pi,L(\Gamma_{2}^{\prime\prime})<\pi,$ then by (I), (11.14), (11.17) and (11.18), $g$ is the desired mapping. If (11.20) does not hold, then by (I), (11.18), (11.19) and the fact that both $\Gamma_{1}^{\prime\prime}$ and $\Gamma_{2}^{\prime\prime}$ have endpoints in $E,$ Theorem 8.1 (a) or (c) applies to $g$, and then, there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $L(f_{1},\partial\Delta)\leq L(g,\partial\Delta),A(f_{1},\Delta)\geq A(g,\Delta),$ each natural edge of $f_{1}$ has spherical length strictly less than $\pi,$ and $V_{NE}(f_{1})\leq V_{NE}(g_{1}),\mathrm{\ }V_{E}(f_{1})\geq V_{E}(g)+1,\ \mathrm{and\ }V(f_{1})\leq V(g)+2.$ Then $f_{1}$ satisfies all the desired conclusions of Lemma 11.3 with (by (11.17)) $V_{NE}(f_{1})\leq V_{NE}(f)-3,\mathrm{\ }V_{E}(f_{1})\geq V_{E}(f)\ \mathrm{and}\ V(f_{1})\leq V(f)-1.$ This completes the proof. ∎ ###### Lemma 11.4. In Case D, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)>A(f,\Delta),$ each natural edge of $\Gamma_{g}$ has spherical length strictly less than $\pi,$ and $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)\geq V_{E}(f)+1\ \mathrm{and\ }V(g)\leq V(f)+1.$ ###### Proof. In Case D, $q_{1}^{\prime}\in T$ and $q_{2}^{\prime}\in T$ are the only points in $\overline{T}\cap E.$ Let $L$ be the line segment in $\overline{T}$ that passes through $q_{1}^{\prime}$ and $q_{2}^{\prime}$ and has endpoints in $\partial T.$ Then there are two cases: Case 1. $L$ intersects $\overline{q_{1}q_{3}}$. Case 2. $L$ does not intersect $\overline{q_{1}q_{3}}$. Assume Case 1 occurs and, without loss of generality, assume $q_{2}^{\prime}$ is closer to $\overline{q_{1}q_{3}}$ than $q_{1}^{\prime}.$ Let $\Gamma_{1}^{\prime}=\overline{q_{1}q_{1}^{\prime}}$ and $\Gamma_{2}^{\prime}=\overline{q_{1}^{\prime}q_{2}}$ (a)). Then $\Gamma_{1}^{\prime}$ and $\Gamma_{2}^{\prime}$ satisfy all the conditions in the proof of Lemma 11.3, and in this case, we can prove Lemma 11.4 by exactly repeating the proof of Lemma 11.3. Assume Case 2 occurs. Then one endpoint $q_{1}^{\prime\prime}$ of $L$ is in the interior of $\Gamma_{1}$ and the other endpoint $q_{2}^{\prime\prime}$ of $L$ is in the interior of $\Gamma_{2}.$ Without loss of generality, assume $q_{1}^{\prime\prime},q_{1}^{\prime},q_{2}^{\prime}$ and $q_{2}^{\prime\prime}$ are arranged in order on $L.$ Let $\Gamma_{1}^{\prime}=\overline{q_{1}q_{1}^{\prime}},\Gamma^{\prime\prime}=\overline{q_{1}^{\prime}q_{2}^{\prime}}$ and $\Gamma_{2}^{\prime}=\overline{q_{2}^{\prime}q_{3}}$. Then, considering that $T$ is on the left hand side of the convex triangle $\overline{q_{1}q_{3}q_{2}q_{1}},$ we have that $L(\Gamma_{1}^{\prime})<\pi,L(\Gamma^{\prime\prime})=\frac{\pi}{2},L(\Gamma_{2}^{\prime})<\pi,$ $L(\Gamma_{1}^{\prime}+\Gamma^{\prime\prime}+\Gamma_{2}^{\prime})<L(\Gamma_{1}+\Gamma_{2});$ and the domain $T$ enclosed by $\Gamma_{1}^{\prime}+\Gamma^{\prime\prime}+\Gamma_{2}^{\prime}-\Gamma_{2}-\Gamma_{1}$ is a polygonal Jordan domain on the right hand side of $\Gamma_{1}+\Gamma_{2}$ with $\overline{T}\cap E=\\{q_{1},q_{2}\\}.$ Then by Lemma 3.2 and the extension arguments, there exists a normal mapping $g:\overline{\Delta}\rightarrow S$ such that $L(g,\partial\Delta)<L(f,\partial\Delta)\text{{\ and }}A(g,\Delta)>A(f,\Delta).$ and $\Gamma_{g}$ has a permitted partition $\Gamma_{g}=\Gamma_{1}^{\prime}+\Gamma^{\prime\prime}+\Gamma_{2}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n},$ which implies the following permitted partition $\displaystyle\Gamma_{g}$ $\displaystyle=$ $\displaystyle\Gamma_{n}+\Gamma_{1}^{\prime}+\Gamma^{\prime\prime}+\Gamma_{2}^{\prime}+\Gamma_{3}+\dots+\Gamma_{n-1}$ $\displaystyle=$ $\displaystyle\overline{q_{n}q_{1}}+\overline{q_{1}q_{1}^{\prime}}+\overline{q_{1}^{\prime}q_{2}^{\prime}}+\overline{q_{2}^{\prime}q_{3}}+\overline{q_{2}q_{3}}+\dots+\overline{q_{n-1}q_{n}}.$ Since $q_{1}^{\prime},q_{2}^{\prime}\in E,$ it is clear that $V_{NE}(g)\leq V_{NE}(f)-1,V_{E}(g)\geq V_{E}(f)+2\ \mathrm{and\ }V(g)\leq V(f)+1.$ Now, there are four cases: Case 2.1. None of $\Gamma_{n}+\Gamma_{1}^{\prime}=\overline{q_{n}q_{1}q_{1}^{\prime}}$ and $\Gamma^{\prime\prime}+\Gamma_{2}^{\prime}=\overline{q_{1}^{\prime}q_{2}^{\prime}q_{3}}$ is a natural edge of $\Gamma_{g}.$ Case 2.2. $\overline{q_{n}q_{1}q_{1}^{\prime}}\ $is a natural edge of $\Gamma_{g},$ while $\overline{q_{1}^{\prime}q_{2}^{\prime}q_{3}}\ $is not. Case 2.3. $\overline{q_{n}q_{1}q_{1}^{\prime}}$ is not a natural edge of $\Gamma_{g},$ while $\overline{q_{1}^{\prime}q_{2}^{\prime}q_{3}}\ $is. Case 2.4. Both $\overline{q_{n}q_{1}q_{1}^{\prime}}$ and $\overline{q_{1}^{\prime}q_{2}^{\prime}q_{3}}$ are natural edges of $\Gamma_{g}.$ The discussion for these cases is almost the same as that for the four Cases 1–4 in the proof of Lemma 11.3, just with a little difference which leads to that the desired mapping may has a number of $V(f)+1$ natural edges. ∎ ## 12\. Decomposition and deformation of Riemann surfaces of normal mappings In this section, we prove the following theorem, which is the first key step to prove the main theorem in Section 14. ###### Theorem 12.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that each natural edge of $f$ has spherical length strictly less than $\pi$. Then, there exist a finite number of normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,\dots m,$ with $m\geq 1,$ such that $\sum_{j=1}^{m}L(f_{j},\partial\Delta)\leq L(f,\partial\Delta),\sum_{j=1}^{m}A(f_{j},\Delta)\geq A(f,\Delta),$ and for each $j\leq m$ the followings hold. (i) Each natural edge of $f_{j}$ has spherical length strictly less than $\pi$. (ii) The boundary curve $\Gamma_{f_{j}}=f_{j}(z),z\in\partial\Delta$, is locally convex in $S\backslash E,$ where $E=\\{0,1,\infty\\}.$ (iii) $f_{j}$ has no branched point in $S\backslash E.$ We first prove several lemmas before we prove this theorem. ###### Lemma 12.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that each natural edge of $\Gamma_{f}=f(z),z\in\partial\Delta,$ has spherical length strictly less than $\pi.$ Then $V(f)\geq 3,$ and if in addition $V_{NE}(f)=0,$ then $V(f)\geq 4.$ ###### Proof. If $V(f)=1$, then $\Gamma_{f}$ itself is a natural edge that is a straight and closed curve in $S$, and $L(f,\partial\Delta)<\pi.$ This is impossible. Assume $V(f)=2$ and $\Gamma_{f}=\Gamma_{1}+\Gamma_{2}$ is a natural partition. Since $\Gamma_{f}$ is a closed curve, $L(\Gamma_{j})<\pi$ and $\Gamma_{j}$ is straight, $j=1,2$, we have $\Gamma_{1}=-\Gamma_{2}$ (ignoring a transformation of parameter) with $L(\Gamma_{1})=L(\Gamma_{2})<\pi.$ Then, $S\backslash\Gamma_{f}$ contains at least one point in $E=\\{0,1,\infty\\}.$ Considering that $f$ is normal, we conclude that $f(\Delta)\supset S\backslash\Gamma_{f}$ contains at least one point of $E,$ which contradicts the assumption that $f$ is normal. Thus, $V(f)\geq 3.$ If in addition $V_{NE}(f)=0,$ then by the assumption, each natural edge of $\Gamma_{f}$ must be $\overline{0,1},\overline{1,0},\overline{1,\infty}$ or $\overline{\infty,1},$ and then since $\Gamma_{f}$ is a closed curve and $V(f)\geq 3$, we have $V(f)\geq 4.$ ∎ ###### Lemma 12.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and assume that the followings hold. (a) each natural edge of $\Gamma_{f}=f(z),z\in\partial\Delta,$ has spherical length strictly less than $\pi.$ (b) $V(f)=3.$ Then $f:\overline{\Delta}\rightarrow f(\overline{\Delta})$ is a homeomorphism and $\Gamma_{f}$ is a generic convex triangle. ###### Proof. Let $\alpha=\alpha_{1}+\alpha_{2}+\alpha_{2}$ be a natural partition of $\partial\Delta$ for $f$ and let $\Gamma_{f}=\overline{q_{1}q_{2}}+\overline{q_{2}q_{3}}+\overline{q_{3}q_{1}}$ be the corresponding natural partition of $\Gamma_{f}=f(z),z\in\partial\Delta.$ Then by (a), $f$ restricted to each $\alpha_{j}$ is a homeomorphism onto $\Gamma_{j}=\overline{q_{j}q_{j+1}},$ where $q_{4}=q_{1}.$ We first show that $\overline{q_{1}q_{2}q_{3}}$ can not be contained in any great circle of $S.$ Otherwise, by (a) and the definition of natural edges, either $q_{3}\in\overline{q_{1}q_{2}}^{\circ}$ or $q_{1}\in\overline{q_{2}q_{3}}^{\circ},\ $where $\overline{q_{1}q_{2}}^{\circ}$ denotes the interior of $\overline{q_{1}q_{2}}.$ But in the first case, $q_{3}$ is not a natural vertex of $\Gamma_{f}$ and in the second case, $q_{1}$ is not a natural vertex of $\Gamma_{f}.$ Thus $\overline{q_{1}q_{2}q_{3}}$ is not contained in any great circle of $S.$ Then $\Gamma_{f}$ must be a triangle that is contained in some open hemisphere $S^{\prime}$ of $S$ and $f$ maps $\partial\Delta$ homeomorphically onto $\Gamma_{f}\ $and then, since $f$ is normal, $f:\overline{\Delta}\rightarrow\overline{T}$ is a homeomorphism, where $T$ is the domain inside $\Gamma_{f}.$ Since $f$ is normal, we also have $f(\Delta)\cap E=\emptyset.$ Thus, $\overline{T}\subset S^{\prime}$ and then $\Gamma_{f}$ is a generic convex triangle. ∎ ###### Lemma 12.3. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping such that each natural edge of $f$ has spherical length strictly less than $\pi$. If $V_{NE}(f)=0,\ $then $L(f,\partial\Delta)\geq 2\pi,$ and if $V_{NE}(f)=1,$ then $L(f,\partial\Delta)\geq\pi.$ ###### Proof. If $V_{NE}(f)=0,$ then by Lemma 12.1, $V(f)\geq 4,$ and in this case each natural edge of $\Gamma_{f}=f(z),z\in\partial\Delta,$ has spherical length $\frac{\pi}{2},$ and then $L(f,\partial\Delta)\geq 2\pi$. If $V_{NE}(f)=1,$ then by Lemma 12.1, $V(f)\geq 3,$ and then $f(\partial\Delta)$ contains at least two point of $E;$ and since $\Gamma_{f}$ is closed, we have $L(f,\partial\Delta)\geq\pi.$ ∎ ###### Lemma 12.4. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping and let $p_{0}$ be a ramification point of $f$. Assume $\beta=\overline{q_{0}q_{1}}\subset S$ satisfies the followings. (a) $q_{0}=f(p_{0})$ and $q_{1}\in E=\\{0,1,\infty\\}$. (b) The interior $\beta^{\circ}$ of $\beta$ has a neighborhood $N$ in $S$ such that $N$ is a polygonal Jordan domain and $f$ has no branched point in $N$. (c) The boundary curve $\Gamma_{f}=\Gamma_{f}(z),z\in\partial\Delta,$ has no natural vertex in $N.$ (d) Either (12.1) $f(\partial\Delta)\cap N=\emptyset,$ or (12.2) $p_{0}\in\partial\Delta\ \mathrm{and}\ f(\partial\Delta)\cap N=\beta^{\circ}.$ Then there exist normal mappings $g_{1},g_{2}:\overline{\Delta}\rightarrow S,$ such that the followings hold. (i) Each natural edge of $\Gamma g_{j}$ is a natural edge of $\Gamma_{f},j=1,2,$ and each natural edge of $\Gamma_{f}$ is a natural edge of either $g_{1}$ or $g_{2}$. (ii) $L(g_{1},\Delta)+L(g_{2},\Delta)=L(f,\Delta)$ and $A(g_{1},\Delta)+A(g_{2},\Delta)=A(f,\Delta).$ (iii) $V_{NE}(g_{1})+V_{NE}(g_{2})=V_{NE}(f),V_{E}(g_{1})+V_{E}(g_{2})=V_{E}(f),$ $V(g_{1})+V(g_{2})=V(f).$ ###### Proof. By Lemma 3.3 or Corollary 3.1, there exist a point $q_{2}$ in $\beta^{\circ}$ such that the section $\overline{q_{0}q_{2}}$ of $\beta=\overline{q_{0}q_{1}}$ has a lift $\gamma\subset\overline{\Delta}$ from $p_{0}$ to some point $p_{2}\in\Delta$ with $\gamma\backslash\\{p_{0}\\}\subset\Delta.$ Let $q^{\ast}\in\beta$ be the closest point to $q_{1}$ in $\beta$ such that the section $\overline{q_{0}q^{\ast}}$ has a lift $\alpha_{2}$ that is an extension of the lift $\gamma$ and that $\alpha_{2}^{\circ}\subset\Delta.$ We show that $q^{\ast}=q_{1}.$ Let $p^{\ast}$ be the terminal point of $\alpha_{2}$. Assume $q^{\ast}\neq q_{1},$ i.e. $q^{\ast}\in\beta^{\circ}.$ If $p^{\ast}\in\Delta,$ then by (b) and Lemma 3.3, $\alpha_{2}$ can be extended past $p^{\ast}$ to be a longer lift so that the extended part is still in $\Delta$, which contradicts the definition of $p^{\ast}$ and $q^{\ast}.$ Thus, we have $p^{\ast}\in\partial\Delta.$ Then by (c) and the definition of natural vertices there is a neighborhood $A_{p^{\ast}}$ of $p^{\ast}$ in $\partial\Delta,$ such that $f$ restricted to $A_{p^{\ast}}\ $is a homeomorphism onto a section of $\beta^{\circ}.$ On the other hand, by (b), (c) and Lemma 3.3, there is a neighborhood $U_{p^{\ast}}$ of $p^{\ast}$ in $\overline{\Delta}$ such that $f$ restricted to $U_{p^{\ast}}$ is a homeomorphism onto $f(U_{p^{\ast}})$ with $f(U_{p^{\ast}})\subset N$ and $f(U_{p^{\ast}})$ is a half-disc whose boundary diameter is contained in $\beta^{\circ}\cap f(U_{p^{\ast}})$. Thus, by (d), $U_{p^{\ast}}\cap\partial\Delta=U_{p^{\ast}}\cap f^{-1}([0,+\infty]),$ and then $\alpha_{2}\cap U_{p^{\ast}}\subset U_{p^{\ast}}\cap\partial\Delta.$ This is a contradiction, since $\alpha_{2}^{\circ}\subset\Delta.$ Thus we have proved that $\alpha_{2}$ is a lift of the whole path $\beta$ with $\alpha_{2}^{\circ}\subset\Delta.$ Since $p_{0}$ is a ramification point, in case $p_{0}\in\Delta$, by Lemma 3.3, $\beta$ has another lift $\alpha_{1}$ starting from $p_{0}$ such that $\alpha_{1}^{\circ}\subset\Delta.$ Since $f(\Delta)\cap E=\emptyset\ $and the terminal point $q_{1}$ of $\beta$ is in $E,$ the terminal points of $\alpha_{1}$ and $\alpha_{2}$ must land on $\partial\Delta,$ and by Lemma 3.5, these terminal points are distinct each other. Thus, $f,\alpha_{1},\alpha_{2}$ and $\beta$ satisfy all assumptions of Corollary 10.1, and then the desired $g_{1}$ and $g_{2}$ follow. In case (12.2), by (c) there is a section $\alpha_{1}$ of $\partial\Delta$ starting from $p_{0}$ so that $\alpha_{1}$ is a lift of $\beta,$ and by Lemma 3.5, the terminal points of $\alpha_{1}$ and $\alpha_{2}$ are also distinct. Then, $f,\alpha_{1},\alpha_{2}$ and $\beta$ satisfy all assumptions of Corollary 10.2, and then the desired $g_{1}$ and $g_{2}$ follow as well. This completes the proof of the lemma. ∎ Now, we can prove Theorem 12.1 in some special cases. ###### Lemma 12.5. Theorem 12.1 holds true if $V_{NE}(f)=0$ or $V_{NE}(f)=1.$ ###### Proof. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that satisfies the assumption of Theorem 12.1 and $V_{NE}(f)=0$ or $V_{NE}(f)=1.$ If $\Gamma_{f}$ is locally convex in $S\backslash E$ and $f$ has no branched point in $S\backslash E,$ then $f$ itself satisfies the conclusion of Theorem 12.1, and there is nothing to proof. If $\Gamma_{f}$ is not locally convex in $S\backslash E,$ then $V_{NE}(f)=1$ and by Theorem 11.1, there exists a normal mapping $g:\overline{\Delta}\rightarrow S,$ such that each natural edge of $g$ has spherical length strictly less than $\pi,$ $L(g,\partial\Delta)\leq L(f,\partial\Delta),A(g,\Delta)\geq A(f,\Delta),$ and $V_{NE}(g)\leq V_{NE}(f)-1=0.$ and then $V_{NE}(g)=0,$ and in this case $\Gamma_{g}$ is locally convex in $S\backslash E.$ If Theorem 12.1 holds for $g,$ then it is clear that Theorem 12.1 holds for $f.$ Thus we may assume that (a) $\Gamma_{f}$ is locally convex in $S\backslash E.$ If $f$ has no branched point in $S\backslash E,$ then there is nothing to prove again. Thus, we may complete the proof under the assumption that (b) $\Gamma_{f}$ is locally convex in $S\backslash E$ and $f$ has a branched point in $S\backslash E.$ Let $p_{0}\in\overline{\Delta}\backslash f^{-1}(E)$ be a ramification point of $f$ and let $q_{0}=f(p_{0}).$ Since $V_{NE}(f)=0$ or $1,$ $\Gamma_{f}$ has at most one natural vertex $q^{\ast}$ outside $E.$ Then by (a), there is a shortest path $\beta=\overline{q_{0}q_{1}}$ from $q_{0}$ to some point $q_{1}\in E$ such that either $\beta\cap f(\partial\Delta)=\\{q_{1}\\}$ or $\beta\cap f(\partial\Delta)=\overline{q_{0}q_{1}}.$ The later case occurs if and only if $q_{0}\in\Gamma_{f}\backslash E.$ We may assume $f$ has no branched point in $\beta\backslash\\{q_{0},q_{1}\\},$ otherwise we take the branched point in the interior of $\beta$ that is closest to $q_{1}.$ Then $\beta^{\circ}$ has a neighborhood $N$ satisfying the hypothesis of Lemma 12.4, and then, by Lemma 12.4, there exist two normal mappings $f_{1},f_{2}:\overline{\Delta}\rightarrow S,$ satisfying the following two conditions. (c) Each natural edge of $f_{j}$ is a natural edge of $f,$ $j=1,2$, and each natural edge of $\Gamma_{f}$ is a natural edge of $f_{1}$ or $f_{2}.$ (d) $L(f,\partial\Delta)=L(f_{1},\partial\Delta)+L(f_{2},\partial\Delta)$ and $A(f,\Delta)=A(f_{1},\Delta)+A(f_{2},\Delta).$ By (c), we have (12.3) $n=V(f)=V(f_{1})+V(f_{2}).$ It is clear by (c) that if $V_{NE}(f)=0,$ then $V_{NE}(f_{1})=V_{NE}(f_{2})=0,$ and if $V_{NE}(f)=1,$ then the the unique natural vertex $q^{\ast}$ of $\Gamma_{f}$ outside $E$ can not be contained in both $\Gamma_{f_{1}}$ and $\Gamma_{f_{2}},$ but $q^{\ast}$ must be a convex natural vertex of $\Gamma_{f_{1}}$ or $\Gamma_{f_{2}}$ and both $f_{1}$ and $f_{2}$ satisfy the assumption of Theorem 12.1. Summarizing, we may assume (e) $V_{NE}(f_{1})=0,$ $V_{NE}(f_{2})=1,$ and $f_{1}$ and $f_{2}$ satisfy (a). On the other hand, by Lemma 12.1 and (e) we have (12.4) $V(f_{1})\geq 4\ \mathrm{and\ }V(f_{2})\geq 3.$ Thus, we have $n=V(f)\geq 7,$ and by (12.3) we have (12.5) $V(f_{1})\leq V(f)-3\ \mathrm{and\ }V(f_{2})\leq V(f)-3.$ We have in fact proved that under the assumption (b), $n\geq 7.$ Thus, Theorem 12.1 holds true in case (a) with $n\leq 6.$ From this and the above arguments for the existence of $f_{1}$ and $f_{2}$ satisfying (c), (d), (e) and (12.5) we can prove the theorem, under the assumption (a), by induction on $n=V(f)$. This completes the proof. ∎ ###### Proof of Theorem 12.1. We prove Theorem 12.1 by induction on the sum $V_{NE}(f)+V(f).$ By Lemma 12.1 we have $V(f)\geq 3,$ and then $V_{NE}+V(f)=3$ holds only in the case $V_{NE}=0,$ but by Lemma 12.1, $V_{NE}=0$ implies $V(f)\geq 4.$ Thus $V_{NE}(f)+V(f)\geq 4,$ and equality holds if and only if $V_{NE}(f)=0$ and $V(f)=4$, or $V_{NE}(f)=1$ and $V(f)=3.$ Thus, by Lemma 12.5, Theorem 12.1 holds true in the case $V_{NE}(f)+V(f)=4.$ Now, let $k>4$ be a positive integer and assume that we have proved Theorem 12.1 for the case $4\leq V_{NE}(f)+V(f)\leq k.$ Let $f$ be any normal mapping that satisfies the assumption of Theorem 12.1 with (12.6) $V_{NE}(f)+V(f)=k+1.$ We call this that $f$ is at the level $k+1,$ and will show that Theorem 12.1 holds true for $f.$ Then, there are only three cases need to be discussed. Case 1. The boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta$, is locally convex in $S\backslash E$ and $f$ has no branched point in $S\backslash E.$ Case 2. $\Gamma_{f}$ is not convex at some natural vertex $p_{1}\in\left(\partial\Delta\right)\backslash f^{-1}(E)$ of $f.$ Case 3. $\Gamma_{f}$ is locally convex in $S\backslash E,$ and $f$ has a branched point in $S\backslash E.$ If Case 1 occurs, then $f$ itself satisfies the conclusion of Theorem 12.1, and then there is nothing to proof. Discussion of Case 2. In this case, by Theorem 11.1 it is clear that there exists a normal mapping $f_{1}:\overline{\Delta}\rightarrow S,$ such that each natural edge of $f_{1}$ has spherical length strictly less than $\pi,$ (12.7) $L(f_{1},\partial\Delta)\leq L(f,\partial\Delta),A(f_{1},\Delta)\geq A(f,\Delta),$ and (12.8) $V_{NE}(f_{1})\leq V_{NE}(f)-1\text{{\ and\ }}V(f_{1})\leq V(f)+1.$ If one of the equalities of (12.8) fails, then by (12.6), $f_{1}$ is at the level of $k,$ and by the induction hypothesis, Theorem 12.1 holds for $f_{1}$ and by (12.7), Theorem 12.1 holds for $f.$ If both of the equalities in (12.8) hold true, then $f_{1}$ is still at the level of $k+1,$ but (12.9) $V_{NE}(f_{1})=V_{NE}(f)-1.$ Then, $f_{1}$ satisfies the assumption of Theorem 12.1, and then we return to Cases 1, 2, or 3. If Case 1 occurs for $f_{1},$ then Theorem 12.1 holds for $f_{1},$ and then Theorem 12.1 holds for $f$ by (12.7). If Case 2 occurs, then we can replace $f$ by $f_{1}$ and repeat the discussion of Case 2. By (12.9), we can not always return to Case 2 from Case 2. Thus, Repeating discussion for Case 2 finitely many times, we return to either Case 1 or Case 3. If we return to Case 1, the proof is completed, and if we return to Case 3, we continue the following discussion. Discussion of Case 3. By Theorem 10.1, there exist two normal mappings $g_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ such that the followings hold. (a1) Each natural edge of $g_{j}$ has spherical length strictly less than $\pi,j=1,2.$ (a2) $\sum_{j=1}^{2}L(g_{j},\partial\Delta)\leq L(f,\partial\Delta),\sum_{j=1}^{2}A(g_{j},\Delta)\geq A(f,\Delta)$. (a3) $V_{NE}(g_{1})+V_{NE}(g_{2})\leq V_{NE}(f)+2.$ (a4) $V(g_{1})+V(g_{2})\leq V(f)+2.$ By Lemma 12.1 and (a1), $V(g_{j})\geq 3,j=1,2,$ and so by (a4) we have (a5) $V(g_{j})\leq V(f)-1,j=1,2.$ Then there are only two cases: Case 2.1 $V_{NE}(g_{j})\geq 2,j=1,2.$ Case 2.2 $V_{NE}(g_{1})\leq V_{NE}(g_{2})$ and $V_{NE}(g_{1})=0$ or $1.$ Discussion of Case 2.1. In this case, by (a3) we have $V_{NE}(g_{j})\leq V_{NE}(f),$ and then by (a5) and (12.6) we have $V_{NE}(g_{j})+V(g_{j})\leq V_{NE}(f)+V(f)-1=k,j=1,2,$ i.e. both $g_{1}$ and $g_{2}$ are at level $\leq k.$ Then by (a1) and the induction hypothesis, Theorem 12.1 holds for $g_{1}$ and $g_{2},$ and then by (a2) and the induction hypothesis, Theorem 12.1 holds for $f.$ Discussion of Case 2.2. Assume (12.10) $V_{NE}(g_{1})=0\ \mathrm{or\ }1.$ Then by Lemma 12.3 (12.11) $L(g_{1},\partial\Delta)\geq\pi.$ We first show that (12.12) $V_{NE}(g_{2})+V(g_{2})\leq V_{NE}(f)+V(f)\leq k+1.$ If $V_{NE}(g_{1})=0,$ then by Lemma 12.1 we have $V(g_{1})\geq 4,$ and then by (a3) and (a4) we have (12.12). If $V_{NE}(g_{1})=1,$ then by (a3) and (a5) we still have (12.12) If $V_{NE}(g_{2})+V(g_{2})<k+1,$ then Theorem 12.1 holds for $g_{2}$ by the induction hypothesis; and on the other hand, by (12.10) and (a1), Theorem 12.1 holds for $g_{1}$; and therefore, by (a2) Theorem 12.1 holds for $f$. Now, we assume $V_{NE}(g_{2})+V(g_{2})=k+1,$ i.e., $g_{2}$ is in the level $k+1.$ Then we can return to Cases 1–3 and repeat the same discussion for $g_{2}.$ We can prove Theorem 12.1 by repeating the above arguments finitely many times, since by (12.11), Case 2.2 can not occur infinitely times. This completes the proof. ∎ ## 13\. Decomposition of fat mappings In this section we prove Theorem 13.1. This is the third key step to prove the main theorem in Section 14. A normal mapping $g:\overline{\Delta}\rightarrow S$ is called _fat_ if and only if $\Delta\backslash f^{-1}([0,+\infty])$ has a component $D$ such that $f:D\rightarrow S\backslash[0,+\infty]$ is a homeomorphism. By Corollary 7.1, if $g$ satisfies all assumptions of Theorem 7.1, then $g$ is fat if and only if $f(\partial D)\subset[0,+\infty].$ ###### Theorem 13.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that satisfies (a)–(d) of Theorem 7.1, that is, the following conditions (a)–(d) hold. (a) Each natural edge of the boundary curve $\Gamma_{f}=f(z),z\in\partial\Delta,$ has length strictly less than $\pi$. (b) $\Gamma_{f}=f(z),z\in\partial\Delta,$ is locally convex in $S\backslash E,E=\\{0,1,\infty\\}.$ (c) $f$ has no branched point in $S\backslash E.$ (d) $\Gamma_{f}\cap[0,+\infty]$ contains at most finitely many points. If $f$ is fat, then there exist two normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,2,$ such that $f_{1}$ and $f_{2}$ satisfy (a)–(d) and $A(f_{1},\Delta)+A(f_{2},\Delta)=A(f,\Delta)-4\pi,$ $L(f_{1},\partial\Delta)+L(f_{2},\partial\Delta)=L(f,\partial\Delta),$ $f_{1}$ maps $[-1,1]\subset\overline{\Delta}$ homeomorphically onto $\overline{0,1}\subset S$ and $f_{2}$ maps $[-1,1]$ homeomorphically onto $\overline{1,\infty}\subset S.$ The geometrical meaning of this theorem is that we can cut off the whole Riemann sphere $S,$ with $[0,+\infty]$ being removed, from the interior of the Riemann surface of $f$ and then sew up the cut edges along $[0,+\infty].$ Then we obtain two Riemann surfaces that are only joint at $1\in S,$ and the boundary curve of these two surfaces compose the boundary curve $\Gamma_{f}.$ ###### Proof. Let $\Delta_{1}$ be a component of $\Delta\backslash f^{-1}([0,+\infty])$ such that $f(\partial\Delta_{1})\subset[0,+\infty].$ Then by Corollary 7.1, $f|_{\overline{\Delta_{1}}}:\overline{\Delta_{1}}\rightarrow S$ is normal and surjective, $f(\partial\Delta_{1})=[0,+\infty]$ and $f$ restricted to $\Delta_{1}$ is a homeomorphism onto $S\backslash[0,+\infty]$. Then the restriction $f:\partial\Delta_{1}\rightarrow[0,+\infty]$ is a folded two to one mapping and we can express $\partial\Delta_{1}$ to be $\partial\Delta_{1}=\beta_{1}+\beta_{2}+\beta_{3}+\beta_{4}$ such that $f$ maps $\beta_{1},\beta_{2},\beta_{3},\beta_{4}$ homeomorphically onto $\overline{0,1},\overline{1,\infty},\overline{\infty,1},$ $\overline{1,0},$ respectively and $\beta_{1},\beta_{2},\beta_{3},\beta_{4}$ are arranged anticlockwise in $\partial\Delta_{1}.$ Denote by $p_{j}\ $the initial points of $\beta_{j},j=1,2,3,4.$ Then $f(p_{1})=0,f(p_{2})=f(p_{4})=1,f(p_{3})=\infty,$ which implies $p_{j}\in\partial\Delta,j=1,2,3,4,$ by the definition of normal mappings. We denote by $\alpha_{j}$ the section of $\partial\Delta$ from $p_{j}$ to $p_{j+1},j=1,2,3,4$ ($p_{5}=p_{1}).$ We first show that the interior of $\beta_{j}$ is contained in $\Delta$ for $j=1,2,3,4.$ Assume $\beta_{1}$ has an interior point $p_{0}$ with $p_{0}\in\partial\Delta.$ Then it is clear that $p_{0}$ is in the interior of $\alpha_{1}$ and $p_{0}\neq 0,1,\infty,$ and then, by (b) the section $\Gamma_{\alpha_{1}}=f(z),z\in\alpha_{1},$ of $\Gamma_{f}$ is convex at $p_{0},$ and by (c), $f$ is regular at $p_{0}.$ On the other hand, $\Gamma_{\beta_{1}}=f(z),z\in-\beta_{1},$ which is the simple path $\overline{1,0},$ is obviously convex by the definition. Therefore, Lemma 6.3 applies to $p_{0},\alpha_{1},-\beta_{1}$ and $f$, and then $\alpha_{1}$ has a neighborhood contained in $\beta_{1}.$ This contradicts (d), for $\alpha_{1}\subset\partial\Delta$ and $\beta_{1}=\overline{0,1}\subset[0,+\infty].$ Thus the interior of $\beta_{1}$ is contained in $\Delta.$ For the same reason, the interiors of $\beta_{2},\beta_{3}$ and $\beta_{4}$ are all contained in $\Delta$ . We have proved that $\Delta\backslash\Delta_{1}$ contains four disjoint Jordan domains $D_{j}$ enclosed by $\alpha_{j}-\beta_{j}$ with $\overline{D_{j}}\cap\overline{D_{j+1}}=\\{p_{j+1}\\},j=1,2,3,4$ ($D_{5}=D_{1}$ and $p_{5}=p_{1}).$ Now, we glue $\overline{D_{1}}$ and $\overline{D_{4}}$ along $\beta_{1}$ and $-\beta_{4}$ so that $x\in\beta_{1}$ and $y\in-\beta_{4}$ are identified if and only if $f(x)=f(y).$ The glued closed domain can be understood to be the unit disk $\overline{\Delta}$ so that $\beta_{1}$ and $-\beta_{4}$ both become the diameter $[-1,1]$ of $\overline{\Delta}.$ In this way we have in fact glued the restrictions $f|_{\overline{D_{1}}}$ and $f|_{\overline{D_{4}}}$ to be a normal mapping $f_{1}:\overline{\Delta}\rightarrow S$ such that $f_{1}$ maps $[-1,1]\subset\overline{\Delta}$ homeomorphically onto $\overline{0,1}\subset S.$ Similarly, we can glue the restrictions $f|_{\overline{D_{2}}}$ and $f|_{\overline{D_{3}}}$ to be a normal mapping $f_{2}:\overline{\Delta}\rightarrow S$ such that $f_{2}$ maps $[-1,1]$ homeomorphically onto $\overline{1,\infty}.$ It is clear that $f_{1}$ and $f_{2}$ satisfies all the conclusions of the Theorem. As a matter of fact, the above process just cut off $f(\Delta_{1}),$ the sphere $S$ with $[0,+\infty]$ being removed, from the interior of the Riemann surface of $f$ and then sew up the cut edges along $[0,+\infty].$ Then we obtain two Riemann surfaces that are only joint at $1\in S,$ and the boundary curve of these two surfaces compose the boundary curve $\Gamma_{f}.$ This completes the proof. ∎ ## 14\. Proof of the main theorem We first prove the main theorem under certain conditions. ###### Lemma 14.1. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that is not fat and satisfies (a)–(d) of Theorem 7.1. Then $A(f,\Delta)<2L(f,\partial\Delta),$ and $A(f,\Delta)<h_{0}L(f,\partial\Delta)-A(f,\Delta),$ where $h_{0}$ is given by (1.3). ###### Proof. The second inequality follows from the first one directly, for $h_{0}>4.$ So we only prove the first inequality. Since $f$ is not fat, for each component $D$ of $\Delta\backslash f^{-1}([0,+\infty]),$ $f(\partial D)\backslash[0,+\infty]\neq\emptyset,$ and so by (d) the interior $\alpha_{0}$ of $\left(\partial D\right)\cap(\partial\Delta)$ is not empty, and then by Theorem 7.1, $L(f,\left(\partial D\right)\cap(\partial\Delta))>L(f,(\partial D)\backslash\left(\partial\Delta\right)),$ $f(\overline{D})$ is contained in some hemisphere of $S,$ which implies $A(f(D))<2\pi,$ and $f$ restricted to $D$ is a homeomorphism. Then we have (14.1) $2L(f,\left(\partial D\right)\cap(\partial\Delta))>L(f,\left(\partial D\right)\cap(\partial\Delta))+L(f,(\partial D)\backslash\left(\partial\Delta\right))=L(f,\partial D).$ If $L(f,\partial D)\geq 2\pi,$ then we have $A(f,D)=A(f(D))<2\pi\leq L(f,\partial D),$ and if $L(f,\partial D)<2\pi,$ then by Theorem 4.3 we have $A(f,D)<L(f,\partial D),$ and then by (14.1), in both cases we have (14.2) $A(f,D)<2L(f,\left(\partial D\right)\cap(\partial\Delta)).$ By Theorem 7.1 it is clear that for any pair $D_{1}$ and $D_{2}$ of distinct components of $\Delta\backslash f^{-1}([0,+\infty]),$ $\left(\partial D_{1}\right)\cap(\partial\Delta)$ and $\left(\partial D_{2}\right)\cap(\partial\Delta)$ contains at most two common points, and on the other hand, by the same theorem, $\Delta\backslash f^{-1}([0,+\infty])$ contains only finitely many components. Thus, we have $L(f,\partial\Delta)=\sum_{D}L(f,\left(\partial D\right)\cap(\partial\Delta)),$ where the sum runs over all components $D$ of $\Delta\backslash f^{-1}([0,+\infty])$. Then, summing up (14.2), we have $A(f,\Delta)=\sum_{D}A(f,D)<2\sum_{D}L(f,(\partial D)\cap(\partial\Delta))=2L(f,\partial\Delta).$ This completes the proof. ∎ ###### Lemma 14.2. Let $f:\overline{\Delta}\rightarrow S$ be a normal mapping that is fat and satisfies (a)–(d) of Theorem 7.1. Then $A(f,\Delta)\leq h_{0}L(f,\partial\Delta)-4\pi.$ where $h_{0}$ is given by (1.3). ###### Proof. By Theorem 13.1, there exist normal mappings $g_{j}:\overline{\Delta}\rightarrow S,j=1,2,\dots,n+1,$ such that for each $j\leq n+1$ the followings hold. (e) Each $g_{j}$ satisfies all assumptions (a)–(d) of theorem 7.1, $j=1,2,\dots,n+1$. (f) Each $g_{j}$ is not fat, $j=1,2,\dots,n+1$. (g) $g_{j}$ maps the diameter $[-1,1]$ of $\overline{\Delta}$ homeomorphically onto the real interval $\overline{0,1}$ in $S$ or onto $\overline{1,\infty}$ in $S.$ (h) $A(f,\Delta)=4n\pi+\sum_{j=1}^{n+1}A(g_{j},\Delta),L(f,\partial\Delta)=\sum_{j=1}^{n+1}L(g_{j},\partial\Delta).$ Let $j$ be any positive integer with $j\leq n+1$ and consider the mapping $g_{j}.$ By (e) and (f), Lemma 14.1 applies. Then we have (14.3) $A(g_{j},\Delta)<2L(g_{j},\partial\Delta),$ and then $\displaystyle 4\pi+A(g_{j},\Delta)$ $\displaystyle<$ $\displaystyle 2L(g_{j},\partial\Delta)+4\pi$ $\displaystyle=$ $\displaystyle(2+\frac{4\pi}{L(g_{j},\partial\Delta)})L(g_{j},\partial\Delta),$ and, considering that $2+\frac{4\pi}{L(g_{j},\partial\Delta)}\leq 4$ in the case $L(g_{j},\partial\Delta)\geq 2\pi,$ we have (k) If $L(g_{j},\partial\Delta)\geq 2\pi,$ then $4\pi+A(g_{j},\Delta)<4L(g_{j},\partial\Delta).$ By Theorem 4.3, we have (l) If $\sqrt{2}\pi\leq L(g_{j},\partial\Delta)<2\pi,$ then $4\pi+A(g_{j},\Delta)<4L(g_{j},\partial\Delta).$ By (g) and Theorem 4.4, we have (m) If $L(g_{j},\partial\Delta)<\sqrt{2}\pi,$ then $4\pi+A(g_{j},\Delta)\leq h_{0}L(g_{j},\partial\Delta),$ where $h_{0}$ is given by (1.3). Summarizing (k)–(m) and the fact that $h_{0}>4$, we have in any case $4\pi+A(g_{j},\Delta)\leq h_{0}L(g_{j},\partial\Delta),j=1,\dots,n+1,$ and then by (h), we have $\displaystyle A(f,\Delta)$ $\displaystyle=$ $\displaystyle 4n\pi+\sum_{j=1}^{n+1}A(g_{j},\Delta)$ $\displaystyle=$ $\displaystyle\sum_{j=1}^{n+1}\left(4\pi+A(g_{j},\Delta)\right)-4\pi$ $\displaystyle\leq$ $\displaystyle h_{0}\sum_{j=1}^{n+1}L(g_{j},\partial\Delta)-4\pi$ $\displaystyle=$ $\displaystyle h_{0}L(f,\partial\Delta)-4\pi.$ This completes the proof. ∎ ###### Proof of the Main Theorem. Let $f:\overline{\Delta}\rightarrow S$ be any nonconstant holomorphic mapping such that $f(\Delta)\cap E=\emptyset.$ Then for any positive number (14.4) $\varepsilon<\frac{1}{4h_{0}}\min\\{4\pi,A(f,\Delta)\\},$ there exists a Jordan domain $D\subset\Delta$ such that $f$ restricted to $D$ is a normal mapping, (14.5) $A(f,D)\geq A(f,\Delta)-\varepsilon\mathrm{\ and\ }L(f,\partial D)<L(f,\Delta)+\varepsilon,$ and the following condition holds. (1) Each natural edge of the restricted mapping $f|_{\overline{D}}$ has spherical length strictly less than $\pi$. Let $h$ be a homeomorphism from $\overline{\Delta}$ onto $\overline{D}$ and let $F=f\circ h.$ Then by (1) $F:\overline{\Delta}\rightarrow S$ is a normal mapping satisfying the assumption of Theorem 12.1 with $A(F,\Delta)=A(f,D)\ $and $L(F,\partial\Delta)=L(f,\partial D).$ Then by (14.5) we have that (14.6) $A(F,\Delta)\geq A(f,\Delta)-\varepsilon\ \mathrm{and}\ L(F,\partial\Delta)<L(f,\Delta)+\varepsilon;$ and by Theorem 12.1 there exist a number of $m$ normal mappings $f_{j}:\overline{\Delta}\rightarrow S,j=1,\dots m,$ such that (14.7) $\sum_{j=1}^{m}A(f_{j},\Delta)\geq A(F,\Delta)\ \mathrm{and\ }\sum_{j=1}^{m}L(f_{j},\partial\Delta)\leq L(F,\partial\Delta),$ and for each $j$ the followings hold. (A) Each natural edge of the boundary curve $\Gamma_{f_{j}}=f_{j}(z),z\in\partial\Delta$, has spherical length strictly less than $\pi$. (B) $\Gamma_{f_{j}}=f_{j}(z),z\in\partial\Delta$, is locally convex in $S\backslash E.$ (C) $f_{j}$ has no branched point in $S\backslash E.$ Then, by Lemma 7.2, for the above $\varepsilon$ and each $j\leq m,$ there exists a normal mapping $g_{j}:\overline{\Delta}\rightarrow S$ such that (14.8) $A(g_{j},\Delta)\geq A(f_{j},\Delta),L(g_{j},\partial\Delta)<L(f_{j},\partial\Delta)+\frac{\varepsilon}{m},$ and $g_{j}$ satisfies (d) in Theorem 7.1 and (A)–(C), say, $g_{j}$ satisfies all hypotheses of Theorem 7.1. Then by Lemmas 14.1 and 14.2 we have (14.9) $A(g_{j},\Delta)\leq h_{0}L(g_{j},\partial\Delta)-\min\\{A(g_{j},\Delta),4\pi\\},j=1,\dots,m.$ On the other hand, if for some $j_{0}\leq m,$ $A(g_{j_{0}},\Delta)\geq 4\pi,$ then we have $\sum_{j=1}^{m}\min\\{A(g_{j},\Delta),4\pi\\}\geq 4\pi,$ and if $A(g_{j},\Delta)<4\pi$ for all $j\leq m,$ then we have, by (14.8), (14.7), (14.6) and (14.4), that $\displaystyle\sum_{j=1}^{m}\min\\{A(g_{j},\Delta),4\pi\\}$ $\displaystyle=$ $\displaystyle\sum_{j=1}^{m}A(g_{j},\Delta)\geq\sum_{j=1}^{m}A(f_{j},\Delta)\geq A(F,\Delta)$ $\displaystyle>$ $\displaystyle A(f,\Delta)-\varepsilon>\frac{4h_{0}-1}{4h_{0}}A(f,\Delta);$ and thus, in both cases, we have (14.10) $\sum_{j=1}^{m}\min\\{A(g_{j},\Delta),4\pi\\}\geq\min\\{\frac{4h_{0}-1}{4h_{0}}A(f,\Delta),4\pi\\}.$ Summing up the inequalities of (14.9), by (14.10) we have $\displaystyle\sum_{j=1}^{m}A(g_{j},\Delta)$ $\displaystyle\leq$ $\displaystyle\sum_{j=1}^{m}h_{0}L(g_{j},\partial\Delta)-\sum_{j=1}^{m}\min\\{A(g_{j},\Delta),4\pi\\}$ $\displaystyle\leq$ $\displaystyle\sum_{j=1}^{m}h_{0}L(g_{j},\partial\Delta)-\min\\{\frac{4h_{0}-1}{4h_{0}}A(f,\Delta),4\pi\\}.$ By (14.8), (14.7) and (14.6) we have $\displaystyle\sum_{j=1}^{m}h_{0}L(g_{j},\partial\Delta)$ $\displaystyle<$ $\displaystyle\sum_{j=1}^{m}h_{0}L(f_{j},\partial\Delta)+\varepsilon h_{0}\leq h_{0}L(F,\partial\Delta)+\varepsilon h_{0}$ $\displaystyle<$ $\displaystyle h_{0}L(f,\Delta)+2\varepsilon h_{0},$ i.e. (14.12) $\sum_{j=1}^{m}h_{0}L(g_{j},\partial\Delta)<h_{0}L(f,\Delta)+2\varepsilon h_{0}.$ By (14.6)–(14.8) we have (14.13) $A(f,\Delta)\leq\sum_{j=1}^{m}A(g_{j},\Delta)+\varepsilon.$ Therefore, we have by (14)–(14.13) $\displaystyle A(f,\Delta)$ $\displaystyle\leq$ $\displaystyle\sum_{j=1}^{m}A(g_{j},\Delta)+\varepsilon$ $\displaystyle\leq$ $\displaystyle\sum_{j=1}^{m}h_{0}L(g_{j},\partial\Delta)-\min\\{\frac{4h_{0}-1}{4h_{0}}A(f,\Delta),4\pi\\}$ $\displaystyle<$ $\displaystyle h_{0}L(f,\Delta)+2\varepsilon h_{0}+\varepsilon-\min\\{\frac{4h_{0}-1}{4h_{0}}A(f,\Delta),4\pi\\}$ $\displaystyle\leq$ $\displaystyle h_{0}L(f,\Delta)+\frac{2h_{0}+1}{4h_{0}}\min\\{A(f,\Delta),4\pi\\}-\min\\{\frac{4h_{0}-1}{4h_{0}}A(f,\Delta),4\pi\\},$ and considering that $h_{0}>4,$ we have $A(f,\Delta)<h_{0}L(f,\Delta).$ It remains to show that the lower is sharp. We give an example to show that $h_{0}$ given by (1.3) is a sharp lower bound of the constant $h$ in (1.1). As in Section 1, we denote by $D$ the spherical disk in $S$ with diameter $\overline{1,\infty},$ the shortest path in $S$ from $1$ to $\infty,$ and for $l\in[\pi,\sqrt{2}\pi]$ denote by $D_{l}$ the domain contained in the disk $D$ such that the boundary $\partial D_{l}$ is composed of two congruent circular arcs, each of which has endpoints $\\{1,\infty\\}$ and spherical length $\frac{l}{2}$. Then, $l=L(\partial D_{l})$ and by (1.4) and (1.5), the number $h_{0}$ given by (1.3) is the maximum value of the function $\frac{4\pi+A(D_{l})}{l}$ and $h_{0}=\frac{4\pi+A(D_{l_{0}})}{l_{0}}$ for some $l_{0}\in(\pi,\sqrt{2}\pi)$. It is clear that $D_{l_{0}},$ regarded as a domain in $\mathbb{C},$ is an angular domain whose vertex is $1$ and bisector is the ray $[1,+\infty)$ in $\mathbb{C}$. We denote by $2\theta_{0}$ the value of the angle of this angular domain. Then it is clear that $\theta_{0}<\frac{\pi}{2}.$ Let $M_{1}$ be the angular domain in $\mathbb{C}$ defined by $M_{1}=\\{re^{i\theta};\ r>0,0<\theta<\frac{\theta_{0}}{m}\\}$ and let $\Sigma_{1}$ be the angular domain in $\mathbb{C}$ defined by $\Sigma_{1}=\\{1+re^{i\theta};\ 0<r<+\infty,-\theta_{0}<\theta<\pi\\}.$ Then it is easy to construct a homeomorphism $f_{0}$ from the closure $\overline{M_{1}}$ of $M_{1}$ in $\overline{\mathbb{C}}$ onto the closure $\overline{\Sigma_{1}}$ of $\Sigma_{1}$ in $\overline{\mathbb{C}},$ such that $f_{0}$ maps the ray $\arg z=\frac{\theta_{0}}{m}$ onto the ray $\arg z=\pi,$ maps the interval $[0,1]$ onto itself increasingly, maps the ray $[1,+\infty]$ onto the ray $z=1+re^{-i\theta_{0}},r\in[0,+\infty]$ and $f_{0}$ is holomorphic on $M_{1}.$ Let $M_{2}=e^{\frac{\theta_{0}}{m}}M_{1}=\\{e^{\frac{\theta_{0}}{m}}z;\ z\in M_{1}\\}.$ Then, by the Schwarz symmetry principle, we can extend $f_{0}$ to be an open and continuous mapping $f_{1}$ from the closed angular domain $A_{1}=\overline{M_{1}\cup M_{2}}=\\{z\in\overline{\mathbb{C}};0\leq\arg z\leq\frac{2\theta_{0}}{m}\\}$ onto $\overline{\mathbb{C}}$ such that $f_{1}\ $maps the segments $l_{k}=\left\\{re^{i\frac{k\theta_{0}}{m}},r\in[0,1]\right\\},k=0,1,$ homeomorphically onto the interval $[0,1],$ respectively; $f_{1}$ maps the segments $L_{k}=\left\\{re^{i\frac{k\theta_{0}}{m}},r\in[1,+\infty]\right\\},k=0,1,$ homeomorphically onto the segments $l^{-}=\left\\{1+re^{-i\theta_{0}},r\in[0,+\infty]\right\\}$ and $l^{+}=\left\\{1+re^{i\theta_{0}},r\in[0,+\infty]\right\\},$ respectively; and $f_{1}$ restricted to the domain $A_{1}$ is a holomorphic mapping that covers the domain $D_{l_{0}}$ two times and covers the domain $\mathbb{C}\backslash\overline{D_{l_{0}}}$ one times. Let $A_{1}^{\ast}=A_{1}^{\circ}\cup l_{0}^{\circ}\cup l_{1}^{\circ},$ where $A_{1}^{\circ}$ is the interior of $A_{1},$ and let $A_{k}^{\ast}=e^{i\frac{2\left(k-1\right)\theta_{0}}{m}}A_{1}^{\ast}=\\{e^{i\frac{2\left(k-1\right)\theta_{0}}{m}}z;z\in A_{1}^{\ast}\\},k=2,\dots,m.$ Then for each $k=1,\dots,m$ we can defined a continuous function $f_{k}$ on $A_{k}^{\ast}$ inductively: $f_{k+1}$ is obtained from $f_{k}$ by Schwarz symmetry principle cross the symmetry axis $l_{k}=\\{re^{i\frac{2k\theta_{0}}{m}},r\in[0,1]\\}.$ Let $H^{+}$ be the upper half plane $\mathrm{Im}z>0$ in $\mathbb{C}$ and let $K=H^{+}\backslash\cup_{k=1}^{m-1}\\{re^{i\frac{2k\theta_{0}}{m}},r\in[1,+\infty)\\}.$ Then $K=\left(\cup_{k=1}^{m}A_{k}^{\ast}\right)\backslash(l_{0}\cup l_{m})$ and $f_{1},\dots,f_{m}$ can be patched to be a holomorphic function $f$ defined on $K\cup(-\infty,+\infty)$, by the Schwarz symmetric principle. It is clear that $K$ is a simply connected domain and there is a conformal mapping $h$ from $\Delta$ onto $K$ such that $h$ can be extended to be a continuous function $\widetilde{h}$ such that when $z$ goes around $\partial\Delta$ once, $\widetilde{h}(z)$ describes the boundary section $(-\infty,+\infty)$ of $K$ once and the boundary sections $\\{re^{i\frac{k\theta_{0}}{m}},r\in[1,+\infty)\\}$ twice for $k=1,\dots,m-1.$ Let $g=f\circ\widetilde{h}.$ Then $g:\overline{\Delta}\rightarrow\overline{\mathbb{C}}$ is a continuous mapping that is holomorphic in $\Delta$ and when we regard $g$ as a mapping from $\overline{\Delta}$ to $S,$ $g$ restricted to $\Delta$ covers $S\backslash D_{l_{0}}$ by $m$ times and covers $D_{l_{0}}$ by $2m$ times and the boundary curve $\Gamma_{g}=g(z),z\in\partial\Delta,$ covers $\partial D_{l_{0}}$ by $m$ times and covers the shortest path $\overline{0,1}$ in $S$ from $0$ to $1$ by $2$ times. Then we have $A(g,\Delta)=4m\pi+mA(D_{l_{0}})$ and $L(g,\partial\Delta)=2L(\overline{0,1})+mL(\partial D_{l_{0}})=\pi+ml_{0},$ and then $\frac{A(g,\Delta)}{L(g,\partial\Delta)}=\frac{4m\pi+mA(D_{l_{0}})}{\pi+mL(\partial D_{l_{0}})}<\frac{4\pi+A(D_{l_{0}})}{l_{0}}=h_{0}.$ It is clear that as $m\rightarrow+\infty,$ $\frac{A(g,\Delta)}{L(g,\partial\Delta)}=\frac{4m\pi+mA(D_{l_{0}})}{\pi+mL(\partial D_{l_{0}})}$ converges to $h_{0}.$ This completes the proof. ∎ ## References * [1] L. Ahlfors, Zur Theorie der Üherlagerung-Sflächen, Acta Math., 65 (1935), 157-194. * [2] F. Bernstein, Über die isoperimetrische Eigenschaft des Kreises auf der Kugeloberfläche und in der Ebene, Math. Ann., vol. 60 (1905), pp. 117-136. * [3] J. Dufresnoy, Sur les. domaines couverts. parles valeurs d’une. fonction. méromorphe. ou. algébroide, Ann. Sci. École. Norm. Sup. 58. (1941),. 179-259. * [4] W.K. Hayman, Meromorphic functions, Oxford, 1964. * [5] T. Radó, The Isoperimetric Inequality on the Sphere, Amer. Jour. Math., Vol.57, No.4. (Oct.,1935), pp.765-770.
arxiv-papers
2009-03-20T07:50:13
2024-09-04T02:49:01.275296
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Guang Yuan Zhang", "submitter": "Guang Yuan Zhang", "url": "https://arxiv.org/abs/0903.3460" }
0903.3517
# Soliton stability and collapse in the discrete nonpolynomial Schrödinger equation with dipole-dipole interactions Goran Gligorić1, Aleksandra Maluckov2, Ljupčo Hadžievski1, and Boris A. Malomed3 1 Vinča Institute of Nuclear Sciences, P.O. Box 522,11001 Belgrade, Serbia 2 Faculty of Sciences and Mathematics, University of Niš, P.O. Box 224, 18001 Niš, Serbia 3 Department of Physical Electronics, School of Electrical Engineering, Faculty of Engineering, Tel Aviv University, Tel Aviv 69978, Israel ###### Abstract The stability and collapse of fundamental unstaggered bright solitons in the discrete Schrödinger equation with the nonpolynomial on-site nonlinearity, which models a nearly one-dimensional Bose-Einstein condensate trapped in a deep optical lattice, are studied in the presence of the long-range dipole- dipole (DD) interactions. The cases of both attractive and repulsive contact and DD interaction are considered. The results are summarized in the form of stability/collapse diagrams in the parametric space of the model, which demonstrate that the the attractive DD interactions stabilize the solitons and help to prevent the collapse. Mobility of the discrete solitons is briefly considered too. ###### pacs: 03.75.Lm; 05.45.Yv ## I Introduction It is well established that the mean-field description of Bose-Einstein condensates (BECs) trapped in a deep optical lattice can be reduced, starting from the one-dimensional (1D) Gross-Pitaevskii equation with the cubic nonlinearity, to the discrete nonlinear Schrödinger (DNLS) equation DNLS-BEC ; DNLS-BEC-review . However, while the DNLS equation with the cubic on-site nonlinearity readily predicts solitons Panos , it cannot describe the dynamical collapse, which is often observed experimentally in the self- attractive BEC Strecker02 , Cornish . In the general case, the reduction of the 3D Gross-Pitaevskii equation for the BEC trapped in a “cigar-shaped” configuration to the 1D form leads, instead of the “naive” cubic Schrödinger equation, to ones with a nonpolynomial nonlinearity sala1 ; Canary . Such models are useful in various settings, making it possible to obtain results in a relatively simple form, which compare well to direct simulations of the underlying 3D equations various . In particular, the version of this model corresponding to the combination of the tight transverse trap and strong optical-lattice potential acting in the longitudinal direction takes the form of the discrete nonpolynomial Schrödinger equation (DNPSE), which was introduced recently luca . An essential property of both the continual nonpolynomial equation and its discrete counterpart is that they make it possible to model the collapse. A new variety of the BEC dynamics, dominated by long-range (nonlocal) interactions, occurs in dipolar condensates, which can be composed of magnetically polarized 52Cr atoms, as demonstrated in a series of experimental works Cr . In particular, the dipole-dipole (DD) attraction in the condensate may give rise to a specific $d$-wave mode of the collapse d-collapse . On the other hand, the 52Cr condensate can be efficiently stabilized against the collapse, adjusting the scattering length of the contact interaction by means of the Feshbach-resonance (FR) technique experim1 . Another theoretically analyzed possibility is to create a condensate dominated by DD interactions between electric dipole moments induced in atoms by a strong external dc electric field dc . A similar situation may be realized in BEC formed by dipolar molecules hetmol . In particular, recent experimental work LiCs has reported the creation of LiCs dipolar molecules in a mixed ultracold gas. A possibility of making 2D solitons in dipolar condensates was predicted in several works. In particular, isotropic solitons Pedri05 and vortices Ami2 may exist if the sign of the DD interaction is inverted by means of rapid rotation of the dipoles reversal . On the other hand, stable anisotropic solitons can be supported by the ordinary DD interaction, if the dipoles are polarized in the 2D plane Ami1 . Solitons supported by nonlocal interactions were also predicted and realized in optics, making use of the thermal nonlinearity Krolik . A natural extension of the consideration of the dipolar BEC includes a strong optical lattice potential, which leads to the discrete model with the long- range DD interactions between lattice sites gpe ; Santos . In particular, 1D unstaggered solitons in this model with the cubic on-site nonlinearity were studied in Ref. gpe . It was shown that the DD interactions might enhance the solitons’ stability. This conclusion suggests a possibility of suppressing the collapse by means of the long-range DD forces, but the study of the collapse is not possible in the discrete system with the cubic nonlinearity. The objective of the present work is to introduce the DD interaction into DNPSE model and analyze the effects of the long-range interactions between dipoles localized at site of the discrete lattice on the soliton’s collapse in the sufficiently dense self-attractive condensate trapped in the deep optical lattice potential. We here focus on unstaggered solitons, leaving the consideration of staggered ones for another work. The paper is structured as follows. The discrete model including the on-site nonpolynomial nonlinearity and long-range DD interactions is formulated in Section II. Results for on-site and inter-site solitons, including the study of their stability, and the possibility of the collapse onset, are presented in Section III. The mobility of discrete solitons in the DNPSE model is also briefly considered in Section III. The paper is concluded by Section IV. ## II The model Adding the long-range DD interaction to the scaled nonpolynomial Schrödinger equation (in its continual form sala1 ; various ) leads to the following 1D equation: $\displaystyle i\frac{\partial F}{\partial t}$ $\displaystyle=$ $\displaystyle\left[-\frac{1}{2}\frac{\partial^{2}}{\partial z^{2}}-V_{0}\cos{(2qz)}+\frac{1-(3/2)\aleph|F|^{2}}{\sqrt{1-\aleph|F|^{2}}}\right]F$ (1) $\displaystyle+$ $\displaystyle GF(z)\int_{-\infty}^{+\infty}\frac{|F(z^{\prime})|^{2}}{|z-z^{\prime}|^{3}}dz^{\prime}.$ Here, $V_{0}$ and $\pi/q$ are the strength and period of the longitudinal optical lattice potential, $F(z,t)\equiv\sqrt{|\gamma|}f(z,t)$, where $f$ is the 1D mean-field wave function subject to normalization $\int_{-\infty}^{+\infty}\left|f(z,t)\right|^{2}dz=1$, and $\gamma=-2Na_{s}\sqrt{m\omega_{\bot}/\hbar}$ is the effective strength of the local interaction, with $N$ the total number of atoms in the condensate, $a_{s}$ the scattering length of atomic collisions ($a_{s}<0$ corresponds to the attraction), $m$ the atom mass, and $\omega_{\bot}$ the transverse trapping frequency sala1 . Further, $\aleph\equiv\mathrm{sgn}\left(a_{s}\right)$ is the sign of the local interaction, and $G=g\left(1-3\cos^{2}\theta\right)$ is the coefficient which defines the ratio of the DD and contact interactions, where $g$ is a positive coefficient and $\theta$ the angle between the $z$ axis and the orientation of the dipoles. One obvious case of interest in the 1D geometry corresponds to the dipoles polarized along the $z$ axis, i.e., $\theta=0$ and $G=-2g$, when the long-range interaction is _attractive_. Another interesting case corresponds to the orientation of the dipoles perpendicular to the $z$ axis ($\theta=\pi/2$ , i.e. $G=g$), which implies the repulsive DD interaction. Assuming a sufficiently deep optical lattice potential, and approximating the wave function by a superposition of localized Wannier modes, similar to how it was done in Refs. luca and gpe , one can derive the discrete version of Eq. (1), i.e., the DNPSE with the DD term: $\displaystyle i\frac{\partial F_{n}}{\partial t}$ $\displaystyle=$ $\displaystyle-C\left(F_{n+1}+F_{n-1}-2F_{n}\right)+\frac{1-\left(3/2\right)\aleph\left|F_{n}\right|^{2}}{\sqrt{1-\aleph\left|F_{n}\right|^{2}}}F_{n}$ (2) $\displaystyle-$ $\displaystyle\Gamma\sum_{n^{\prime}\neq n}\frac{\left|F_{n^{\prime}}\right|^{2}}{\left|n-n^{\prime}\right|^{3}}F_{n},$ where the linear-coupling $C$ and the ratio between DD and contact interaction coefficients $\Gamma=G/\left|\gamma\right|$, are defined as in Ref. gpe ($\Gamma>0$ for attractive and $\Gamma<0$ for the repulsive DD interactions). Two dynamical quantities are conserved by Eq. (2), viz., norm $P=\sum_{n}\left|F_{n}\right|^{2}$ and Hamiltonian $\displaystyle H$ $\displaystyle=$ $\displaystyle\sum_{n}\left[C\left|F_{n}-F_{n+1}\right|^{2}+\sqrt{1-\aleph\left|F_{n}\right|^{2}}\left|F_{n}\right|^{2}\right.$ (3) $\displaystyle\left.-\Gamma\sum_{n\neq n^{\prime}}\frac{\left|F_{n^{\prime}}\right|^{2}\left|F_{n}\right|^{2}}{\left|n-n^{\prime}\right|^{3}}\right].$ Note that the staggering transformation, $F_{n}\equiv(-1)^{n}\exp\left(-4iCt\right)\tilde{F}_{n}$, can be used to change the sign of $C$ if it is negative, but this transformation cannot be used to invert the signs of nonlinearity coefficients in Eq. (2). Experimentally adjustable parameters are the relative strength of the DD/contact interactions, $\Gamma$, and the norm of stationary wave function, $P$. The latter may be expressed in terms of the total number of atoms in the condensate, $N$ luca ; gpe : $P\sim N\left|a_{s}\right|\sqrt{m\omega_{\bot}/\hbar}$. In particular, $a_{s}\approx 5$ nm for 52Cr atoms (far from the FR); assuming the transverse-confinement width to be $(\sqrt{m\omega_{\bot}/\hbar})^{-1}\sim 5$ $\mathrm{\mu}$m, we conclude that $P\sim 1$ may correspond to $\sim 1000$ atoms in the condensate. A typical value of the relative interaction strength, if estimated as the ratio of the effective scattering lengths corresponding to the DD and contact interactions in the 52Cr condensate, without the use of the FR technique, is $~{}\left|\Gamma\right|\simeq 0.15$ experim1 . Actually, $\Gamma$ can be made both positive and negative, and its absolute value may be altered within broad limits by means of the FR Cr . In particular, $\left|\Gamma\right|$ can be given very large values in the experimentally possible situation when the strength of the contact interactions is almost nullified with the help of the FR experim1 . Stationary solutions to Eq. (2), with chemical potential $\mu$, are sought for as $F_{n}=u_{n}\exp(-i\mu t)$, with real discrete function $u_{n}$ satisfying a stationary equation, $\displaystyle\mu u_{n}$ $\displaystyle=$ $\displaystyle-C\left(u_{n+1}+u_{n-1}-2u_{n}\right)+\frac{1-\left(3/2\right)\aleph u_{n}^{2}}{\sqrt{1-\aleph u_{n}^{2}}}u_{n}$ (4) $\displaystyle-$ $\displaystyle\Gamma u_{n}\sum_{n^{\prime}\neq n}\frac{u_{n^{\prime}}^{2}}{\left|n-n^{\prime}\right|^{2}}.$ In the case of the attractive contact interaction ($\aleph=+1$), $u_{n}^{2}$ cannot exceed the maximum value, $\left(u_{n}^{2}\right)_{\max}=1$, as seen from Eq. (4). In fact, the presence of the singularity in Eq. (2) at $\left|F_{n}\right|^{2}=1$ makes it possible to study the onset of collapse in the framework of this equation luca . Stationary equation (4) was numerically solved by an algorithm based on the modified Powell minimization method luca ; gpe . Initial ansätze used to construct on-site and inter-site-centered discrete solitons were taken, respectively, as $\left\\{u_{n}^{(0)}\right\\}=(...,\,0,\,A,\,0,\,...)$ and $(...,\,0,\,A,\,A,\,0,\,...)$, where $A$ is a real constant obtained from Eq. (4) in the corresponding approximation. Results reported below were obtained in the lattice composed of $101$ or $100$ sites, for the on-site and inter- site configurations, respectively. It was checked that the results do not alter if a larger lattice had been used. ## III Results and discussion ### III.1 The case of the attractive contact interaction Families of fundamental unstaggered solitons of on-site and inter-site types for the local attraction ($\aleph=+1$) and either sign of the DD interaction were obtained from the numerical solution of Eq. (4). In contrast to the 1D discrete model with the cubic on-site nonlinearity, where bright unstaggered solitons exist only for sufficiently weak repulsive DD interaction gpe , in the present model solitons can be also found if the repulsive DD interaction is strong. The solitons were categorized as stable ones if they met two conditions: the slope (Vakhitov-Kolokolov) criterion, according to which the slope of the $P(\mu)$ dependence must be negative (or may be very close to zero, see below), $dP/d\mu\leq 0$, and, simultaneously, the spectral condition, according to which the corresponding eigenvalues, found from linearized equations for small perturbations, must not have a positive real part gpe ; stability . In order to draw general conclusions about the influence of the DD interaction on the solitons, the analysis is presented below for two different values of the lattice coupling constant $C$, viz., $C=0.8$ and $C=0.2$. These cases correspond, respectively, to the proximity to the continuum limit, and to a strongly discrete system. #### III.1.1 The quasi-continual model ($C=0.8$) A global characteristic of soliton families is the $P(\mu)$ dependence, i.e., the scaled norm as a function of the chemical potential. For $C=0.8$ and four different values of DD parameter $\Gamma$, the $P(\mu)$ curves are displayed in Fig. 1. In the absence of the DD interaction, $\Gamma=0$, two subfamilies of on-site solitons are found, one (which occupies a narrow interval of $\mu$) obeying the slope criterion, and the other one violating it, in a broad interval. With the increase of the strength of the attractive DD interactions ($\Gamma=5$), the region where the slope condition is met spreads out, and, when the DD interaction is dominant ($\Gamma=12$), the condition is satisfied for all on-site solitons. On the other hand, the slope condition is fulfilled for all inter-site solitons, regardless of the value of $\Gamma$. It is worthy to note that the difference between the $P(\mu)$ curves for the on-site and inter-site solitons vanishes as the attractive DD interaction strengthens. In the case of the repulsive DD interaction, the $P(\mu)$ curves for on-site and inter-site solitons are completely separated, see Fig. 1(d). Actually, the slope of $P(\mu)$ curves for both on-site and inter-site solitons tends to be very small in this case, which makes the application of the slope criterion doubtful. In these areas, the solitons feature the amplitude close to the upper limit admitted by the model, $u_{\max}^{2}=1$, and a very small width, corresponding to a situation when nearly all atoms are collected in a single well of the underlying potential lattice. The spectral stability was examined by linearizing Eq. (2) for small perturbations $\delta F_{n}$ around the soliton, and finding the respective eigenvalues in a numerical form. The results of the stability analysis for the on-site solitons, with $C=0.8$, are summarized in Fig. 2, in the form of the stability diagram in the plane of $\left(\mu,\Gamma\right)$, where contours of constant norm $P$ for the on-site solitons are included too. The collapse condition, $u_{\max}^{2}=1$, is attained at the black solid line, which is, simultaneously, a stability border. In direct simulations, the on-site solitons which are predicted to be stable survived as long as the simulations ran [Fig. 3(a)], while the solitons classified as unstable ones suffered the collapse (destruction of the solution after attaining the level of $u_{\max}^{2}=1$) in a finite time. On the other hand, all inter-site solitons are unstable, as the spectrum of eigenvalues for small perturbations around them always contains real eigenvalues. However, unstable inter-site solitons which have stable on-site counterparts with the same norm avoid the collapse, evolving into robust breathers oscillating around the corresponding stable on-site solitons, as shown in Fig. 3(b). Unstable inter-site solitons do collapse if no stable on- site soliton with the same norm can be found, see Fig. 3(c). Therefore, the border line for the collapse of the inter-site solitons coincides with the stability border for on-site solitons in Fig. 2. For the repulsive DD interaction, the spectral stability condition for all inter-site solitons does not hold either. Because, in this case, curves $P(\mu)$ for the inter-site and on-site solitons are strongly separated [Fig.1(d)], unstable inter-site solitons do not find stable on-site counterparts with the same norm, therefore they suffer the collapse. As for the on-site solitons, there exists a region where the spectral stability condition holds for them. This region expands as the repulsive DD interaction gets stronger, although the respective curve $P(\mu)$ becomes almost horizontal, and the slope condition cannot be accurately verified. Direct numerical simulations confirm the predictions of the stability analysis for the on-site solitons in this case too. #### III.1.2 The strongly discrete model ($C=0.2$) In this case, the slope condition is satisfied for all on-site solitons in the absence of the DD interaction ($\Gamma=0$), see Fig. 4(a). As the strength of the attractive DD interaction grows, a pair of subfamilies emerge, the slope- stable and unstable ones, the respective $P(\mu)$ curves being similar to those observed in the case of the strong coupling, $C=0.8$ [Fig. 4(b)]. Eventually, when the attractive DD interaction becomes dominant, the region where the slope condition is satisfied spreads over the entire parameter space, as seen in Fig. 4(c). In the model with $C=0.2$, all inter-site solitons again satisfy the slope condition. With the strengthening of the DD interaction, the separation between the $P(\mu)$ curves for the on-site branch, which satisfies the slope condition, and its inter-site counterpart vanishes. On the other hand, in the case of the repulsive DD interaction, the corresponding $P(\mu)$ curves for on-site and inter-site soliton families are strongly separated, see Fig. 4(d). Results of the stability analysis for the on-site solitons are summarized in the stability diagram displayed in Fig. 5(a) in parametric space $(\Gamma,\mu)$. Unlike the case of $C=0.8$, cf. Fig. 2, in the present case there appears a region where the spectral stability condition is violated for on-site solitons as the DD interaction grows stronger, as well as a region where the stability condition holds for inter-site solitons. These regions disappear again with the further growth of $\Gamma$. Also in contrast to the case of $C=0.8$, the line at which the collapse is attained in the family of on-site solitons _does not_ coincide with the border between stable and unstable parts of the family. Rather, the collapse line passes trough the unstable region where the spectral-stability condition does not hold, see Fig. 5(a). Direct simulations demonstrate that unstable on-site solitons which have stable inter-site counterparts with the equal norm evolve into breathers oscillating around the stable counterparts. On the other hand, if unstable on- site solitons cannot find stable inter-site counterparts with the same (or close) value of the norm, they undergo the collapse. In fact, the existence of the two different scenarios of the instability development – the formation of the breather and collapse – explains the above-mentioned fact that the collapse line does not coincide with the instability border. In the present case too, direct simulations corroborate the stability of those solitons which do not have unstable eigenvalues. Extending the above-mentioned trend, unstable inter-site solitons which have stable on-site counterparts with the same norm evolve into persistent breathers, while those unstable solitons that are devoid of stable equal-norm counterparts suffer the collapse. Accordingly, the line at which the collapse is attained does not coincide with the instability border, as seen in Fig. 5(b). It is worthy to note the existence of a stability region for inter-site solitons in Fig. 5(b) which is adjacent to the collapse line. In the latter case, the stable inter-site solitons do not have on-site counterparts with the same value of the norm. For the repulsive DD interactions, the spectral stability condition always holds for on-site solitons and does not hold for inter-site modes, similar to the case of $C=0.8$. Again, in some part of the parameter space, the corresponding $P(\mu)$ curves for the on-site solitons are nearly horizontal lines with zero slope, being completely separated from the $P(\mu)$ line for the inter-site modes. Direct simulations demonstrate that the on-site solitons are indeed stable in this case, while the unstable inter-site solitons undergo the collapse. ### III.2 The case of repulsive contact interactions If the local interaction is repulsive, the existence of the unstaggered solitons may only be supported by the attractive DD interaction. In the model with the self-repulsive cubic on-site nonlinearity, unstaggered solitons were found only when the relative strength of the attractive DD interaction was large enough, $\Gamma\geq 0.4$ gpe . In the present model, unstaggered solitons (with large amplitudes) are obtained for smaller values of $\Gamma$ as well. Nevertheless, general results obtained in the present model for the case of the local repulsion are not drastically different from those reported in the model with the cubic on-site nonlinearity in Ref. gpe . In particular, differences between $P(\mu)$ curves for on-site and inter-site solitons are small at all values of $\mu$, the slope condition is always satisfied for both types of the solitons, and there is an exchange between regions where the spectral stability condition is fulfilled for on-site and inter-site solitons. Further, unstable solitons evolve into breathers oscillating around their stable counterparts. The similarity of these results for discrete solitons in the present DNPSE model and its cubic counterpart is not surprising, as in the case of the local repulsion (unlike attraction) there is no dramatic difference between the nonpolynomial and cubic nonlinearities, therefore the competition of the local term of either type (nonpolynomial or cubic) with the DD attraction gives rise to similar solitary modes. ### III.3 Moving discrete solitons Finally, we briefly summarize results concerning mobility of localized modes, with respect to the concept of the Peierls-Nabarro barrier mobil . To this end, we follow the lines of the analysis developed in Refs. luca and gpe . Examination of the mobility has shown that the Peierls-Nabarro barrier in the DNPSE model depends on the strength of the DD interaction in the same way as it was in the discrete model with the cubic on-site nonlinearity. Namely, in the case of the local attraction, the repulsive or attractive DD interaction decreases or increases, respectively, a region in plane $(P,\mu)$ where mobile localized modes can be found. On the other hand, in the case of the contact repulsion, all localized modes can be set in motion by an initial kick, regardless of the value of DD coefficient $\Gamma$. In all cases when mobile discrete solitons exist, the vanishing of the Peierls-Nabarro barrier coincides with the disappearance of the separation between $P(\mu)$ curves for the on-site and inter-site soliton families, cf. Refs. luca ; gpe . ## IV Conclusion The purpose of this work was to achieve a better understanding on the influence of the long-range DD (dipole-dipole) interactions on the stability and collapse of localized nonlinear modes in the cigar-shaped Bose-Einstein condensate trapped in a deep optical-lattice potential. To this end, we have introduced the model based on the one-dimensional DNPSE (discrete nonpolynomial Schrödinger equation), which includes the contact (on-site) and DD nonlinear terms. Both attractive and repulsive signs of the contact and DD interactions were considered. The main conclusion is that the presence of the attractive DD interaction enhances the soliton’s stability and helps to prevent the collapse. Our analysis was limited to unstaggered solitons, the consideration of staggered localized modes being a subject of a separate work. G.G., A.M. and Lj.H. acknowledge support from the Ministry of Science, Serbia (through project 141034). ## References * (1) A. Trombettoni and A. Smerzi, Phys. Rev. Lett. 86, 2353 (2001); F. Kh. Abdullaev, B. B. Baizakov, S. A. Darmanyan, V. V. Konotop, and M. Salerno, Phys. Rev. A 64, 043606 (2001); G. L. Alfimov, P. G. Kevrekidis, V. V. Konotop, and M. Salerno, Phys. Rev. E 66, 046608 (2002); R. Carretero-González, K. Promislow, Phys. Rev. A 66, 033610 (2002); N. K. Efremidis and D. N. Christodoulides, ibid. 67, 063608 (2003). * (2) M. A. Porter, R. Carretero-González, P. G. Kevrekidis, and B. A. Malomed, Chaos 15, 015115 (2005). * (3) P. G. Kevrekidis , K. O. Rasmussen and A. R. Bishop, Int. J. Mod. Phys. B 15, 2833 (2001). * (4) K. E. Strecker, G. B. Partridge, A. G. Truscott and R. G. Hulet, Nature 417, 150 (2002); see also K. E. Strecker, G. B. Partridge, A. G. Truscott, and R. G. Hulet, New J. Phys. 5, 73 (2003). * (5) S. L. Cornish, S. T. Thompson and C. E. Wieman, Phys. Rev. Lett. 96, 170401 (2006). * (6) L. Salasnich, Laser Phys. 12, 198 (2002); L. Salasnich, A. Parola, and L. Reatto, Phys. Rev. A 65, 043614 (2002); ibid. 66, 043603 (2002). * (7) L. Salasnich, A. Parola, and L. Reatto, Phys. Rev. A 66, 043603 (2002); L. Salasnich, Phys. Rev. A 70, 053617 (2004); L. Salasnich and B. A. Malomed, Phys. Rev. A 74, 053610 (2006); L. Salasnich, A. Cetoli, B. A. Malomed, and F. Toigo, ibid. 75, 033622 (2007); L. Salasnich, A. Cetoli, B. A. Malomed, F. Toigo, and L. Reatto, ibid. 76, 013623 (2007); L. Salasnich, B. A. Malomed, and F. Toigo, ibid. 76, 063614 (2007); 77, 035601 (2008). * (8) A. M. Mateo and V. Delgado, Phys. Rev. Lett. 97, 180409 (2006); A. Muñoz Mateo and V. Delgado, Phys. Rev. A 77, 013617 (2008). * (9) A. Maluckov, Lj. Hadžievski, B. A. Malomed, L. Salasnich, Phys. Rev. A 78, 013616 (2008). * (10) A. Griesmaier, J. Werner, S. Hensler, J. Stuhler, and T. Pfau., Phys. Rev. Lett. 94, 160401 (2005); J. Stuhler, A. Griesmaier, T. Koch, M. Fattori, T. Pfau, S. Giovanazzi, P. Pedri, and L. Santos, ibid. 95, 150406 (2005); J. Werner, A. Griesmaier, S. Hensler, J. Stuhler, and T. Pfau, ibid. 94, 183201 (2005); A. Griesmaier, J. Stuhler, T. Koch, M. Fattori, T. Pfau, and S. Giovanazzi, ibid. 97, 250402 (2006); T. Lahaye, T. Koch, B. Fröhlich, M. Fattori, J. Metz, A. Griesmaier, S. Giovanazzi, and T. Pfau, Nature (London) 448, 672 (2007). * (11) T. Koch, T. Lahaye, J. Metz, B. Fröhlich, A. Griesmaier, T. Pfau, Nature Physics 4, 218 (2008). * (12) T. Lahaye, J. Metz, B. Froehlich, T. Koch, M. Meister, A. Griesmaier, T. Pfau, H. Saito, Y. Kawaguchi, and M. Ueda, Phys. Rev. Lett. 101, 080401 (2008). * (13) M. Marinescu and L. You, Phys. Rev. Lett. 81, 4596 (1998); S. Giovanazzi, D. O’Dell, and G. Kurizki, Phys. Rev. Lett. 88, 130402 (2002); I. E. Mazets, D. H. J. O’Dell, G. Kurizki, N. Davidson, and W. P. Schleich, J. Phys. B 37, S155 (2004). * (14) J. Sage, S. Sainis, T. Bergeman, and D. DeMille, Phys. Rev. Lett. 94, 203001 (2005); C. Ospelkaus, L. Humbert, P. Ernst, K. Sengstock, and K. Bongs, ibid. 97, 120402 (2006); T. Köhler, K. Góral, and P. S. Julienne, Rev. Mod. Phys. 78, 1311 (2006). * (15) J. Deiglmayr, A. Grochola, M. Repp, K. Mörtlbauer, C. Glück, J. Lange, O. Dulieu, R. Wester, and M. Weidemüller, Phys. Rev. Lett. 101, 133004 (2008). * (16) S. Giovanazzi, A. Görlitz, and T. Pfau, Phys. Rev. Lett. 89, 130401 (2002); A. Micheli, G. Pupillo, H. P. Büchler, and P. Zoller, Phys. Rev. A 76, 043604 (2007). * (17) P. Pedri and L. Santos, Phys. Rev. Lett. 95, 200404 (2005); R. Nath, P. Pedri, and L. Santos, Phys. Rev. A 76, 013606 (2007). * (18) I. Tikhonenkov, B.A. Malomed, and A. Vardi. Vortex solitons in dipolar Bose-Einstein condensates. Phys. Rev. A 78, 043614 (2008). * (19) I. Tikhonenkov, B. Malomed, and A. Vardi, Phys. Rev. Lett. 100, 090406 (2008). * (20) C. Rotschild, O. Cohen, O. Manela, and M. Segev, Phys. Rev. Lett. 95, 213904 (2005); D. Briedis, D. E. Petersen, D. Edmundson, W. Królikowski, and O. Bang, Opt. Exp. 13, 435 (2005). * (21) G. Gligorić, A. Maluckov, Lj. Hadžievski, B. A. Malomed, Phys. Rev. A 78, 063615 (2008). * (22) M. Klawunn and L. Santos, arXiv: 0812.3543. * (23) Y. Sivan, B. Ilan, G. Fibich, Phys. Rev. E 78, 046602, (2008) * (24) Yu. S. Kivshar and D. K. Campbell, Phys. Rev. E 48, 3077 (1993); Lj. Hadžievski, A. Maluckov, M. Stepić, and D. Kip, Phys. Rev. Lett. 93, 033901 (2004); Z. Xu, Y. Kartashov, and L. Torner, Phys. Rev. Lett. 95, 113901 (2005). ## Figures Figure 1: The $P(\mu)$ (norm versus chemical potential) dependencies for families of on- and inter-site unstaggered solitons (the solid and dashed lines, respectively) in the case of the attractive contact interaction, for $C=0.8$ and relative strength of the DD interaction $\Gamma=0$ (a), $5$ (b), $12$ (c), and $-5$ (d). Figure 2: The stability/collapse diagram for on-site solitons, as determined by the stability analysis performed for $C=0.8$. The gray and white areas are occupied by unstable and stable solitons, respectively. The soliton norm keeps constant values along thin contour lines, as indicated in the figure. The chain of bold dots connected by the black line shows a curve along which the collapse is attained. Figure 3: (a) An example of a stable on-site soliton. (b,c) Development of the instability of inter- site solitons: (b) the case when a stable on-site soliton exists whose norm is equal to that of the unstable inter-site sooliton. In this situation, the unstable soliton evolves into a breather oscillating around the stable on-site soliton. (c) The case without the stable on-site counterpart with the equal norm. In the latter case, the unstable soliton collapses. Figure 4: $P(\mu)$ dependencies for families of on- and inter-site (solid and dashed lines, respectively) unstaggered solitons in the strongly discrete model ($C=0.2$) with the attractive contact interaction. The relative strength of the DD interaction is $\Gamma=0$ (a), $5$ (b), $15$ (c), and $-5$ (d). Figure 5: The stability/collapse diagram for (a) on-site (a) and inter-site (b) unstaggered solitons in the strongly discrete version of the model, with $C=0.2$. The notation has the same meaning as in Fig. 2.
arxiv-papers
2009-03-20T13:46:07
2024-09-04T02:49:01.306798
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "G. Gligoric, A. Maluckov, Lj. Hadzievski, B. A. Malomed", "submitter": "Aleksandra Maluckov", "url": "https://arxiv.org/abs/0903.3517" }
0903.3653
# Cohomological rigidity and the number of homeomorphism types for small covers over prisms Xiangyu Cao and Zhi Lü School of Mathematical Sciences, Fudan University, Shanghai, China xiangyu.cao08@gmail.com Institute of Mathematics, School of Mathematical Sciences, Fudan University, Shanghai, 200433, P.R.China. zlu@fudan.edu.cn ###### Abstract. In this paper we give a method of constructing homeomorphisms between two small covers over simple convex polytopes. As a result we classify, up to homeomorphism, all small covers over a 3-dimensional prism $\mathrm{P}^{3}(m)$ with $m\geq 3$. We introduce two invariants from colored prisms and other two invariants from ordinary cohomology rings of small covers. These invariants can form a complete invariant system of homeomophism types of all small covers over a prism in most cases. Then we show that the cohomological rigidity holds for all small covers over a prism $\mathrm{P}^{3}(m)$ (i.e., cohomology rings of all small covers over a $\mathrm{P}^{3}(m)$ determine their homeomorphism types). In addition, we also calculate the number of homeomorphism types of all small covers over a $\mathrm{P}^{3}(m)$. ###### Key words and phrases: Small covers, prism, classification This work is supported by grants from FDUROP (No. 080705) and NSFC (No. 10671034) ## 1\. Introduction In 1991, Davis and Januszkiewicz [DJ] introduced and studied a class of ${\mathbb{Z}}_{2}^{n}$-manifolds (called small covers), which belong to the topological version of toric varieties. An $n$-dimensional small cover $M^{n}$ is a closed $n$-manifold with a locally standard ${\mathbb{Z}}_{2}^{n}$-action such that its orbit space is a simple convex $n$-polytope $P^{n}$. As shown in [DJ], $P^{n}$ naturally admits a characteristic function $\lambda$ defined on the facets of $P^{n}$ (here we also call $\lambda$ a ${\mathbb{Z}}_{2}^{n}$-coloring on $P^{n}$), so that the geometrical topology and the algebraic topology of the samll cover $M^{n}$ can be completely determined by the pair $(P^{n},\lambda)$. In other words, the Davis- Januszkiewicz theory for small covers indicates the following two key points: 1. $\bullet$ Each small cover $\pi:M^{n}\longrightarrow P^{n}$ can be reconstructed from $(P^{n},\lambda)$, and this reconstruction is denoted by $M(\lambda)$. Thus, all small covers over a simple convex polytope $P^{n}$ correspond to all ${\mathbb{Z}}_{2}^{n}$-colorings on $P^{n}$, i.e., all small covers over a simple convex polytope $P^{n}$ are given by $\Gamma(P^{n})=\\{M(\lambda)|\lambda$ is a ${\mathbb{Z}}_{2}^{n}$-coloring on $P^{n}$$\\}$. 2. $\bullet$ The algebraic topology of a small cover $\pi:M^{n}\longrightarrow P^{n}$, such as equivariant cohomology, mod 2 Betti numbers and ordinary cohomology etc., can be explicitly expressed in terms of $(P^{n},\lambda)$. In the recent years, much further research on small covers has been carried on (see, e.g. [I], [GS], [NN], [CCL], [C], [LM], [LY], [KM], [M1]-[M3]). In some sense, the classification up to equivariant homeomorphism of small covers over a simple convex polytope has been understood very well. Actually, this can be seen from the following two kinds of viewpoints: One is that two small covers $M(\lambda_{1})$ and $M(\lambda_{2})$ over a simple convex polytope $P^{n}$ are equivariantly homeomorphic iff there is an automorphism $h\in\text{Aut}(P^{n})$ such that $\lambda_{1}=\bar{h}\circ\lambda_{2}$ where $\bar{h}$ induced by $h$ is an automorphism on all facets of $P^{n}$ (see [LM]); the other is that two small covers $M(\lambda_{1})$ and $M(\lambda_{2})$ over a simple convex polytope $P^{n}$ are equivariantly homeomorphic iff their equivariant cohomologies are isomorphic as $H^{*}(B{\mathbb{Z}}_{2}^{n};{\mathbb{Z}}_{2})$-algebras (see [M1]). However, in non-equivariant case, the classification up to homeomorphism of small covers over a simple convex polytope is far from understood very well except for few special polytopes (see, e.g. [GS], [KM], [M2], [M3], [LY]). In this paper we shall introduce an approach (called the sector method) of constructing homeomorphisms between two small covers. The basic idea of sector method is simply stated as follows: we first cut a $\mathbb{Z}_{2}^{n}$-colored simple convex $n$-polytope $(P^{n},\lambda)$ in ${\mathbb{R}}^{n}$ into two parts $P_{1}$ and $P_{2}$ by using an $(n-1)$-dimensional hyperplane $H$ such that the section $S$ cut out by $H$ is an $(n-1)$-dimensional simple convex polytope with certain property. Of course, $S$ naturally inherits a coloring from $(P^{n},\lambda)$. Then by using automorphisms of $S$ and automorphisms of ${\mathbb{Z}}_{2}^{n}$ we can construct new colored polytopes $(P^{\prime n},\lambda^{\prime})$ from $(P^{n},\lambda)$ (note that generally $P^{\prime n}$ may not be combinatorially equivalent to $P^{n}$), and further obtain new small covers $M(\lambda^{\prime})$ from those new colored polytopes $(P^{\prime n},\lambda^{\prime})$ by the reconstruction of small covers. Moreover, we can study how to construct the homeomorphisms between $M(\lambda)$ and $M(\lambda^{\prime})$. In particular, we give the method of constructing the homeomorphisms between $M(\lambda)$ and $M(\lambda^{\prime})$ (see Theorems 3.2-3.3). As an application, up to homeomorphism we shall classify all small covers over prisms. Let $\mathrm{P}^{3}(m)$ denote a 3-dimensional prism that is the product of $[0,1]$ and an $m$-gon where $m\geq 3$. Let $\Lambda(\mathrm{P}^{3}(m))=\\{\lambda\big{|}\lambda\text{ is a ${\mathbb{Z}}_{2}^{3}$-coloring on $\mathrm{P}^{3}(m)$}\\}$, and let $\Gamma(\mathrm{P}^{3}(m))=\\{M(\lambda)\big{|}\lambda\in\Lambda(\mathrm{P}^{3}(m))\\}$. Using the sector method, we first study rectangular sectors and find seven rectangular sectors with a good twist $\Psi(\psi,\rho,v_{0})$ in Section 4 (see Definition 3.3 for $\Psi(\psi,\rho,v_{0})$). We then use these seven rectangular sectors to define some operations on the coloring sequences of side-faces of colored polytopes $(\mathrm{P}^{3}(m),\lambda)$ in Section 5. Furthermore, we show that all $(\mathrm{P}^{3}(m),\lambda)$ can be reduced to some canonical forms without changing the homeomorphism type of the small covers $M(\lambda)$ (see Propositions 5.2-5.4 and 5.9). In particular, we introduce two combinatorial invariants $m_{\lambda}$ and $n_{\lambda}$ in Section 5, and then show in Section 6 that $(m_{\lambda},n_{\lambda})$ is actually a complete homeomorphism invariant of a class of small covers $M(\lambda)$ (see Corollary 6.6). In addition, we also introduce two algebraic invariants $\Delta(\lambda)$ and ${\mathcal{B}}(\lambda)$ in $H^{*}(M(\lambda);\mathbb{Z}_{2})$, which can become a complete homeomorphism invariant in most cases. Both $(m_{\lambda},n_{\lambda})$ and $(\Delta(\lambda),{\mathcal{B}}(\lambda))$ are of interest because of the nature of colored polytopes. With the help of these invariants, we can obtain the following cohomological rigidity theorem. ###### Theorem 1.1 (Cohomological rigidity). Two small covers $M(\lambda_{1})$ and $M(\lambda_{2})$ in $\Gamma(\mathrm{P}^{3}(m))$ are homeomorphic if and only if their cohomologies $H^{*}(M(\lambda_{1});{\mathbb{Z}}_{2})$ and $H^{*}(M(\lambda_{2});{\mathbb{Z}}_{2})$ are isomorphic as rings. ###### Remark 1.1. Kamishima and Masuda showed in [KM] that the cohomological rigidity holds for small covers over a cube. In addition, Masuda in [M2] also gave a cohomological non-rigidity example of dimension 25. A further question is what extent the cohomological rigidity can extend to small covers. In addition, we also determine the number of homeomorphism classes of all small covers in $\Gamma(\mathrm{P}^{3}(m))$. ###### Theorem 1.2 (Number of homeomorphism classes). Let $N(m)$ denote the number of homeomorphism classes of all small covers in $\Gamma(\mathrm{P}^{3}(m))$. Then $N(m)=\begin{cases}2&\text{ if $m=3$}\\\ 4&\text{ if $m=4$}\\\ \sum_{0\leq k\leq{m\over 2}}([{k\over 2}]+1)+6&\text{ if $m>4$ is even}\\\ \sum_{1\leq k\leq{m\over 2}}([{k\over 2}]+1)+4&\text{ if $m>4$ is odd.}\\\ \end{cases}$ The arrangement of this paper is as follows. In Section 2 we review the basic theory about small covers. In Section 3 we introduce the sector method. In Section 4 we apply the sector method to colored prisms and discuss the rectangular sectors. In Section 5 we use the rectangular sectors to define some operations on the coloring sequences of colored prisms and then determine the canonical forms of all colored prisms. In Section 6 we introduce two algebraic invariants of cohomology and then calculate such two invariants of all small covers. Finally, we complete the proofs of Theorems 1.1 and 1.2 in Section 7. ## 2\. Theory of small covers The purpose of this section is to briefly review the theory of small covers. Throughout the following assume that $\pi:M^{n}\longrightarrow P^{n}$ is a small cover over a simple convex $n$-polytope $P^{n}$. Note that a simple convex $n$-polytope $P^{n}$ means that exactly $n$ faces of codimension-one (i.e., facets) meet at each of its vertices. Let $\mathcal{F}(P^{n})=\\{F_{1},...,F_{\ell}\\}$ denote the set of all facets of $P^{n}$. ### 2.1. Coloring and Reconstruction Take a $k$-face $F^{k}$ of $P^{n}$, an easy observation shows (see also [DJ, Lemma 1.3]) that $\pi^{-1}(F^{k})\longrightarrow F^{k}$ is still a $k$-dimensional small cover. In particular, for any $x\in\pi^{-1}(\text{int}F^{k})$, its isotropy subgroup $G_{x}$ is independent of the choice of $x$, denoted by $G_{F}$. $G_{F}$ is isomorphic to $\mathbb{Z}_{2}^{n-k}$, and $G_{F}$ fixes $\pi^{-1}(F^{k})$ in $M^{n}$. In the case $k=n-1$, $F^{n-1}$ is a facet and $G_{F}$ has rank $1$, so that $G_{F}$ uniquely corresponds to a nonzero vector $v_{F}$ in ${\mathbb{Z}}_{2}^{n}$. Then there is a natural map (called characteristic function) $\lambda:\mathcal{F}(P)\longrightarrow\mathbb{Z}_{2}^{n}$ by mapping each facet $F$ to its corresponding nonzero vector $v_{F}$ in ${\mathbb{Z}}_{2}^{n}$ with the property $(\star)$: whenever the intersection of some facets $F_{i_{1}},...,F_{i_{r}}$ in $\mathcal{F}(P^{n})$ is nonempty, $\lambda(F_{i_{1}}),...,\lambda(F_{i_{r}})$ are linearly independent in $\mathbb{Z}_{2}^{n}$. Note that if each nonzero vector of $\mathbb{Z}_{2}^{n}$ is regarded as being a color, then the characteristic function $\lambda$ means that each facet is colored by a color. Thus, we also call $\lambda$ a $\mathbb{Z}_{2}^{n}$-coloring on $P^{n}$ here. By $\Lambda(P^{n})$ we denote the set of all $\mathbb{Z}_{2}^{n}$-colorings on $P^{n}$. ###### Remark 2.1. Since $P^{n}$ is simple, for each $k$-face $F^{k}$, there are $n-k$ facets $F_{i_{1}},...,F_{i_{n-k}}$ such that $F^{k}=F_{i_{1}}\cap\cdots\cap F_{i_{n-k}}$ and $\pi^{-1}(F^{k})$ is a transversal intersection of $\pi^{-1}(F_{i_{1}})$, $...,$ $\pi^{-1}(F_{i_{n-k}})$. Then the group $G_{F}$ determined by $F^{k}$ is actually generated by $\lambda(F_{i_{1}})$, $...,$ $\lambda(F_{i_{n-k}})$. Davis and Januszkiewicz [DJ] gave a reconstruction of $M^{n}$ by using the $\mathbb{Z}_{2}^{n}$-coloring $\lambda$ and the product bundle $P^{n}\times\mathbb{Z}_{2}^{n}$ over $P^{n}$. Geometrically this reconstruction is exactly done by gluing $2^{n}$ copies of $P^{n}$ along their boundaries via $\lambda$. Thus this reconstruction can be written as follows: $M(\lambda):=P^{n}\times\mathbb{Z}_{2}^{n}/(p,v)\sim(p,v+\lambda(F))\text{ for }p\in F\in\mathcal{F}(P^{n}).$ Then we have ###### Theorem 2.1 (Davis-Januszkiewicz). All small covers over $P^{n}$ are given by $\Gamma(P^{n})$$=\\{M(\lambda)|\lambda\in\Lambda(P^{n})\\}$. There is a natural action of $\text{GL}(n,\mathbb{Z}_{2})$ on $\Lambda(P^{n})$ defined by $\lambda\longmapsto\alpha\circ\lambda$, and it is easy to see that such an action is free, and also induces an action of $\text{GL}(n,\mathbb{Z}_{2})$ on $\Gamma(P^{n})$ by $M(\lambda)\longmapsto M(\alpha\circ\lambda)$. Following [DJ], two small covers $M(\lambda_{1})$ and $M(\lambda_{2})$ in $\Gamma(P^{n})$ are said to be Davis-Januszkiewicz equivalent if there is a $\alpha\in\text{GL}(n,\mathbb{Z}_{2})$ such that $\lambda_{1}=\alpha\circ\lambda_{2}$. Thus, each Davis-Januszkiewicz equivalence class in $\Gamma(P^{n})$ is actually an orbit of the action of $\text{GL}(n,\mathbb{Z}_{2})$ on $\Gamma(P^{n})$. ### 2.2. Betti numbers and $h$-vector The notion of the $h$-vector plays an essential important role in the theory of polytopes, while the notion of Betti numbers is also so important in the topology of manifolds. Davis-Januszkiewicz theory indicates that the Dehn- Sommerville relations for the $h$-vectors and the Poincaré duality for the Betti numbers are essentially consistent in the setting of small covers. Let $P^{*}$ be the dual of $P^{n}$ that is a simplicial polytope. Then the boundary $\partial P^{*}$ denoted by $K_{P}$ is a finite simplicial complex of dimension $n-1$. For $0\leq i\leq n-1$, by $f_{i}$ one denotes the number of all $i$-faces in $K_{P}$. Then the vector $(f_{0},f_{1},...,f_{n-1})$ is called the $f$-vector of $P^{n}$, denoted by ${\bf f}(P^{n})$. Then the $h$-vector denoted by ${\bf h}(P^{n})$ of $P^{n}$ is an integer vector $(h_{0},h_{1},...,h_{n})$ defined from the following equation $h_{0}t^{n}+\cdots+h_{n-1}t+h_{n}=(t-1)^{n}+f_{0}(t-1)^{n-1}+\cdots+f_{n-1}.$ ###### Theorem 2.2 (Davis-Januszkiewicz). Let $\pi:M^{n}\longrightarrow P^{n}$ be a small cover over a simple convex polytope $P^{n}$. Then ${\bf h}(P^{n})=(h_{0},...,h_{n})=(b_{0},...,b_{n})$ where $b_{i}=\dim H^{i}(M^{n};{\mathbb{Z}}_{2})$. ###### Remark 2.2. We see from Theorem 2.1 that the Poincaré duality $b_{i}=b_{n-i}$ agrees with the Dehn-Sommerville relation $h_{i}=h_{n-i}$. ###### Example 2.1. For the prism $\mathrm{P}^{3}(m)$, ${\bf h}(\mathrm{P}^{3}(m))=(1,m-1,m-1,1)$, so any small cover over $\mathrm{P}^{3}(m)$ has the mod 2 Betti numbers $(b_{0},b_{1},b_{2},b_{3})=(1,m-1,m-1,1)$. ### 2.3. Stanley-Reisner face ring and equivariant cohomology Stanley-Reisner face ring is a basic combinatorial invariant, and equivariant cohomology is an essential invariant in the theory of transformation groups. Davis-Januszkiewicz theory indicates that these two kinds of invariants are also essentially consistent in the setting of small covers. Let $P^{n}$ be a simple convex polytope with facet set $\mathcal{F}(P^{n})=\\{F_{1},...,F_{\ell}\\}$. Following [DJ], the Stanley- Reisner face ring of $P^{n}$ over $\mathbb{Z}_{2}$, denoted by $\mathbb{Z}_{2}(P^{n})$, is defined as follows: $\mathbb{Z}_{2}(P^{n})=\mathbb{Z}_{2}[F_{1},...,F_{\ell}]/I$ where the $F_{i}$’s are regarded as indeterminates of degree one, and $I$ is a homogenous ideal generated by all sequence free monomials of the form $F_{i_{1}}\cdots F_{i_{s}}$ with $F_{i_{1}}\cap\cdots\cap F_{i_{s}}=\emptyset$. ###### Example 2.2. Let $P^{n}$ be an $n$-simplex $\Delta^{n}$ with $n+1$ facets $F_{1},...,F_{n+1}$. Then $\mathbb{Z}_{2}(\Delta^{n})=\mathbb{Z}_{2}[F_{1},...,F_{n+1}]/(F_{1}\cdots F_{n+1}).$ ###### Example 2.3. Let $F_{1},...,F_{2n}$ be $2n$ facets of an $n$-cube $I^{n}$ with $F_{i}\cap F_{i+n}=\emptyset,i=1,...,n$. Then $\mathbb{Z}_{2}(I^{n})=\mathbb{Z}_{2}[F_{1},...,F_{2n}]/(F_{i}F_{i+n}|i=1,...,n).$ ###### Theorem 2.3 (Davis-Januszkiewicz). Let $\pi:M^{n}\longrightarrow P^{n}$ be a small cover over a simple convex polytope $P^{n}$. Then its equivariant cohomology $H^{*}_{\mathbb{Z}_{2}^{n}}(M^{n};\mathbb{Z}_{2})\cong\mathbb{Z}_{2}(P^{n}).$ ### 2.4. Ordinary cohomology Let $\pi:M^{n}\longrightarrow P^{n}$ be a small cover over a simple convex polytope $P^{n}$ with $\mathcal{F}(P^{n})=\\{F_{1},...,F_{\ell}\\}$, and $\lambda:\mathcal{F}(P^{n})\longrightarrow\mathbb{Z}_{2}^{n}$ its $\mathbb{Z}_{2}^{n}$-coloring. Now let us extend $\lambda:\mathcal{F}(P^{n})\longrightarrow\mathbb{Z}_{2}^{n}$ to a linear map $\widetilde{\lambda}:\mathbb{Z}_{2}^{\ell}\longrightarrow\mathbb{Z}_{2}^{n}$ by replacing $\\{F_{1},...,F_{\ell}\\}$ by the basis $\\{e_{1},...,e_{\ell}\\}$ of $\mathbb{Z}_{2}^{\ell}$. Then $\widetilde{\lambda}:\mathbb{Z}_{2}^{\ell}\longrightarrow\mathbb{Z}_{2}^{n}$ is surjective, and $\widetilde{\lambda}$ can be regarded as an $n\times\ell$-matrix $(\lambda_{ij})$, which is written as follows: $(\lambda(F_{1}),...,\lambda(F_{\ell})).$ It is well-known that $H_{1}(B\mathbb{Z}_{2}^{\ell};\mathbb{Z}_{2})=H_{1}(E\mathbb{Z}_{2}^{n}\times_{\mathbb{Z}_{2}^{n}}M^{n};\mathbb{Z}_{2})=\mathbb{Z}_{2}^{\ell}$ and $H_{1}(B\mathbb{Z}_{2}^{n};\mathbb{Z}_{2})=\mathbb{Z}_{2}^{n}$. So one has that $p_{*}:H_{1}(E\mathbb{Z}_{2}^{n}\times_{\mathbb{Z}_{2}^{n}}M^{n};\mathbb{Z}_{2})\longrightarrow H_{1}(B\mathbb{Z}_{2}^{n};\mathbb{Z}_{2})$ can be identified with $\widetilde{\lambda}:\mathbb{Z}_{2}^{\ell}\longrightarrow\mathbb{Z}_{2}^{n}$, where $p:E\mathbb{Z}_{2}^{n}\times_{\mathbb{Z}_{2}^{n}}M^{n}\longrightarrow B\mathbb{Z}_{2}^{n}$ is the fibration of the Borel construction associating to the universal principal $\mathbb{Z}_{2}^{n}$-bundle $E\mathbb{Z}_{2}^{n}\longrightarrow B\mathbb{Z}_{2}^{n}$. Furthermore, $p^{*}:H^{1}(B\mathbb{Z}_{2}^{n};\mathbb{Z}_{2})\longrightarrow H^{1}_{\mathbb{Z}_{2}^{n}}(M^{n};\mathbb{Z}_{2})$ is identified with the dual map $\widetilde{\lambda}^{*}:\mathbb{Z}_{2}^{n*}\longrightarrow\mathbb{Z}_{2}^{\ell*}$, where $\widetilde{\lambda}^{*}=\widetilde{\lambda}^{\top}$ as matrices. Therefore, column vectors of $\widetilde{\lambda}^{*}$ can be understood as linear combinations of $F_{1},...,F_{\ell}$ in the face ring $\mathbb{Z}_{2}(P^{n})=\mathbb{Z}_{2}[F_{1},...,F_{\ell}]/I$. Write $\lambda_{i}=\lambda_{i1}F_{1}+\cdots+\lambda_{i\ell}F_{\ell}.$ Let $J_{\lambda}$ be the homogeneous ideal $(\lambda_{1},...,\lambda_{n})$ in $\mathbb{Z}_{2}[F_{1},...,F_{\ell}]$. Davis and Januszkiewicz calculated the ordinary cohomology of $M^{n}$, which is stated as follows. ###### Theorem 2.4 (Davis-Januszkiewicz). Let $\pi:M^{n}\longrightarrow P^{n}$ be a small cover over a simple convex polytope $P^{n}$. Then its ordinary cohomology $H^{*}(M^{n};\mathbb{Z}_{2})\cong\mathbb{Z}_{2}[F_{1},...,F_{\ell}]/I+J_{\lambda}.$ The following result which will be used later is due to Nakayama and Nishimura [NN]. ###### Proposition 2.5. Let $\pi:M^{n}\longrightarrow P^{n}$ be a small cover over a simple convex polytope $P^{n}$, and $\lambda:\mathcal{F}(P^{n})=\\{F_{1},...,F_{\ell}\\}\longrightarrow\mathbb{Z}_{2}^{n}$ its $\mathbb{Z}_{2}^{n}$-coloring. Then $M^{n}$ is orientable if and only if there exists an automorphism $\sigma\in\text{\rm GL}(n,\mathbb{Z}_{2})$ such that $\lambda^{\prime}=\sigma\circ\lambda$ satisfies $\sum_{j=1}^{n}\lambda^{\prime}_{jl}\equiv 1\mod 2$ for all $1\leq l\leq\ell$, where $\widetilde{\lambda^{\prime}}=(\lambda^{\prime}_{ij}):\mathbb{Z}_{2}^{\ell}\longrightarrow\mathbb{Z}_{2}^{n}$ is the linear extension of $\lambda^{\prime}$, as before. ## 3\. Sector Method Each point of a simple convex polytope $P^{n}$ has a neighborhood which is affinely isomorphic to an open subset of ${\mathbb{R}}^{n}_{\geq 0}$, so $P^{n}$ is an $n$-dimensional nice manifold with corners (see [D]). An automorphism of $P^{n}$ is a self-homeomorphism of $P^{n}$ as a manifold with corners, and by $\text{Aut}(P^{n})$ we denote the group of automorphisms of $P^{n}$. All faces of $P^{n}$ forms a poset by inclusion. An automorphism of $\mathcal{F}(P^{n})$ is a bijection from $\mathcal{F}(P^{n})$ to itself which preserves the poset structure of all faces of $P^{n}$, and by $\text{Aut}(\mathcal{F}(P^{n}))$ we denote the group of automorphisms of $\mathcal{F}(P^{n})$. Each automorphism of $\text{Aut}(P^{n})$ naturally induces an automorphism of $\mathcal{F}(P^{n})$. It is well-known (see [BP] or [Z]) that two simple convex polytopes are combinatorially equivalent if and only if they are homeomorphic as manifolds with corners. Thus, the natural homomorphism $\Phi:\text{Aut}(P^{n})\longrightarrow\text{Aut}(\mathcal{F}(P^{n}))$ is surjective. ###### Definition 3.1. Let $P$ be a simple $n$-polytope and $S$ be a simple $(n-1)$-polytope. An embedding $i:S\longrightarrow P$ is called a _sector_ if the following conditions are satisfied: 1. (a) $P\backslash i(S)$ have two connected components such that $i(S)$ is the common facet of $P_{1}$ and $P_{2}$, where $P_{1},P_{2}$ denote the closures of the two components respectively, called the sub-polytopes of $i$. 2. (b) For every face $F\subset S$ of dimension $k$, $i(F)$ is the subset of a unique $(k+1)$-dimensional face of $P^{n}$. Suppose that $i:S\longrightarrow P$ is a sector with $P_{1}$ and $P_{2}$ as its two sub-polytopes. Let $i_{r}:S\rightarrow P_{r},r=1,2$, be the embeddings induced by $p\mapsto i(p)$. Then $P=P_{1}\coprod P_{2}/i_{1}(s)\sim i_{2}(s).$ Furthermore, we can get an induced map $i_{*}:\mathcal{F}(S)\rightarrow\mathcal{F}(P)$, which is poset structure- preserving. Of course, $i_{*}$ is injective. Now set $\bar{\lambda}:=\lambda\circ i_{*}$, which is called the _derived coloring_ of $i_{*}$ and $\lambda$. Obviously, the derived coloring $\bar{\lambda}$ assigns to each facet of $S$ a vector in $\mathbb{Z}_{2}^{n}$ and satisfies the independence condition: whenever the intersection of some facets $F_{l_{1}},...,F_{l_{r}}$ in $\mathcal{F}(S)$ is nonempty, $\bar{\lambda}(F_{l_{1}}),...,\bar{\lambda}(F_{l_{r}})$ are linearly independent. Let $(\psi,\rho)$ be a pair of $\psi\in\text{Aut}(S)$ and $\rho\in\text{GL}(n,\mathbb{Z}_{2})$. $(\psi,\rho)$ is called an _auto- equivalence_ of $S$ if $\bar{\lambda}\circ\psi=\rho\circ\bar{\lambda}$, where we just abuse $\varphi$ and the automorphism of $\mathcal{F}(S)$ induced by $\varphi$. Now given a $\mathbb{Z}_{2}^{n}$-colored simple $n$-polytope $(P,\lambda)$ with a sector $i:S\longrightarrow P$ and its two sub-polytopes $P_{1},P_{2}$, and fix $(\psi,\rho)$ an auto-equivalence of $S$. Suppose that $P^{\prime}$ is another simple $n$-polytope with $j:S\rightarrow P^{\prime}$ another sector, cutting $P^{\prime}$ into ${P^{\prime}}_{1}$ and ${P^{\prime}}_{2}$, such that there are $f_{r}:P_{r}\rightarrow{P^{\prime}}_{r},r=1,2$, which are combinatorially equivalent with $f_{1}\circ i_{1}=j_{1}$ and $f_{2}\circ i_{2}\circ\psi=j_{2}$. Thus $P^{\prime}=P_{1}^{\prime}\coprod P_{2}^{\prime}/j_{1}(s)\sim j_{2}(s)=f_{1}(P_{1})\coprod f_{2}(P_{2})/f_{1}\circ i_{1}(s)\sim f_{2}\circ i_{2}\circ\psi(s).$ ###### Remark 3.1. Generally $P$ is not combinatorially equivalent to $P^{\prime}$ although $P_{r}$ is combinatorially equivalent to $P^{\prime}_{r}$ $(r=1,2)$. Then we can define a $\mathbb{Z}_{2}^{n}$-coloring $\lambda^{\prime}$ on $P^{\prime}$ as follows: for each facet $F\in\mathcal{F}(P^{\prime})$, if $F\cap{P_{1}}^{\prime}\neq\emptyset$, then there is a unique facet $F_{1}\in\mathcal{F}(P)$ such that $f_{1}(F_{1}\cap P_{1})\subset F$. Similarly, if $F\cap{P^{\prime}}_{2}\neq\emptyset$, then there is also a unique facet $F_{2}\in\mathcal{F}(P^{n})$ such that $f_{2}(F_{2}\cap P_{2})\subset F$. Furthermore, define $\lambda^{\prime}:\mathcal{F}(P^{\prime})\rightarrow\mathbb{Z}_{2}^{n}$ in the following way: $\lambda^{\prime}(F)=\begin{cases}\lambda(F_{1})&\text{ if $F\cap{P_{1}}^{\prime}\neq\emptyset$}\\\ \rho^{-1}\circ\lambda(F_{2})&\text{ if $F\cap{P_{2}}^{\prime}\neq\emptyset$.}\end{cases}$ Such $\lambda^{\prime}$ is well-defined. In fact, if $F$ has nonempty intersection with both ${P^{\prime}}_{1}$ and $P^{\prime}_{2}$, then $F$ must lie in the image of $j_{*}$, say $F=j_{*}(f)$ where $f\in\mathcal{F}(S)$. Then from $f_{1}\circ i_{1}=j_{1}$ we see that $F_{1}=i_{*}(f)$, and from $f_{2}\circ i_{2}\circ\psi=j_{2}$ we see that $F_{2}=i_{*}(\psi(f))$. So $\lambda(F_{1})=\bar{\lambda}(f)=\rho^{-1}\circ\bar{\lambda}\circ\psi(f)=\rho^{-1}\circ\lambda\circ i_{*}\circ\psi(f)=\rho^{-1}\circ\lambda(F_{2})$ as desired. In summary, we now have two colored polytopes $(P,\lambda)$ and $({P}^{\prime},\lambda^{\prime})$. Then using the reconstruction of small covers, we obtain two small covers $M(\lambda)=P\times\mathbb{Z}_{2}^{n}/(p,v)\sim(p,v+\lambda(F))\text{ for }p\in F\in\mathcal{F}(P)$ and $M(\lambda^{\prime})=P^{\prime}\times\mathbb{Z}_{2}^{n}/(p,v)\sim(p,v+\lambda^{\prime}(F))\text{ for }p\in F\in\mathcal{F}(P^{\prime})$. Now let us look at two small covers $\pi:M(\lambda)\longrightarrow P$ and $\pi^{\prime}:M(\lambda^{\prime})\longrightarrow P^{\prime}$. Set $M_{r}={\pi}^{-1}(P_{r}),r=1,2$. Let $\mathcal{S}=S\times\mathbb{Z}_{2}^{n}/\\{(s,v)\sim(s,v+\bar{\lambda}(f))|s\in f\in\mathcal{F}(S)\\}.$ Then it is easy to see that $\mathcal{S}$ is an $(n-1)$-dimensional closed manifold (but possibly disconnected), called the sector manifold here. The sector $i:S\longrightarrow P$ naturally induces an embedding $\iota:\mathcal{S}\hookrightarrow M(\lambda)$ defined by $\\{(s,v)\\}\longmapsto\\{(i(s),v)\\}$, and $i_{r}:S\longrightarrow P_{r}$ also induces the embedding $\iota_{r}:\mathcal{S}\hookrightarrow M_{r}$ $(r=1,2)$. Obviously, $\partial M_{r}=\iota_{r}(\mathcal{S})={\pi}^{-1}(i(S))=\iota(\mathcal{S})$. Using this terminology one can write $M(\lambda)=M_{1}\coprod M_{2}/\iota_{1}(x)\sim\iota_{2}(x)=M_{1}\coprod M_{2}/\\{(i_{1}(s),v)\\}\sim\\{(i_{2}(s),v)\\},$ i.e., $M(\lambda)$ is obtained by gluing $M_{1}$ and $M_{2}$ together along their common boundary $\iota(\mathcal{S})$ via $\iota_{1}$ and $\iota_{2}$. Similarly, set $M^{\prime}_{r}={\pi^{\prime}}^{-1}(P^{\prime}_{r}),r=1,2$. Since ${P^{\prime}}_{r}$ is combinatorially equivalent to $P_{r}$ for $r=1,2$, $M^{\prime}_{r}$ is homeomorphic to $M_{r}$. More precisely, $f_{1}:P_{1}\longrightarrow P^{\prime}_{1}$ induces an equivariant homeomorphism $\widetilde{f}_{1}:M_{1}\longrightarrow M^{\prime}_{1}$ by mapping $x=\\{(p,v)\\}\longmapsto\\{(f_{1}(p),v)\\}$, while $f_{2}:P_{2}\longrightarrow P^{\prime}_{2}$ induces a weakly equivariant homeomorphism $\widetilde{f}_{2}:M_{2}\longrightarrow M^{\prime}_{2}$ by mapping $x=\\{(p,v)\\}\longmapsto\\{(f_{2}(p),\rho^{-1}(v))\\}$. Let $\iota^{\prime}_{r}$ $(r=1,2)$ be the embedding $\mathcal{S}\hookrightarrow M^{\prime}_{r}$ induced by $j_{r}:S\longrightarrow P^{\prime}_{r}$ and $\iota^{\prime}$ the embedding $\mathcal{S}\hookrightarrow M(\lambda^{\prime})$ induced by $j:S\longrightarrow P^{\prime}$. Then $\partial M^{\prime}_{r}=\iota^{\prime}_{r}(\mathcal{S})={\pi^{\prime}}^{-1}(i(S))=\iota^{\prime}(\mathcal{S})$. Furthermore, one has that $M(\lambda^{\prime})=M^{\prime}_{1}\coprod M^{\prime}_{2}/\iota^{\prime}_{1}(x)\sim\iota^{\prime}_{2}(x)=M^{\prime}_{1}\coprod M^{\prime}_{2}/\\{(j_{1}(s),v)\\}\sim\\{(j_{2}(s),v)\\}.$ On the other hand, take an arbitrary $v_{0}\in\mathbb{Z}_{2}^{n}$, using the relation $\bar{\lambda}\circ\psi=\rho\circ\bar{\lambda}$ we see easily that the auto-equivalence $(\psi,\rho)$ of $S$ also induces a weakly equivariant homeomorphism $\Psi:\mathcal{S}\rightarrow\mathcal{S}$ defined by $\\{(s,v)\\}\mapsto\\{(\psi(s),\rho(v)+v_{0})\\}$, so that $\iota_{2}\circ\Psi$ gives a new embedding of $\mathcal{S}$ in $M_{2}$ and $\widetilde{f}_{2}\circ\iota_{2}\circ\Psi$ also gives a new embedding of $\mathcal{S}$ in $M^{\prime}_{2}$. Let $\widetilde{M}(\lambda)=M_{1}\coprod M_{2}/\iota_{1}(x)\sim\iota_{2}(\Psi(x))$. The one has that ###### Lemma 3.1. $\widetilde{M}(\lambda)$ is homeomorphic to $M(\lambda^{\prime})$. ###### Proof. Let $z=\\{(p,v)\\}\in\widetilde{M}(\lambda)$. Define $\Pi:\widetilde{M}(\lambda)\longrightarrow M(\lambda^{\prime})$ by $\Pi(z)=\begin{cases}\widetilde{f}_{1}(z)&\text{if $z\in M_{1}$}\\\ \widetilde{f^{\prime}}_{2}(z)&\text{if $z\in M_{2}$}\end{cases}$ where $\widetilde{f^{\prime}}_{2}(z)=\\{(f_{2}(p),\rho^{-1}(v)+\rho^{-1}(v_{0}))\\}$. To show that $\Pi$ is a homeomorphism, it suffices to prove that for $x\in\mathcal{S}$, if $\iota_{1}(x)\sim\iota_{2}(\Psi(x))$ in $\widetilde{M}(\lambda)$, then $\Pi\circ\iota_{1}(x)\sim\Pi\circ\iota_{2}(\Psi(x))$ in $M(\lambda^{\prime})$. Since $\Pi\circ\iota_{1}=\widetilde{f}_{1}\circ\iota_{1}=\iota^{\prime}_{1}$, it needs only to check that $\Pi\circ\iota_{2}\circ\Psi=\iota^{\prime}_{2}$. Let $x=\\{(s,v)\\}$. Then $\Pi\circ\iota_{2}\circ\Psi(x)=\widetilde{f^{\prime}}_{2}\circ\iota_{2}\circ\Psi(x)=\widetilde{f^{\prime}}_{2}\circ\iota_{2}(\\{(\psi(s),\rho(v)+v_{0})\\})=\widetilde{f^{\prime}}_{2}(\\{(i_{2}\circ\psi(s),\rho(v)+v_{0})\\}=\\{(f_{2}\circ i_{2}\circ\psi(s),\rho^{-1}(\rho(v)+v_{0})+\rho^{-1}(v_{0}))\\}=\\{(f_{2}\circ i_{2}\circ\psi(s),v)\\}=\iota^{\prime}_{2}(x)$, as desired. ∎ ###### Remark 3.2. It is easy to see that generally $\widetilde{M}(\lambda)$ is not (weakly) equivariant homeomorphic to $M(\lambda^{\prime})$ except that $\rho$ is the identity of $\mathbb{Z}_{2}^{n}$. Also, clearly the definition of $\Psi$ depends on the auto-equivalence $(\psi,\rho)$ of $S$ and $v_{0}$, so we may write $\Psi$ as $\Psi(\psi,\rho,v_{0})$ to indicate this dependence. Now let us consider when $M(\lambda)$ and $M(\lambda^{\prime})$ are homeomorphic. ###### Definition 3.2. We say that $\Psi(\psi,\rho,v_{0})$ is extendable to a self-homeomorphism of $M_{2}$ if there is a self-homeomorphism $\widetilde{\Psi}:M_{2}\rightarrow M_{2}$ such that $\widetilde{\Psi}\circ\iota_{2}=\iota_{2}\circ\Psi$. ###### Theorem 3.2. If $\Psi(\psi,\rho,v_{0})$ is extendable to a self-homeomorphism of $M_{2}$, then $M(\lambda)$ is homeomorphic to $M(\lambda^{\prime})$. ###### Proof. Let $\widetilde{\Psi}:M_{2}\rightarrow M_{2}$ be a self-homeomorphism with $\widetilde{\Psi}\circ\iota_{2}=\iota_{2}\circ\Psi$. By Lemma 3.1, one may identify $M(\lambda^{\prime})$ with $\widetilde{M}(\lambda)=M_{1}\coprod M_{2}/\iota_{1}(x)\sim\iota_{2}(\Psi(x))$. Define $H:M(\lambda)\longrightarrow M(\lambda^{\prime})$ by $H(x)=\begin{cases}x&\text{if $x\in M_{1}\subset M(\lambda)$}\\\ \widetilde{\Psi}(x)&\text{if $x\in M_{2}\subset M(\lambda)$.}\end{cases}$ An easy observation shows that $H$ is a well-defined homeomorphism. ∎ ###### Remark 3.3. Take an automorphism $\widetilde{\psi}$ of $P_{2}$ such that $\widetilde{\psi}(i_{2}(S))=i_{2}(S)$. Then the restriction $\widetilde{\psi}|_{i_{2}(S)}$ gives an automorphism of $i_{2}(S)$. If we can choose $(\psi,\rho)$ with the property that $\psi\circ i_{2}=\widetilde{\psi}|_{i_{2}(S)}$ and $\rho\circ\lambda=\lambda\circ\widetilde{\psi}$, then it is easy to check that $(\widetilde{\psi},\rho)$ can induce a self-homeomorphism $\widetilde{\Psi}(\widetilde{\psi},\rho,v_{0})$ of $M_{2}$, which is defined by $\\{(p,v)\\}\longmapsto\\{(\widetilde{\psi}(p),\rho(v)+v_{0})\\}$, so that $\widetilde{\Psi}(\widetilde{\psi},\rho,v_{0})$ is an extension of $\Psi(\psi,\rho,v_{0})$. In this case, we see that $M(\lambda)$ is homeomorphic to $M(\lambda^{\prime})$. However, the condition $\rho\circ\lambda=\lambda\circ\widetilde{\psi}$ results in a little bit difficulty for the choice of $(\widetilde{\psi},\rho)$. Next let us further analyze $\Psi(\psi,\rho,v_{0})$. ###### Theorem 3.3. If $\Psi(\psi,\rho,v_{0})$ is isotopic to the identity, then $M(\lambda)$ is homeomorphic to $M(\lambda^{\prime})$. ###### Proof. Since the image of the embedding $i:S\rightarrow P$ does not contain any vertex of $P$, we can extend $i$ to an embedding $\widetilde{i}:S\times[-1,1]\rightarrow P$ such that $i=\widetilde{i}(\cdot,0)$ and each $\widetilde{i}(\cdot,t)$ is a sector. We can further assume that $\widetilde{i}(S\times[-1,0])\subset P_{1}$ and $\widetilde{i}(S\times[0,1])\subset P_{2}$. Now in the world of topology, $\widetilde{i}$ corresponds to an embedding $\widetilde{\iota}:\mathcal{S}\times[-1,1]\rightarrow M(\lambda)$ such that $\iota=\widetilde{\iota}(\cdot,0)$, and $\widetilde{\iota}(\mathcal{S}\times[0,1])\subset M_{2}$. Now let $\bar{\Psi}:\mathcal{S}\times[0,1]\rightarrow\mathcal{S}$ be an isotopy such that $\bar{\Psi}(\cdot,0)=\Psi$ and $\bar{\Psi}(\cdot,1)=\text{id}$. Then define $\widetilde{\Psi}:M_{2}\rightarrow M_{2}$ by $\widetilde{\Psi}(y)=\begin{cases}\widetilde{\iota}(\bar{\Psi}(x,t),t)&\text{if $y=\widetilde{\iota}(x,t)\in\text{Im}\widetilde{\iota}$}\\\ y&\text{if $y\not\in\text{Im}\widetilde{\iota}$.}\end{cases}$ One checks easily that $\widetilde{\Psi}$ is a self-homeomorphism of $M_{2}$ such that $\widetilde{\Psi}|_{\iota_{2}(\mathcal{S})}=\iota_{2}\circ\Psi$. Moreover, Theorem 3.3 follows by applying Theorem 3.2. ∎ ###### Definition 3.3. $\Psi(\psi,\rho,v_{0})$ is called a _good twist_ if $\Psi(\psi,\rho,v_{0})$ is isotopic to the identity. We note that the homeomorphism type of $M(\lambda^{\prime})$ doesn’t depend on the choice of $v_{0}$. So to apply Theorem 3.3 we can choose a suitable $v_{0}$ such that $\Psi(\psi,\rho,v_{0})$ meets the conditions. ###### Remark 3.4. The sector method above provides a way of how to construct a homeomorphism between two small covers $M(\lambda)\longrightarrow P$ and $M(\lambda^{\prime})\longrightarrow P^{\prime}$ regardless of whether $P$ is combinatorially equivalent to $P^{\prime}$ or not. In addition, the sector method also gives an approach of how to construct a new colored polytope $(P^{\prime},\lambda^{\prime})$ from $(P,\lambda)$ by the auot-equivalence $(\psi,\rho)$ at the sector $i:S\longrightarrow P$. ## 4\. Application to prisms: Rectangular Sector Method The objective of this section is to give the application of the sector method to prisms. Let $\mathrm{P}^{3}(m)$ denote a 3-dimensional prism that is the product of $[0,1]$ and an $m$-gon where $m\geq 3$. When $m\neq 4$, let $c,f$ (the _ceiling_ and the _floor_) be the two 2-faces of $\mathrm{P}^{3}(m)$ that are $m$-gons. For the 3-cube (i.e., $m=4$), we specify two opposite 2-faces and distinguish them as ceiling and floor. For convenience, we identify other 2-faces (i.e., side 2-faces) with $s_{1},...,s_{m}$ in the natural way. Let $\Lambda(\mathrm{P}^{3}(m))=\\{\lambda\big{|}\lambda\text{ is a ${\mathbb{Z}}_{2}^{3}$-coloring on $\mathrm{P}^{3}(m)$}\\}.$ ### 4.1. Rectangular sector Generally, any polygon can become a sector in the setting of all 3-polytopes. However, here we shall put attention on rectangular sectors because this will be sufficient enough to the classification of all small covers over prisms. Throughout the following, choose the rectangle $S=\\{(x,y)\in\mathbb{R}^{2}\big{|}|x|\leq 1,|y|\leq 1\\}$ in a plane $\mathbb{R}^{2}$. Clearly $S$ can always be embedded as a sector in any $\mathbb{Z}_{2}^{3}$-colored simple 3-polytope $(P^{3},\lambda)$. Fix $\\{e_{1},e_{2},e_{3}\\}$ as a basis of $\mathbb{Z}_{2}^{3}$, then it is easy to see that up to Davis-Januszkiewicz equivalence, all possible derived colorings $\bar{\lambda}:\mathcal{F}(S)\longrightarrow\mathbb{Z}_{2}^{3}$ and corresponding sector manifolds $\mathcal{S}$ can be stated as follows: | top edge | left edge | bottom edge | right edge | sector manifold $\mathcal{S}$ ---|---|---|---|---|--- $\bar{\lambda}_{1}$ | $e_{1}$ | $e_{2}$ | $e_{1}$ | $e_{2}$ | union of 2 tori $\bar{\lambda}_{2}$ | $e_{1}$ | $e_{2}$ | $e_{1}+e_{2}$ | $e_{2}$ | union of 2 Klein bottles $\bar{\lambda}_{3}$ | $e_{1}$ | $e_{2}$ | $e_{3}$ | $e_{2}$ | torus $\bar{\lambda}_{4}$ | $e_{3}$ | $e_{1}$ | $e_{1}+e_{3}$ | $e_{2}$ | Klein bottle $\bar{\lambda}_{5}$ | $e_{3}$ | $e_{1}$ | $e_{1}+e_{2}+e_{3}$ | $e_{2}$ | torus It is well-known that the symmetric group $\mathrm{Aut}(S)$ of $S$ as a 4-gon is isomorphic to the dihedral group $\mathcal{D}_{4}$ of order 8, which just contains four reflections. Clearly, each reflection of $S$ may be expressed as a matrix. For example, the reflection along $y$-axis can be written as $\text{diag}(-1,1)$, and the reflection along $x$-axis can be written as $\text{diag}(1,-1)$. ### 4.2. Construction of new colored polytopes from $(\mathrm{P}^{3}(m),\lambda)$ Given a pair $(\mathrm{P}^{3}(m),\lambda)$ in $\Lambda(\mathrm{P}^{3}(m))$. We use the convention that all embedded rectangular sectors of $(\mathrm{P}^{3}(m),\lambda)$ used here are always orthogonal to the ceiling and floor of $\mathrm{P}^{3}(m)$. Given such a sector $i:S\longrightarrow\mathrm{P}^{3}(m)$ (note: here we don’t need that $i$ must map the top edge and the bottom edge of $S$ into the ceiling and the floor of $\mathrm{P}^{3}(m)$, respectively), it is easy to see that there are two side faces $s_{k},s_{l}$ $(k\neq l$ and $k<l)$ such that $S\longrightarrow\mathrm{P}^{3}(m)$ is essentially determined by $s_{k}$ and $s_{l}$ and it is called the sector _at_ $s_{k},s_{l}$ and is denoted by $i(k,l)$, where $S=\\{(x,y)\in\mathbb{R}^{2}\big{|}|x|\leq 1,|y|\leq 1\\}$. Let $P_{1}$ and $P_{2}$ be two prisms cut out by $i(k,l):S\longrightarrow\mathrm{P}^{3}(m)$ from $\mathrm{P}^{3}(m)$. Throughout the following, one also uses the convention that $P_{2}$ contains side faces $s_{k},...,s_{l}$ of $\mathrm{P}^{3}(m)$. Now, using the sector method we discuss how to construct new colored 3-polytopes $(\mathrm{P}^{\prime},\lambda^{\prime})$ from $(\mathrm{P}^{3}(m),\lambda)$ by auto-equivalences $(\psi,\rho)$ at the sector $i(k,l):S\longrightarrow\mathrm{P}^{3}(m)$. For our purpose, we wish that (1) $\mathrm{P}^{\prime}$ is still combinatorially equivalent to $\mathrm{P}^{3}(m)$, and (2) $\Psi(\psi,\rho,v_{0})$ is a good twist, so that each $M(\lambda^{\prime})$ is homeomorphic to $M(\lambda)$ by Theorem 3.3. This will depend upon the choices of $\psi$ and $\rho$. Actually, the construction of $\mathrm{P}^{\prime}$ depends upon the choice of $\psi$, and the definition of $\lambda^{\prime}$ depends upon the choice of $\rho$. In particular, $v_{0}$ will provide a convenience for the choices of $(\psi,\rho)$. Convention: $\psi=\text{\rm diag}(-1,1)$ or $\text{\rm diag}(1,1)$ means that $i(k,l)$ maps the top edge and the bottom edge of $S$ into the ceiling and the floor of $\mathrm{P}^{3}(m)$, respectively, and $\psi=\text{\rm diag}(1,-1)$ means that $i(k,l)$ maps the left edge and the right edge of $S$ into the ceiling and the floor of $\mathrm{P}^{3}(m)$, respectively. ###### Lemma 4.1. If $\psi=\text{\rm diag}(-1,1)$ or $\text{\rm diag}(1,-1)$ or $\text{\rm diag}(1,1)$, then we can construct a new polytope $\mathrm{P}^{\prime}$ from $\mathrm{P}^{3}(m)$ by $\psi$ at the sector $i(k,l):S\longrightarrow\mathrm{P}^{3}(m)$ such that $\mathrm{P}^{\prime}$ is combinatorially equivalent to $\mathrm{P}^{3}(m)$. ###### Proof. The case $\psi=\text{\rm diag}(1,1)$ is trivial. Actually, in this case we can just choose $P^{\prime}_{r}=P_{r}$ and let $f_{r}:P_{r}\longrightarrow P^{\prime}_{r}$ be the identity, where $r=1,2$. If $\psi=\text{diag}(-1,1)$, to construct $\mathrm{P}^{\prime}$, we first choose $P^{\prime}_{1}=P_{1}$ and $f_{1}$ as the identity from $P_{1}\longrightarrow P^{\prime}_{1}$, and then choose $P^{\prime}_{2}$ as the image of mirror reflection $R$ of $P_{2}$ along a 2-plane $H$ orthogonal to the ceiling and floor of $P_{2}$ with $H\cap P_{2}=\emptyset$ (i.e., intuitively $P^{\prime}_{2}$ is obtained by reserving the ordering of the side faces $s_{k},...,s_{l}$ of $P_{2}$) and $f_{2}$ as the homeomorphism induced by the reflection $R$, as shown in the following figure. Now, we clearly see that $\mathrm{P}^{\prime}$ can be defined as $P_{1}\coprod P^{\prime}_{2}/i_{1}(s)\sim f_{2}\circ i_{2}\circ\psi(s)$, which is combinatorially equivalent to $\mathrm{P}^{3}(m)$. In a similar way, we can prove the case $\psi=\text{diag}(1,-1)$. ∎ Now suppose that $\mathrm{P}^{\prime}$, which is just constructed from $\mathrm{P}^{3}(m)$ by a $\psi$ at the sector $i(k,l):S\longrightarrow\mathrm{P}^{3}(m)$, is combinatorially equivalent to $\mathrm{P}^{3}(m)$. Then, as stated in Section 3, we can use $\rho$ to give a coloring $\lambda^{\prime}$ on $\mathrm{P}^{\prime}$ as long as $\rho$ satisfies the equation $\rho\circ\bar{\lambda}=\bar{\lambda}\circ\psi$. To guarantee that $M(\lambda^{\prime})$ is homeomorphic to $M(\lambda)$, we need choose $(\psi,\rho)$ carefully such that $\Psi(\psi,\rho,v_{0})$ is a good twist. Based upon the possible values of $\bar{\lambda}$ (see the table above), we find some good twists and list them as follows: Sector | $(S,\bar{\lambda})$ | $\Psi(\psi,\rho,v_{0})$ | $\psi$ | $\rho(e_{1})$ | $\rho(e_{2})$ | $\rho(e_{3})$ | $v_{0}$ ---|---|---|---|---|---|---|--- $S(1)$ | $(S,\bar{\lambda}_{1})$ | $\Psi(\psi_{1},\rho_{1},v_{0}^{(1)})$ | $\text{diag}(1,-1)$ | $e_{1}$ | $e_{2}$ | $e_{3}$ | $e_{1}$ $S(2_{1})$ | $(S,\bar{\lambda}_{2})$ | $\Psi(\psi_{21},\rho_{21},v_{0}^{(21)})$ | $\text{diag}(1,1)$ | $e_{1}$ | $e_{2}$ | $e_{3}+e_{2}$ | $0$ $S(2_{2})$ | $(S,\bar{\lambda}_{2})$ | $\Psi(\psi_{22},\rho_{22},v_{0}^{(22)})$ | $\text{diag}(1,-1)$ | $e_{1}+e_{2}$ | $e_{2}$ | $e_{3}$ | $e_{1}$ $S(3_{1})$ | $(S,\bar{\lambda}_{3})$ | $\Psi(\psi_{31},\rho_{31},v_{0}^{(31)})$ | $\text{diag}(-1,1)$ | $e_{1}$ | $e_{2}$ | $e_{3}$ | $e_{2}$ $S(3_{2})$ | $(S,\bar{\lambda}_{3})$ | $\Psi(\psi_{32},\rho_{32},v_{0}^{(32)})$ | $\text{diag}(1,-1)$ | $e_{3}$ | $e_{2}$ | $e_{1}$ | $e_{1}$ $S(4)$ | $(S,\bar{\lambda}_{4})$ | $\Psi(\psi_{4},\rho_{4},v_{0}^{(4)})$ | $\text{diag}(1,-1)$ | $e_{1}$ | $e_{2}$ | $e_{3}+e_{1}$ | $e_{3}$ $S(5)$ | $(S,\bar{\lambda}_{5})$ | $\Psi(\psi_{5},\rho_{5},v_{0}^{(5)})$ | $\text{diag}(-1,1)$ | $e_{2}$ | $e_{1}$ | $e_{3}$ | $e_{1}$ ###### Remark 4.1. It should be pointed out that we have not listed all such good twists. At least we omit compositions of good twists that have already appeared in the above table. However, as we shall see, those good twists listed above are sufficient in the further applications. Here we only give a detailed argument of $S(1)$ because all other cases can be checked similarly. In $S(1)$, we know that $\mathcal{S}={[-1,1]}^{2}\times\mathbb{Z}_{2}^{3}/\sim$ is the disjoint union of two tori. Then we can write $\mathcal{S}=\\{(z_{1},z_{2},\alpha)\big{|}z_{k}\in S^{1}\subset{\mathbb{C}},k=1,2,\alpha\in\\{0,1\\}\\}$, such that for $\mathbf{x}=\\{((x_{1},x_{2}),v=a_{1}e_{2}+a_{2}e_{1}+a_{3}e_{3})\\}\in\mathcal{S}$, there is the following one-one correspondence $z_{k}(\mathbf{x})=\begin{cases}\mathrm{exp}(\mathbf{i}x_{k}\pi/2)&\text{ if }a_{k}=0\\\ \mathrm{exp}(\mathbf{i}(\pi-x_{k}\pi/2))&\text{ if }a_{k}\neq 0\end{cases}$ for $k=1,2$ and $\alpha(\mathbf{x})=a_{3}$. Now we consider the map $\Psi(\psi,\rho,v_{0})$ where $\psi(x_{1},x_{2})=(x_{1},-x_{2})$, $\rho=\text{id}$ and $v_{0}=e_{1}$. An easy computation yields that $\Psi(z_{1},z_{2},\alpha)=(z_{1},-z_{2},\alpha)$, which is clearly isotopic to the identity via the homotopy $((z_{1}$, $z_{2}$, $\alpha),t)$$\mapsto$$(z_{1}$, $z_{2}\mathrm{exp}({\mathbf{i}\pi t})$, $\alpha)$ where $t\in[0,1]$. Thus $\Psi(\psi,\rho,v_{0})$ is a good twist. ## 5\. Operations on coloring sequences and canonical forms Now we apply the developed rectangular sector method to study small covers over prisms. Given a pair $(\mathrm{P}^{3}(m),\lambda)$ in $\Lambda(\mathrm{P}^{3}(m))$ and a sector $i(k,l):S\longrightarrow\mathrm{P}^{3}(m)$. We have known how to construct a $(\mathrm{P}^{\prime},\lambda^{\prime})$ from $(\mathrm{P}^{3}(m),\lambda)$ by an auto-equivalence $(\psi,\rho)$ at the sector $S\longrightarrow\mathrm{P}^{3}(m)$. Indeed, by Lemma 4.1, if $\psi=\text{id}$ or $\text{\rm diag}(-1,1)$ or $\text{\rm diag}(1,-1)$, then $\mathrm{P}^{\prime}$ is also a $\mathrm{P}^{3}(m)$ with the same ceiling and floor coloring, and $\lambda^{\prime}$ has the same side coloring sequence as $\lambda$ on sides faces from $s_{l+1}$ to $s_{k-1}$. For $k\leq r\leq l$, if $\psi=\text{id}$, then $\lambda^{\prime}(s_{r})=\rho^{-1}\lambda(s_{r})$; if $\psi=\text{\rm diag}(-1,1)$ or $\text{\rm diag}(1,-1)$, $\lambda^{\prime}(s_{r})=\rho^{-1}\lambda(s_{k+l-r})$, that is, we reflect the sequence from $s_{k}$ to $s_{l}$ and apply the linear transformation $\rho$. By Theorem 3.3, when the derived coloring $\bar{\lambda}$ of the sector at $s_{k},s_{l}$ and $(\psi,\rho)$ match a case in the table of last section, we can conclude that $M(\lambda^{\prime})$ is homeomorphic to $M(\lambda)$. Thus we can reduce $(\mathrm{P}^{3}(m),\lambda)$ to $(\mathrm{P}^{3}(m),\lambda^{\prime})$ without changing the homeomorphism type of the small cover. In this case, both $(\mathrm{P}^{3}(m),\lambda)$ and $(\mathrm{P}^{3}(m),\lambda^{\prime})$ are said to be sector-equivalent, denoted by $(\mathrm{P}^{3}(m),\lambda)\approx(\mathrm{P}^{3}(m),\lambda^{\prime})$ or simply $\lambda\approx\lambda^{\prime}$. Based upon this rectangular sector method, we shall show that $\Lambda(\mathrm{P}^{3}(m))$ contains some basic colored pairs, called “canonical forms”, such that any pair in $\Lambda(\mathrm{P}^{3}(m))$ is sector-equivalent to one of canonical forms. This means that up to homeomorphism, those canonical forms determine all small covers over $\mathrm{P}^{3}(m)$. For a convenience, after fixing the colorings of ceiling and floor, we use the convention that a coloring on $\mathrm{P}^{3}(m)$ will simply be described as a sequence by writing its side face colorings in order, keeping in mind that the first one is next to the last. ###### Definition 5.1. A coloring $\lambda\in\lambda(\mathrm{P}^{3}(m))$ is said to be _2-independent_ if all $\lambda(s_{i}),i=1,...,m$, span a 2-dimensional subspace of $\mathbb{Z}_{2}^{3}$; otherwise it’s said to be _3-independent_. If $\lambda(c)=\lambda(f)$, then $\lambda$ is said to be _trivial_ ; otherwise _nontrivial_. The argument is divided into two cases: (i) $\lambda$ is trivial; (ii) $\lambda$ is nontrivial. ### 5.1. Trivial colorings Given a pair $(\mathrm{P}^{3}(m),\lambda)$ in $\Lambda(\mathrm{P}^{3}(m))$, throughout the following suppose that $\lambda$ is trivial with $\lambda(c)=\lambda(f)=e_{1}$. Let $\\{\alpha,\beta,e_{1}\\}$ be a basis of $\mathbb{Z}_{2}^{3}$, and let $\gamma=\alpha+\beta$. Write $\bar{\alpha}=\alpha+e_{1}$, $\bar{\beta}=\beta+e_{1}$ and $\bar{\gamma}=\gamma+e_{1}$. We say that $\lambda$ satisfies the property $(\star)$ if all three letters $\alpha,\beta,\gamma$ (with or without bar we don’t care) appear in its coloring sequence. Applying sectors $S(1),S(2_{1}),S(2_{2})$ and $S(3_{2})$ to the trivial coloring $\lambda$ gives the following four fundamental operations on its coloring sequence $(\lambda(s_{1}),...,\lambda(s_{m}))$: 1. $\text{O}_{1}$ Take two side faces $s_{k},s_{l}$ $(k<l)$ with the same coloring and then use $S(1)$ to reflect the coloring sequence of $s_{k},s_{k+1},...,s_{l}$. 2. $\text{O}_{21}$ Take two faces $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k})=\lambda(s_{l})+\lambda(c)$ (without loss of generality, assume that $\\{\lambda(s_{k}),\lambda(s_{l})\\}=\\{\alpha,\bar{\alpha}\\}$), and then by using $S(2_{1})$, we can do a linear transform $(e_{1},\alpha,\beta)\mapsto(e_{1},\alpha,\bar{\beta})$ to change the coloring sequence of $s_{k},s_{k+1},...,s_{l}$. 3. $\text{O}_{22}$ Take two faces $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k})=\lambda(s_{l})+\lambda(c)$ and $\\{\lambda(s_{k}),\lambda(s_{l})\\}=\\{\alpha,\bar{\alpha}\\}$ as above, then by using $S(2_{2})$ we can reflect the coloring sequence of $s_{k},s_{k+1},...,s_{l}$ and do a linear transform $(e_{1},\alpha,\beta)\mapsto(e_{1},\bar{\alpha},\beta)$ to change the reflected coloring sequence. 4. $\text{O}_{32}$ Take $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k}),\lambda(s_{l}),e_{1}$ independent, and then by using $S(3_{2})$ we can reflect the coloring sequence of $s_{k},s_{k+1},..,s_{l}$ and do a linear transform $(\lambda(s_{k}),\lambda(s_{l}),e_{1})\mapsto(\lambda(s_{l}),\lambda(s_{k}),e_{1})$ to change the reflected coloring sequence. ###### Lemma 5.1. The trivial coloring $\lambda$ with the property $(\star)$ is always sector- equivalent to a coloring whose coloring sequence contains only one of both $\mathrm{\gamma}$ and $\mathrm{\bar{\gamma}}$. ###### Proof. Let $\widetilde{\gamma}=\gamma$ or $\bar{\gamma}$. With no loss, assume that the time number $\ell$ of $\widetilde{\gamma}$ appearing in the coloring sequence of $\lambda$ is greater than one. Up to Davis-Januszkiewicz equivalence, one also may assume that $\ell<m/2$. By the definition of $\lambda$, it is easy to see that any two $\widetilde{\gamma}$’s in the coloring sequence cannot become neighbors. Let $\widetilde{\gamma},x_{1},...,x_{r},\widetilde{\gamma},y$ with $x_{i},y\not=\widetilde{\gamma}$ be a subsequence of the coloring sequence. If $r>1$, we proceed as follows: 1. (1) When $x_{1}=y$, by doing the operation $\text{O}_{1}$ on $x_{1},...,x_{r},\widetilde{\gamma},y$, we may only change the subsequence $\widetilde{\gamma},x_{1},...,x_{r},\widetilde{\gamma},y$ into $\widetilde{\gamma},y,\widetilde{\gamma},x_{r},...,x_{1}$ in the coloring sequence, and the value of $\ell$ is unchanged. 2. (2) When $x_{1}-y=e_{1}$, with no loss one may assume that $x_{1}={\alpha},y={\bar{\alpha}}$. Then by doing the operation $\text{O}_{22}$ on $x_{1}=\alpha,x_{2},...,x_{r},\widetilde{\gamma},y={\bar{\alpha}}$, we may only change the subsequence $\widetilde{\gamma},\alpha,x_{2},...,x_{r},\widetilde{\gamma},{\bar{\alpha}}$ into $\widetilde{\gamma},\alpha,\widetilde{\gamma},x^{\prime}_{r},...,x^{\prime}_{2},\bar{\alpha}$ with $x^{\prime}_{i}\not=\widetilde{\gamma}$, and the value of $\ell$ is unchanged. 3. (3) When $x_{1},y,e_{1}$ are linearly independent, with no loss one may assume that $x_{1}=\alpha,y=\beta$. Then by doing the operation $\text{O}_{32}$ on $x_{1}=\alpha,x_{2},...,x_{r}$, $\widetilde{\gamma},y=\beta$, we may only change the subsequence $\widetilde{\gamma},\alpha,x_{2},...,x_{r},\widetilde{\gamma},\beta$ into $\widetilde{\gamma}$, $\alpha$, $\widetilde{\gamma},x^{\prime}_{r},...,x^{\prime}_{2},\beta$ with $x^{\prime}_{i}\not=\widetilde{\gamma}$, and the value of $\ell$ is unchanged. Thus, we may reduce the coloring $\lambda$ to another coloring with the following coloring sequence (5.1) $(\widetilde{\gamma},y_{1},\widetilde{\gamma},y_{2},...,\widetilde{\gamma},y_{\ell-1},\widetilde{\gamma},y_{\ell},z_{1},...,z_{m-2\ell})\text{ with }m-2\ell>0.$ Without loss of generality, one may assume that $y_{\ell-1}=\alpha$. If $y_{\ell}=\beta$ or $\bar{\beta}$, by doing the operation $\text{O}_{32}$ on $\widetilde{\gamma},y_{\ell-1},\widetilde{\gamma},y_{\ell}$, one may change $\widetilde{\gamma},y_{\ell-1},\widetilde{\gamma},y_{\ell}$ into $\widetilde{\gamma},y_{\ell},y_{\ell-1},y_{\ell}$, so that the coloring sequence (5.1) is reduced to $(\widetilde{\gamma}$, $y_{1}$, $\widetilde{\gamma}$, $y_{2},...$, $\widetilde{\gamma},y_{\ell-2}$, $\widetilde{\gamma}$, $y_{\ell},y_{\ell-1},y_{\ell}$, $z_{1},...,z_{m-2\ell})$. If $y_{\ell}=\alpha$ or $\bar{\alpha}$, then $z_{1}=\beta$ or $\bar{\beta}$. By doing the operation $\text{O}_{32}$ on $\widetilde{\gamma},y_{\ell-1},\widetilde{\gamma},y_{\ell},z_{1}$, one may change $\widetilde{\gamma},y_{\ell-1},\widetilde{\gamma},y_{\ell},z_{1}$ into $\widetilde{\gamma},y_{\ell},z_{1},y_{\ell-1},z_{1}$, so that the coloring sequence (5.1) is reduced to $(\widetilde{\gamma}$, $y_{1}$, $\widetilde{\gamma}$, $y_{2},...$, $\widetilde{\gamma},y_{\ell-2}$, $\widetilde{\gamma}$, $y_{\ell},z_{1},y_{\ell-1}$, $z_{1},...,z_{m-2\ell})$. So we have managed to reduce the number $\ell$ of $\widetilde{\gamma}$’s by 1. We can continue this process until we reach $\ell=1$, as desired. ∎ Now let us determine the “canonical form” of the trivial coloring $\lambda$ on $\mathrm{P}^{3}(m)$. First let us consider the case in which $\lambda$ is 2-independent ###### Proposition 5.2. Suppose that $\lambda$ is 2-independent. Then 1. (1) If $\lambda$ doesn’t possess the property $(\star)$, then $m$ is even and $\lambda$ is sector-equivalent to the canonical form $\lambda_{C_{1}}$ with the coloring sequence $\mathcal{C}_{1}=(\alpha$, $\beta,$$...,\alpha,\beta)$. 2. (2) If $\lambda$ possesses the property $(\star)$, then $\lambda$ is sector- equivalent to one of the following two canonical forms: $\mathrm{(a)}$ $\lambda_{C_{2}}$ with $m$ even and with the coloring sequence $\mathcal{C}_{2}=(\alpha,\gamma,\alpha,\beta,...,\alpha,\beta)$; $\mathrm{(b)}$ $\lambda_{C_{3}}$ with $m$ odd and with the coloring sequence $\mathcal{C}_{3}=(\alpha,\gamma,\beta,\alpha,\beta,...,\alpha,\beta)$. ###### Proof. If $\lambda$ doesn’t possess the property $(\star)$, then it is easy to see that $\lambda$ is unique up to Davis-Januszkiewicz equivalence and $m$ is even. So Proposition 5.2(1) follows from this. By Lemma 5.1, an easy observation shows that Proposition 5.2(2) holds. ∎ Next let us consider the case in which $\lambda$ is 3-independent. ###### Proposition 5.3. If $\lambda$ is 3-independent without the property $(\star)$, then $m$ is even and $\lambda$ is sector-equivalent to the canonical form $\lambda_{C_{4}}$ with the coloring sequence $\mathcal{C}_{4}=(\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta)$. ###### Proof. Without loss of generality assume that each element in the coloring sequence $\mathcal{C}$ of $\lambda$ is in the set $\\{\alpha,\beta,\bar{\alpha},\bar{\beta}\\}$ and that both $\alpha$ and $\bar{\alpha}$ must appear in $\mathcal{C}$. Since $\alpha$ and $\bar{\alpha}$ (or $\beta$ and $\bar{\beta}$) can become neighbors, one has that $m$ must be even. Similarly to the argument of Lemma 5.1, by using the operations $\text{O}_{1}$ and $\text{O}_{22}$, we may reduce $\lambda$ to a coloring with the coloring sequence (5.2) $(\bar{\alpha},x_{1},...,\bar{\alpha},x_{r},\alpha,x_{r+1},...,{\alpha},x_{{m\over 2}})$ where $r\geq 1$ and $x_{i}=\beta$ or $\bar{\beta}$, and this reduction doesn’t change the number of bars on $\alpha$’s. If $r>1$, by doing the operation $\text{O}_{22}$ on $\bar{\alpha},x_{r-1},\bar{\alpha},x_{r},\alpha$, we may reduce the sequence (5.2) to $(\bar{\alpha},x_{1},...,\bar{\alpha},x_{r-2},\bar{\alpha},x_{r},\alpha,x_{r-1},\alpha,x_{r+1},...,{\alpha},x_{{m\over 2}}),$ reducing the number of bars on $\alpha$’s by one. This process can be carried out until the sequence (5.2) is reduced to (5.3) $(\bar{\alpha},x_{r},\alpha,x_{1},...,{\alpha},x_{r-2},\alpha,x_{r-1},\alpha,x_{r+1},...,{\alpha},x_{{m\over 2}}).$ Next, we claim that by using the operation $\text{O}_{21}$, we may remove all possible bars on $\beta$’s in the sequence (5.3). In fact, if $x_{r}=\bar{\beta}$, then applying the operation $\text{O}_{21}$ on $\bar{\alpha},x_{r},\alpha$, we may remove the bar on $x_{r}$. Generally, with no loss, one may assume that $x_{j}=\bar{\beta}$ and $x_{r}=x_{l}=\beta$ where $l\in\\{1,...,j-1\\}$ if $j\leq r+1$ and $j\not=r$, and $l\in\\{1,...,r-1,r+1,...,j-1\\}$ if $j>r+1$. Applying the operation $\text{O}_{21}$ on $\bar{\alpha},x_{r},...,\alpha,x_{j}=\bar{\beta},\alpha$, one may remove the bar on $x_{j}=\bar{\beta}$, but add the bar on $x_{r}$ and $x_{l}$’s. Again applying the operation $\text{O}_{21}$ on $\bar{\alpha},\bar{x}_{r},...,\alpha,\bar{x}_{l},...,\alpha,\bar{x}_{j-1},\alpha$, one may remove all bars on $\bar{x}_{r}$ and $\bar{x}_{l}$’s. Thus, by carrying on this procedure, the above claim holds. This completes the proof. ∎ ###### Proposition 5.4. If $\lambda$ is 3-independent with the property $(\star)$ and $m>4$, then $\lambda$ is sector-equivalent to one of the following six canonical forms: 1. (1) $\lambda_{C_{5}}$ with $m$ odd and with the coloring sequence $\mathcal{C}_{5}=(\bar{\gamma},\alpha,\beta,...,\alpha,\beta).$ 2. (2) $\lambda_{C_{6}}$ with $m$ odd and with the coloring sequence $\mathcal{C}_{6}=(\bar{\gamma},\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta).$ 3. (3) $\lambda_{C_{7}}$ with $m$ odd and with the coloring sequence $\mathcal{C}_{7}=({\gamma},\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta).$ 4. (4) $\lambda_{C_{8}}$ with $m$ even and with the coloring sequence $\mathcal{C}_{8}=(\bar{\alpha},\gamma,\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta).$ 5. (5) $\lambda_{C_{9}}$ with $m$ even and with the coloring sequence $\mathcal{C}_{9}=(\alpha,\gamma,\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta).$ 6. (6) $\lambda_{C_{10}}$ with $m$ even and with the coloring sequence $\mathcal{C}_{10}=(\alpha,\bar{\gamma},\alpha,\beta,...,\alpha,\beta).$ ###### Proof. By Lemma 5.1, one may assume that $\widetilde{\gamma}(=\gamma$ or $\bar{\gamma})$ appears only one time in the coloring sequence $\mathcal{C}$ of $\lambda$. Case (I): $m$ is odd. If only one of both $\alpha$ and $\bar{\alpha}$ appears in $\mathcal{C}$ and the same thing also happens for both $\beta$ and $\bar{\beta}$, then $\widetilde{\gamma}$ must be $\bar{\gamma}$ so $\mathcal{C}$ is just $\mathcal{C}_{5}$. Otherwise we can carry out our argument as in Proposition 5.3 on the subsequence in $\mathcal{C}$ of containing no $\widetilde{\gamma}$, so that $\mathcal{C}$ is sector-equivalent to $\mathcal{C}_{6}$ or $\mathcal{C}_{7}$. Case (II): $m$ is even. Consider two neighbors of $\widetilde{\gamma}$, since $m$ is even, such two neighbors must be the same letter. Up to Davis- Januszkiewicz equivalence, one may assume that they are $\\{\alpha,{\alpha}\\}$ or $\\{\alpha,\bar{\alpha}\\}$. If two neighbors of $\widetilde{\gamma}$ are $\\{\alpha,\bar{\alpha}\\}$, with no loss assume that $\mathcal{C}=(\alpha,\widetilde{\gamma},\bar{\alpha},x_{4},...,x_{m})$. Then we can carry out our argument as in Proposition 5.3 on $\bar{\alpha},x_{4},...,x_{m}$, so that $\mathcal{C}$ may be reduced to $\mathcal{C}^{\prime}=(\alpha,\widetilde{\gamma},\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta)$. If $\widetilde{\gamma}=\gamma$, then $\mathcal{C}^{\prime}$ is just $\mathcal{C}_{8}$. If $\widetilde{\gamma}=\bar{\gamma}$, applying the operation $\text{O}_{22}$ on $\alpha,\bar{\gamma},\bar{\alpha}$, one may further reduce $\mathcal{C}^{\prime}$ to $\mathcal{C}_{9}$. Now suppose that two neighbors of $\widetilde{\gamma}$ are $\\{\alpha,{\alpha}\\}$. If $\mathcal{C}$ only contains $\alpha$ and $\beta$ except for $\widetilde{\gamma}$, then $\mathcal{C}$ is just $\mathcal{C}_{10}$. Otherwise, with no loss assume that $\mathcal{C}$ also contains $\bar{\alpha}$. Up to Davis-Januszkiewicz equivalence, by using the linear transformation $(e_{1},\alpha,\beta)\longmapsto(e_{1},\bar{\alpha},\beta)$ one may write $\mathcal{C}=(\bar{\alpha},\widetilde{\gamma},\bar{\alpha},x_{4},...,x_{m})$. Furthermore, Then we can carry out our argument as in Proposition 5.3 to reduce $\mathcal{C}$ to $(\bar{\alpha},\widetilde{\gamma},\bar{\alpha},\beta,\alpha,\beta,...,\alpha,\beta)$. If $\widetilde{\gamma}$ is not $\gamma$, applying the operation $\text{O}_{22}$ on $\alpha,\bar{\gamma},\bar{\alpha}$, one may further reduce $\mathcal{C}^{\prime}$ to $\mathcal{C}_{8}$. ∎ ###### Remark 5.1. An easy observation shows that for a 3-independent trivial coloring $\lambda$ with the property $(\star)$, if $m=3$, then $\lambda$ is just sector- equivalent to the following canonical form $\lambda_{C^{3}}\text{ with the coloring sequence }\mathcal{C}^{3}=(\bar{\gamma},\alpha,\beta)$ and if $m=4$, then $\lambda$ is just sector-equivalent to one of the following two canonical forms 1. (1) $\lambda_{C_{1}^{4}}$ with the coloring sequence $\mathcal{C}_{1}^{4}=(\alpha,\gamma,\bar{\alpha},\beta).$ 2. (2) $\lambda_{C_{2}^{4}}$ with the coloring sequence $\mathcal{C}_{2}^{4}=(\alpha,\bar{\gamma},\alpha,\beta).$ Combining Propositions 5.2-5.4 and Remark 5.1 gives the following ###### Corollary 5.5. The number of homeomorphism classes of small covers over $\mathrm{P}^{3}(m)$ with trivial colorings is at most $N_{t}(m)=\begin{cases}2&\text{ if }m=3\\\ 4&\text{ if $m>3$ is odd}\\\ 6&\text{ if $m$ is even}\end{cases}$ By Proposition 2.5, a direct observation shows that ###### Corollary 5.6. $M(\lambda_{C_{i}}),i=1,5,10$, are orientable, and $M(\lambda_{C_{i}}),i=2,3,4,6,7,8,9$, are non-orientable. ### 5.2. Nontrivial Prism Small Covers Given a pair $(\mathrm{P}^{3}(m),\lambda)$ in $\Lambda(\mathrm{P}^{3}(m))$, throughout suppose that $\lambda$ is nontrivial, i.e., $\lambda(c)\not=\lambda(f)$. ###### Definition 5.2. Let $M_{\lambda}=\\{s_{i}\big{|}\text{Span}\\{\lambda(s_{i-1}),\lambda(s_{i}),\lambda(s_{i+1})\\}=\mathbb{Z}_{2}^{3}\\}$ and let $m_{\lambda}:=|M_{\lambda}|$ denote the number of side faces in $M_{\lambda}$. Set $\lambda_{0}:=\lambda(c)-\lambda(f)$. Let $N_{\lambda}=\\{s_{i}\big{|}\lambda(s_{i})=\lambda_{0}\\}$, and let $n_{\lambda}:=|N_{\lambda}|$ denote the number of side faces in $N_{\lambda}$. ###### Lemma 5.7. Let $\lambda$ be a nontrivial coloring on $\mathrm{P}^{3}(m)$ with $m>3$. Then 1. (1) $m_{\lambda}\leq n_{\lambda}\leq m/2$. In particular, if $m$ is odd, then $n_{\lambda}>0$. 2. (2) $m_{\lambda}$ is even. ###### Proof. First, $n_{\lambda}\leq m/2$ is obvious since any two faces in $N_{\lambda}$ are not adjacent. To show that $m_{\lambda}\leq n_{\lambda}$, take one $s_{i}\in N_{3}$. Then $\lambda(s_{i-1}),\lambda(s_{i}),\lambda(s_{i+1})$ are linearly independent. Furthermore, the linear independence of $\\{\lambda(s_{i-1}),\lambda(s_{i}),\lambda(c)\\}$ and $\\{\lambda(s_{i}),\lambda(s_{i+1}),\lambda(c)\\}$ implies that $\lambda(c)$ must be either $\lambda(s_{i-1})+\lambda(s_{i+1})$ or $\lambda(s_{i-1})+\lambda(s_{i})+\lambda(s_{i+1})$. This is also true for $\lambda(f)$. Now $\lambda(c)\neq\lambda(f)$ makes sure that $\lambda(c)-\lambda(f)=\lambda(s_{i})$, so that $s_{i}\in N_{\lambda}$. Thus, $M_{\lambda}\subseteq N_{\lambda}$, i.e., $m_{\lambda}\leq n_{\lambda}$. Moreover, if $n_{\lambda}=0$ then $m_{\lambda}=0$, so that the coloring sequence of $\lambda$ is 2-independent. However, $n_{\lambda}=0$ means that one has only two choices of colors. This forces $m$ to be even. With no loss, assume that $m_{\lambda}>0$ (since $0$ is even). For each $i$, let $V_{i}$ denote the subspace spanned by $\lambda(s_{i})$ and $\lambda(s_{i+1})$. Obviously, if $s_{i}\in M_{\lambda}$ then $V_{i}\not=V_{i-1}$, and if $s_{i}\not\in M_{\lambda}$ then $V_{i}=V_{i-1}$. Thus, $s_{i}\in M_{\lambda}$ if and only if $V_{i}\not=V_{i-1}$. Next we claim that for any $i$, $\lambda_{0}\in V_{i}$. In fact, if $s_{i}\in M_{\lambda}$, since $M_{\lambda}\subseteq N_{\lambda}$, we have that $s_{i}\in N_{\lambda}$ so $\lambda_{0}=\lambda(s_{i})\in V_{i}$. If $s_{i}\not\in M_{\lambda}$ then $V_{i}=V_{i-1}$. Since $V_{i}=V_{i-1}$ contains no $\lambda(c)$ and $\lambda(f)$, $\lambda_{0}$ must be in $V_{i}=V_{i-1}$. This proves the claim. Furthermore, for any $i$, $V_{i}$ must be either $\text{Span}\\{\lambda_{0},\alpha\\}$ or $\text{Span}\\{\lambda_{0},\lambda(c)+\alpha\\}$, where $\alpha$ is a nonzero element such that $\alpha$, $\lambda(c)$ and $\lambda(f)$ are linearly independent. Now we clearly see that there is a switch of choosing either $\text{Span}\\{\lambda_{0},\alpha\\}$ or $\text{Span}\\{\lambda_{0},\lambda(c)+\alpha\\}$ exactly when we pass $s_{i}\in M_{\lambda}$. But the total number of switches must be even. So $m_{\lambda}$ is even. ∎ ###### Remark 5.2. An easy observation shows that if $m=3$, then there is a possibility that $m_{\lambda}=3$ but still $n_{\lambda}=1<3/2$. This is exactly an exception only for $m_{\lambda}$ in the case $m=3$. Throughout the following, assume that $m>3$. Applying sectors $S(2_{1}),S(3_{1}),S(4)$ and $S(5)$ to the nontrivial coloring $\lambda$ gives the following four fundamental operations on its coloring sequence: 1. $\bar{\text{O}}_{21}$ Take $s_{k},s_{l}\in N_{\lambda}$ with $k<l$, by using $S(2_{1})$, we may do a linear transformation $(\lambda(c),\lambda_{0},\lambda(s_{k+1})\mapsto(\lambda(c),\lambda_{0},\lambda(s_{k+1})+\lambda_{0})$ to change the coloring sequence of $s_{k},s_{k+1},...,s_{l}$. 2. $\text{O}_{31}$ Take $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k})=\lambda(s_{l})\neq\lambda_{0}$, and use $S(3_{1})$ to reflect the coloring sequence of $s_{k},s_{k+1},...,s_{l}$. 3. $\text{O}_{4}$ Take $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k})-\lambda(s_{l})=\lambda(c)$ or $\lambda(f)$, we use $S(4)$ to reflect the coloring sequence of $s_{k},s_{k+1},...,s_{l}$ and then to do a linear transformation $(\lambda_{0},\lambda(s_{k}),\lambda(s_{l}))\mapsto(\lambda_{0},\lambda(s_{l}),\lambda(s_{k}))$ to change the reflected coloring sequence. 4. $\text{O}_{5}$ Take $s_{k},s_{l}$ $(k<l)$ with $\lambda(s_{k})-\lambda(s_{l})=\lambda_{0}$, we use $S(4)$ to reflect the coloring sequence of $s_{k},s_{k+1},...,s_{l}$ and then to do a linear transformation $(\lambda(c),\lambda(s_{k}),$ $\lambda(s_{l}))$ $\mapsto(\lambda(c),\lambda(s_{l}),\lambda(s_{k}))$ to change the reflected coloring sequence. It is easy to check the following ###### Lemma 5.8. The operations $\bar{\text{\rm O}}_{21}$, $\text{\rm O}_{31}$, $\text{\rm O}_{4}$ and $\text{\rm O}_{5}$ above will not change $m_{\lambda},n_{\lambda}$ of the nontrivial coloring $\lambda$. Without loss of generality, throughout the following one assumes that $\lambda(c)=e_{1},\lambda(f)=e_{1}+e_{2}$, so that $\lambda_{0}=e_{2}$, where $\\{e_{1},e_{2},e_{3}\\}$ is a basis of $\mathbb{Z}_{2}^{3}$. ###### Proposition 5.9. For $m>3$, each nontrivial coloring $\lambda$ is sector-equivalent to the following canonical form $\lambda_{C_{*}}$ with the coloring sequence (5.4) $\mathcal{C}_{*}=(e_{2},x_{1},e_{2},...,e_{2},x_{m_{\lambda}},e_{2},y_{1},...,e_{2},y_{n_{\lambda}-m_{\lambda}},z_{1},...,z_{m-2n_{\lambda}})$ where $x_{i}=\begin{cases}e_{1}+e_{3}&\text{if $i$ is odd}\\\ e_{3}&\text{if $i$ is even}\end{cases}$ and for all $1\leq i\leq n_{\lambda}-m_{\lambda}$, $y_{i}=e_{3}$ and $z_{i}=\begin{cases}e_{2}+e_{3}&\text{if $i$ is odd}\\\ e_{3}&\text{if $i$ is even.}\end{cases}$ ###### Proof. If $n_{\lambda}\leq 1$ then clearly the coloring $\lambda$ can be reduced to a coloring with the coloring sequence $\begin{cases}(e_{2},e_{3},e_{2}+e_{3},e_{3},...,e_{2}+e_{3},e_{3})&\text{ if $n_{\lambda}=1$ and $m$ is even}\\\ (e_{2},e_{3},e_{2}+e_{3},e_{3},...,e_{2}+e_{3},e_{3},e_{2}+e_{3})&\text{ if $n_{\lambda}=1$ and $m$ is odd}\\\ (e_{2}+e_{3},e_{3},...,e_{2}+e_{3},e_{3}).&\text{ if $n_{\lambda}=0$}\end{cases}$ If $n_{\lambda}\geq 2$, we may choose two $s_{k}$ and $s_{l}$ in $N_{\lambda}$ with $k<l$. Consider the coloring sub-sequence (5.5) $(\lambda(s_{k})=)e_{2},r_{1},...,r_{l-2},e_{2}(=\lambda(s_{l})),r_{l-1}$ of $s_{k},...,s_{l},s_{l+1}$, it is easy to see that $r_{1}-r_{l-1}\in\text{Span}\\{e_{1},e_{2}\\}$. Then when when $r_{1}-r_{l-1}=0$ (resp. $e_{1}$ or $e_{1}+e_{2}$, $e_{2}$), we may do the operation $\text{O}_{31}$ (resp. $\text{O}_{4}$ or $\text{O}_{5}$) on $r_{1},...,r_{l-2},e_{2},r_{l-1}$ from $s_{k+1}$ to $s_{l+1}$, and change (5.5) into $e_{2},r_{l-1},e_{2},r^{\prime}_{l-2},...,r^{\prime}_{2},r_{1}$. With this understood, assume that $N_{\lambda}=\\{s_{1}$, $s_{3},$$...,$ $s_{2n_{\lambda}-1}\\}$, so we may write the coloring sequence of $\lambda$ as follows: $\mathcal{C}=(e_{2},\alpha_{1},...,e_{2},\alpha_{n_{\lambda}},\beta_{1},...,\beta_{m-2n_{\lambda}})$ with $\alpha_{n_{\lambda}},\beta_{i}\in\\{e_{2}+e_{3},e_{3}\\}$. By doing the operation $\bar{\text{O}}_{21}$ on $\alpha_{n_{\lambda}},\beta_{1},...,\beta_{m-2n_{\lambda}}$, we may reduce $\mathcal{C}$ to $\mathcal{C}^{\prime}=(e_{2},\alpha_{1},...,\alpha_{n_{\lambda}-1},e_{2},e_{3},z_{1},...,z_{m-2n_{\lambda}})$ such that $z_{i}$ is $e_{2}+e_{3}$ if $i$ is odd, and $e_{3}$ if $i$ is even. Then we may further use the operation $\text{O}_{4}$ to reduce $\mathcal{C}^{\prime}$ to $\mathcal{C}^{\prime\prime}$ with $M_{\lambda}=\\{s_{1},...,s_{2m_{\lambda}-1}\\}$ and without changing the part $\mathcal{C}^{\prime}-\\{e_{2},\alpha_{1},...,\alpha_{n_{\lambda}-1},e_{2}\\}$. Finally, by using the operation $\bar{\text{O}}_{21}$, we may reduce $\mathcal{C}^{\prime\prime}$ to $\mathcal{C}_{*}$ as desired. ∎ Together with Theorem 3.3, Lemmas 5.7-5.8 and Proposition 5.9, it easily follows that ###### Corollary 5.10. Let $\lambda_{1},\lambda_{2}$ be two nontrivial colorings on $\mathrm{P}^{3}(m)$ with $m>3$. If $(m_{\lambda_{1}},n_{\lambda_{1}})=(m_{\lambda_{2}},n_{\lambda_{2}})$, then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic. ###### Corollary 5.11. For $m>3$, let $(k,l)$ be a pair such that $(1)$ $l\leq k\leq m/2$ and if $2\nmid m$ then $k>0$; and $(2)$ $l$ is even. Then there is a nontrivial coloring $\lambda$ on $\mathrm{P}^{3}(m)$ with $(n_{\lambda},m_{\lambda})=(k,l)$. As a consequence of Proposition 2.5 and Proposition 5.9, one also has ###### Corollary 5.12. Let $\lambda$ be a nontrivial coloring on $\mathrm{P}^{3}(m)$ with $m>3$. Then $M(\lambda)$ is orientable if $n_{\lambda}=0$, and non-orientable if $n_{\lambda}>0$. ## 6\. Mod 2 cohomology rings and two invariants Given a pair $(\mathrm{P}^{3}(m),\lambda)$ in $\Lambda(\mathrm{P}^{3}(m))$, one knows that the mod 2 cohomology ring of $M(\lambda)$ is $H^{*}(M(\lambda);\mathbb{Z}_{2})=\mathbb{Z}_{2}[c,f,s_{1},...,s_{m}]/I+J_{\lambda}$ where $I$ is the ideal generated by $cf$ and $s_{i}s_{j}$ with $s_{i}\cap s_{j}=\emptyset$, and $J_{\lambda}$ is the ideal generated by three linear relations (determined by the $3\times(m+2)$ matrix $(\lambda(c),\lambda(f),\lambda(s_{1}),...,\lambda(s_{m}))$). ### 6.1. Two invariants $\Delta(\lambda)$ and $\mathcal{B}(\lambda)$ Now let us introduce two invariants in $H^{*}(M(\lambda)$; $\mathbb{Z}_{2})$. Set $\mathcal{H}_{\lambda}^{1}=\\{x\in H^{1}(M(\lambda);\mathbb{Z}_{2})\big{|}x^{2}=0\\}$ $\mathcal{H}_{\lambda}^{2}=\\{x^{2}\big{|}x\in H^{1}(M(\lambda);\mathbb{Z}_{2})\\}$ and $\mathcal{K}_{\lambda}=\text{Span}\\{xy\big{|}x\in H^{1}(M(\lambda);\mathbb{Z}_{2}),y\in\mathcal{H}_{\lambda}^{1}\\}.$ Clearly, they are all vector spaces over $\mathbb{Z}_{2}$, and $\dim\mathcal{H}_{\lambda}^{2}=\dim H^{1}(M(\lambda);\mathbb{Z}_{2})-\dim\mathcal{H}_{\lambda}^{1}=m-1-\dim\mathcal{H}_{\lambda}^{1}.$ Note that $\dim H^{1}(M(\lambda);\mathbb{Z}_{2})=m-1$ by Example 2.1. Obviously, $\dim\mathcal{H}_{\lambda}^{1}$ is an invariant of the cohomology ring $H^{*}(M(\lambda);\mathbb{Z}_{2})$, denoted by $\Delta(\lambda)$. Define a bilinear map $\omega:H^{1}(M(\lambda);\mathbb{Z}_{2})\times\mathcal{H}_{\lambda}^{1}\longrightarrow\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ by $(x,y)\longmapsto[xy]$, which is surjective. Let $\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$ be the dual space of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$. Take a $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$, one can obtain a bilinear map $\theta\circ\omega:H^{1}(M(\lambda);\mathbb{Z}_{2})\times\mathcal{H}_{\lambda}^{1}\longrightarrow\mathbb{Z}_{2},$ which corresponds an $(m-1)\times\Delta(\lambda)$-matrix. Let $b_{r}(\lambda)$ denote the number of those $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$ such that $\text{rank }\theta\circ\omega=r$ where $1\leq r\leq\Delta(\lambda)$. Then we obtain an integer vector $\mathcal{B}(\lambda)=(b_{1}(\lambda),...,b_{\Delta(\lambda)}(\lambda)),$ called the bilinear vector. It is not difficult to see that $\mathcal{B}(\lambda)$ is an invariant of the cohomology ring $H^{*}(M(\lambda);\mathbb{Z}_{2})$. It should be pointed out that we shall only calculate $b_{1}(\lambda)$ and $b_{2}(\lambda)$ in $\mathcal{B}(\lambda)$ because basically this will be sufficient enough to reach our purpose. By $\bar{\mathcal{B}}(\lambda)$ we denote $(b_{1}(\lambda),b_{2}(\lambda))$. We also use the convention that $b_{2}(\lambda)=0$ if $\Delta(\lambda)=1$. ### 6.2. Calculation of $\Delta(\lambda)$ First we shall deal with the case in which $\lambda$ is nontrivial. ###### Lemma 6.1. If $\lambda$ is nontrivial, then $\Delta(\lambda)=\begin{cases}n_{\lambda}&\text{if $n_{\lambda}>0$ and $m_{\lambda}=0$}\\\ n_{\lambda}-1&\text{if $m_{\lambda}>0$}\\\ 1&\text{if $n_{\lambda}=0$ (so $m$ is even).}\end{cases}$ ###### Proof. By Proposition 5.9, each $\lambda$ is sector-equivalent to the canonical form $\lambda_{C_{*}}$ with the coloring sequence $\mathcal{C}_{*}$ and without changing $m_{\lambda}$ and $n_{\lambda}$, so it suffices to consider the $\lambda_{C_{*}}$. If $n_{\lambda}>0$ and $m_{\lambda}=0$, we can obtain from (5.4) that $\lambda_{C_{*}}$ determines the following three linear relations in $H^{1}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$ (6.1) $c+f=0$ (6.2) $f+\sum_{i\text{ is odd}}s_{i}=0$ (6.3) $s_{2}+\cdots+s_{2n_{\lambda}}+\sum_{2n_{\lambda}<i\leq m}s_{i}=0.$ So we may choose $B_{1}=\\{f,s_{2},s_{3},...,s_{m-1}\\}$ as a basis of $H^{1}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$. Since $cf=0$ and $s_{i}s_{j}=0$ with $s_{i}\cap s_{j}=\emptyset$ in $H^{*}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$, one can easily obtain from (6.1) and (6.3) that $B_{2}=\\{f,s_{2},s_{4},...,s_{2n_{\lambda}-2}\\}\subset\mathcal{H}_{\lambda_{C_{*}}}^{1}$, and $B_{2}\subset B_{1}$. Thus, $\dim\mathcal{H}_{\lambda}^{1}=\dim\mathcal{H}_{\lambda_{C_{*}}}^{1}\geq n_{\lambda}$. On the other hand, an easy argument shows that $B_{3}=\\{s_{3}^{2},...,s_{2n_{\lambda}-1}^{2},s_{2n_{\lambda}}^{2},...,s_{m-1}^{2},fs_{2},s_{3}s_{4},s_{5}s_{6},...,s_{2n_{\lambda}-1}s_{2n_{\lambda}}\\}$ forms a basis of $H^{2}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$. Now observe that the square of each element of $B_{1}\setminus B_{2}$ is in $B_{3}$, so $\dim\mathcal{H}_{\lambda}^{2}=\dim\mathcal{H}_{\lambda_{C_{*}}}^{2}\geq m-1-n_{\lambda}$. Furthermore, $\dim\mathcal{H}_{\lambda}^{1}\leq n_{\lambda}$. Therefore, $\Delta(\lambda)=n_{\lambda}$. If $m_{\lambda}>0$, then $\lambda_{C_{*}}$ determines the following three linear relations $\begin{cases}c+f+s_{2}+\cdots+s_{2m_{\lambda}-2}=0\\\ f+\sum_{i\text{ is odd}}s_{i}=0\\\ s_{2}+\cdots+s_{2n_{\lambda}}+\sum_{2n_{\lambda}<i\leq m}s_{i}=0.\end{cases}$ In this case, we choose $B_{4}=\\{s_{1},s_{2},...,s_{m-1}\\}$ as a basis of $H^{1}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$. Then one sees that $B_{5}=\\{s_{2},s_{4},...,s_{2n_{\lambda}-2}\\}\subset\mathcal{H}_{\lambda_{C_{*}}}^{1}$. Furthermore, we choose $B_{6}=\\{s_{1}^{2},s_{3}^{2},...,s_{2n_{\lambda}-1}^{2},s_{2n_{\lambda}}^{2},s_{2n_{\lambda}+1}^{2},...,s_{m-1}^{2},s_{2}s_{3},s_{4}s_{5},...,s_{2n_{\lambda}-2}s_{2n_{\lambda}-1}\\}$ as a basis of $H^{2}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$. A similar argument as above shows that $\Delta(\lambda)=n_{\lambda}-1$. If $n_{\lambda}=0$, in a similar way as above, it is easy to see that we may choose $B_{7}=\\{f,s_{3},...,s_{m}\\}$ as a basis of $H^{1}(M(\lambda_{C_{*}});\mathbb{Z}_{2})$ and $B_{8}=\\{f\\}$ forms a basis of $\mathcal{H}_{\lambda_{C_{*}}}^{1}$. Thus, $\Delta(\lambda)=1$. ∎ Next we consider the case in which $\lambda$ is trivial. ###### Lemma 6.2. Let $\lambda$ be trivial. Then $\Delta(\lambda)=\begin{cases}m-1&\text{if $\lambda\approx\lambda_{C_{1}}$}\\\ m-2&\text{if $\lambda\approx\lambda_{C_{i}},i=2,3,4$}\\\ m-3&\text{if $\lambda\approx\lambda_{C_{i}}$ with $m>4$, $i=5,6,7,8,9,10$.}\end{cases}$ In particular, if $m=3$ then $\Delta(\lambda_{C^{3}})=0$, and if $m=4$ then $\Delta(\lambda_{C_{1}^{4}})=\Delta(\lambda_{C_{2}^{4}})=1$. ###### Proof. The argument is similar to that of Lemma 6.1, and is not quite difficult. Here we only list the three linear relations and the bases of $H^{i}(M(\lambda);\mathbb{Z}_{2})(i=1,2)$ and $\mathcal{H}_{\lambda}^{1}$, but for the detailed proof, we would like to leave it to readers as an exercise. $\lambda$ | $m$ | Three linear relations by determined by $J_{\lambda}$ ---|---|--- $\lambda_{C_{1}}$ | even | $c+f=0,\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{2}}$ | even | $c+f=0,s_{2}+\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{3}}$ | odd | $c+f=0,s_{2}+\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{4}}$ | even | $c+f+s_{1}=0,\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{5}}$ | odd | $c+f+s_{1}=0,\sum_{i\text{ is odd}}s_{i}=0,s_{1}+\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{6}}$ | odd | $c+f+s_{1}+s_{2}=0,\sum_{i\text{ is odd}}s_{i}=0,s_{1}+\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{7}}$ | odd | $c+f+s_{2}=0,\sum_{i\text{ is odd}}s_{i}=0,s_{1}+\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{8}}$ | even | $c+f+s_{1}+s_{3}=0,s_{2}+\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{9}}$ | even | $c+f+s_{3}=0,s_{2}+\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda_{C_{10}}$ | even | $c+f+s_{2}=0,s_{2}+\sum_{i\text{ is odd}}s_{i}=0,\sum_{i\text{ is even}}s_{i}=0$ $\lambda$ | Basis of $H^{1}(M(\lambda);\mathbb{Z}_{2})$ | Basis of $\mathcal{H}_{\lambda}^{1}$ | Basis of $H^{2}(M(\lambda);\mathbb{Z}_{2})$ ---|---|---|--- $\lambda_{C_{1}}$ | $\\{f,s_{3},...,s_{m}\\}$ | $\\{f,s_{3},...,s_{m}\\}$ | $\\{s_{3}s_{4},fs_{3},...,fs_{m}\\}$ $\lambda_{C_{2}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{f,s_{2},s_{4},...,s_{m-1}\\}$ | $\\{s_{1}^{2},fs_{2},...,fs_{m-1}\\}$ $\lambda_{C_{3}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{f,s_{4},...,s_{m}\\}$ | $\\{s_{1}^{2},fs_{1},...,fs_{m-2}\\}$ $\lambda_{C_{4}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{3},...,s_{m}\\}$ | $\\{s_{1}s_{2},fs_{3},...,fs_{m}\\}$ $\lambda_{C_{5}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{3},...,s_{m-1}\\}$ | $\\{s_{1}s_{2},fs_{2},...,fs_{m-1}\\}$ $\lambda_{C_{6}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{3},...,s_{m-1}\\}$ | $\\{f^{2},s_{2}^{2},fs_{2},...,fs_{m-2}\\}$ $\lambda_{C_{7}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{3},...,s_{m-1}\\}$ | $\\{f^{2},s_{2}^{2},fs_{3},...,fs_{m-1}\\}$ $\lambda_{C_{8}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{2},s_{4},...,s_{m-1}\\}$ | $\\{f^{2},s_{3}^{2},fs_{1},fs_{4},...,fs_{m-1}\\}$ $\lambda_{C_{9}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{2},s_{4},...,s_{m-1}\\}$ | $\\{f^{2},s_{3}^{2},fs_{1},fs_{4},...,fs_{m-1}\\}$ $\lambda_{C_{10}}$ | $\\{f,s_{2},...,s_{m-1}\\}$ | $\\{s_{2},s_{4},...,s_{m-1}\\}$ | $\\{f^{2},s_{3}^{2},fs_{3},...,fs_{m-1}\\}$ ∎ ###### Remark 6.1. Although it is not mentioned in this paper, the authors have calculated the first Betti number under $\mathbb{Z}$-coefficients of all small covers over prisms and discovered that the number is always equal to $\Delta(\lambda)$ in the $\mathbb{Z}_{2}$-cohomology ring. One can check that this is also true for all closed surfaces (i.e., 2-dimensional small covers). It should be reasonable to conjecture that this is true for all small covers. ###### Proposition 6.3. Let $\lambda_{1}$ and $\lambda_{2}$ be two colorings in $\Lambda(\mathrm{P}^{3}(m))$ such that $\lambda_{1}$ is trivial but $\lambda_{2}$ is nontrivial. If $m>6$, then both $M(\lambda_{1})$ and $M(\lambda_{1})$ cannot be homeomorphic. ###### Proof. Suppose that $M(\lambda_{1})$ and $M(\lambda_{1})$ are homeomorphic. Then their cohomologies are isomorphic, so $\Delta(\lambda_{1})=\Delta(\lambda_{2})$. However, by Lemmas 6.1 and 6.2, one has that $\Delta(\lambda_{1})\geq m-3$ and $\Delta(\lambda_{2})\leq m/2$. Furthermore, if $m>6$, then $\Delta(\lambda_{1})\geq m-3>m/2\geq\Delta(\lambda_{2})$, so $\Delta(\lambda_{1})\not=\Delta(\lambda_{2})$, a contradiction. ∎ ###### Remark 6.2. We see from the proof of Proposition 6.3 that $\Delta(\lambda_{1})$ and $\Delta(\lambda_{2})$ can coincide only if $m\leq 6$. For $m=5,6$, all possible cases that $\Delta(\lambda_{1})=\Delta(\lambda_{2})$ happens are stated as follows: when $(n_{\lambda_{C_{*}}},m_{\lambda_{C_{*}}})=(m-3,0)$, one has that $\Delta(\lambda_{C_{*}})=\Delta(\lambda_{C_{i}})$, $i=5,6,7,8,9,10$. For $m=3,4$, we know from [LY] and [M3] that up to homeomorphism, there are only two small covers over $\mathrm{P}^{3}(3)$: ${\mathbb{R}}P^{3}$ and $S^{1}\times{\mathbb{R}}P^{2}$, and there are only four small covers over $\mathrm{P}^{3}(4)$: $(S^{1})^{3}$, $S^{1}\times K$, a twist $(S^{1})^{2}$-bundle over $S^{1}$ and a twist $K$-bundle over $S^{1}$, where $K$ is a Klein bottle. In particular, the cohomological rigidity holds in this case. ### 6.3. Calculation of $\bar{\mathcal{B}}(\lambda)$ Let $\lambda\in\Lambda(\mathrm{P}^{3}(m))$ with $m>4$. Choose an ordered basis $B^{\prime}$ of $H^{1}(M(\lambda);\mathbb{Z}_{2})$ and an ordered basis $B^{\prime\prime}$ of $\mathcal{H}_{\lambda}^{1}$, let $A_{0}$ denote an $(m-1)\times\Delta(\lambda)$ matrix $(a_{ij})$, where $a_{ij}=[u_{i}v_{j}]\in\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$, $u_{i}$ is the $i$-th element in $B^{\prime}$ and $v_{j}$ the $j$-th element in $B^{\prime\prime}$, so each element in $B^{\prime}$ corresponds to a row and each element in $B^{\prime\prime}$ a column. It follows that for any $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$, $\theta(A_{0})=(\theta(a_{ij}))$ is a representation matrix of $\theta\circ\omega$. First let us look at the case in which $\lambda$ is nontrivial. ###### Lemma 6.4. Let $\lambda$ be nontrivial. Then $\bar{\mathcal{B}}(\lambda)=\begin{cases}(0,0)&\text{if $(n_{\lambda},m_{\lambda})=(0,0)$}\\\ (1,0)&\text{if $(n_{\lambda},m_{\lambda})=(1,0)$ or $(2,2)$}\\\ (1,3)&\text{if $(n_{\lambda},m_{\lambda})=(2,0)$}\\\ (0,n_{\lambda})&\text{if $n_{\lambda}>2$ and $m_{\lambda}=0$}\\\ (n_{\lambda}-m_{\lambda},{{m_{\lambda}-1}\choose 1}+{{m_{\lambda}-1}\choose 2}+{{n_{\lambda}-m_{\lambda}}\choose 2})&\text{if $n_{\lambda}>2$ and $m_{\lambda}>0$}\end{cases}$ ###### Proof. By Proposition 5.9, one may assume that $\lambda=\lambda_{C_{*}}$. Then our argument proceeds as follows. (1) If $n_{\lambda}>0$ and $m_{\lambda}=0$, then Lemma 6.1 we may take $B^{\prime}=B_{1}$ and $B^{\prime\prime}=B_{2}$. Thus one has that $A_{0}$ is equal to $\begin{bmatrix}0&[fs_{2}]&[fs_{4}]&[fs_{6}]&\cdots&[fs_{2n_{\lambda}-6}]&[fs_{2n_{\lambda}-4}]&[fs_{2n_{\lambda}-2}]\\\ [s_{2}f]&0&0&0&{3}&0\\\ [s_{3}f]&[s_{3}s_{2}]&[s_{3}s_{4}]&0&{3}&0\\\ [s_{4}f]&0&0&0&{3}&0\\\ {8}\\\ [s_{2n_{\lambda}-3}f]&0&{3}&0&[s_{2n_{\lambda}-3}s_{2n_{\lambda}-4}]&[s_{2n_{\lambda}-3}s_{2n_{\lambda}-2}]\\\ [s_{2n_{\lambda}-2}f]&0&0&0&{3}&0\\\ [s_{2n_{\lambda}-1}f]&0&0&0&{2}&0&[s_{2n_{\lambda}-1}s_{2n_{\lambda}-2}]\\\ [s_{2n_{\lambda}}f]&0&0&0&{3}&0\\\ {8}\\\ [s_{m-1}f]&0&0&0&{3}&0\end{bmatrix}$ By direct calculations one knows from (6.2) and (6.3) that $s_{2n_{\lambda}}s_{2n_{\lambda}+1}+s_{2n_{\lambda}+1}^{2}+\cdots+s_{m}^{2}=0$ so $[s_{2n_{\lambda}}s_{2n_{\lambda}+1}]=0$ and $\begin{cases}s_{2i}s_{2i+1}=s_{2i+1}s_{2i+2}&\text{when $1\leq i\leq n_{\lambda}-1$}\\\ fs_{i}=s_{i}^{2}\text{ so $[fs_{i}]=0$}&\text{when either $i$ is odd or $i>2n_{\lambda}$ is even}\\\ fs_{i}=s_{i-1}s_{i}+s_{i}s_{i+1}&\text{when $2\leq i\leq 2n_{\lambda}$ is even.}\end{cases}$ Set $x_{1}=[fs_{2}]$ and $x_{i}=[s_{2i-1}s_{2i}]$ for $2\leq i\leq n_{\lambda}$. Then $[fs_{2i}]=x_{i}+x_{i+1}$ for $2\leq i\leq n_{\lambda}-1$ and $[fs_{2n_{\lambda}}]=x_{n_{\lambda}}$. Thus, we see that $\\{x_{1},...,x_{n_{\lambda}}\\}$ forms a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$, and the corresponding rows of $f,s_{2},...,s_{2n_{\lambda}}$ in $A_{0}$ are nonzero. Now we may reduce $A_{0}$ to $A$ by deleting those zero rows of $A_{0}$, so that for each $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$, $\text{rank}(\theta(A_{0}))=\text{rank}(\theta(A))$ still holds. Write $A$ as follows: $\begin{bmatrix}0&x_{1}&x_{2}+x_{3}&x_{3}+x_{4}&\cdots&x_{n_{\lambda}-3}+x_{n_{\lambda}-2}&x_{n_{\lambda}-2}+x_{n_{\lambda}-1}&x_{n_{\lambda}-1}+x_{n_{\lambda}}\\\ x_{1}&0&0&0&{3}&0\\\ 0&x_{2}&x_{2}&0&{3}&0\\\ x_{2}+x_{3}&0&0&0&{3}&0\\\ {8}\\\ 0&0&{3}&0&x_{n_{\lambda}-1}&x_{n_{\lambda}-1}\\\ x_{n_{\lambda}-1}+x_{n_{\lambda}}&0&0&0&{3}&0\\\ 0&0&0&0&{2}&0&x_{n_{\lambda}}\\\ x_{n_{\lambda}}&0&0&0&{3}&0\\\ \end{bmatrix}$ Let $\\{\theta_{i}\big{|}i=1,...,n_{\lambda}\\}$ be the dual basis of $\\{x_{1},...,x_{n_{\lambda}}\\}$ in $\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$. Take any $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$, one may write $\theta=\sum_{i\in S}\theta_{i}$ where $S\subset\\{1,...,n_{\lambda}\\}$. Obviously, if $n_{\lambda}=1$ then $b_{1}(\lambda)=1$ and $b_{2}(\lambda)=0$. If $n_{\lambda}\geq 2$, it is easy to see that $b_{1}(\lambda)=0$ since $\text{rank}\theta(A)$ cannot be 1 whenever $S$ is empty or non-empty. If $n_{\lambda}=2$, then $\text{rank}\theta(A)=2$ only when $S=\\{1\\},\\{2\\},\\{1,2\\}$, so $b_{2}(\lambda)=3$. If $n_{\lambda}>2$, by direct calculations, one has that only when $S=\\{i\\}(i\not=2)$ or $\\{1,2\\}$, $\text{rank}\theta(A)=2$, so $b_{2}(\lambda)=n_{\lambda}$. (2) If $n_{\lambda}>0$, then Lemma 6.1 we may take $B^{\prime}=B_{4}$ and $B^{\prime\prime}=B_{5}$. Moreover, we see that in $A_{0}$, only corresponding rows of $s_{1},s_{3},...,s_{2n_{\lambda}-1}$ are nonzero, so we may delete the other rows from $A_{0}$ to obtain $A$ so that for each $\theta\in\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$, $\text{rank}(\theta(A_{0}))=\text{rank}(\theta(A))$. Now we can write down $A$ after simple calculations: $A=\begin{bmatrix}[s_{1}s_{2}]&0&{2}&0\\\ [s_{2}s_{3}]&[s_{2}s_{3}]&0&{1}&0\\\ 0&[s_{4}s_{5}]&[s_{4}s_{5}]&0&{1}\\\ {5}\\\ {2}&0&[s_{2n_{\lambda}-4}s_{2n_{\lambda}-3}]&[s_{2n_{\lambda}-4}s_{2n_{\lambda}-3}]\\\ {3}&0&[s_{2n_{\lambda}-2}s_{2n_{\lambda}-1}]\end{bmatrix}$ Set $x_{i}=[s_{2i}s_{2i+1}]\in\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$, for $i=1,...,n_{\lambda}-1$. A direct calculation shows that $[s_{1}s_{2}]=x_{1}+x_{2}+\cdots+x_{m_{\lambda}-1}$. So we see that $\\{x_{i}\big{|}i=1,...,n_{\lambda}-1\\}$ forms a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$. Let $\\{\theta_{i}\big{|}i=1,...,n_{\lambda}-1\\}$ be its dual basis in $\text{Hom}(\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}),\mathbb{Z}_{2})$. Then one may write $\theta=\sum_{i\in S}\theta_{i}$ where $S\subset\\{1,...,n_{\lambda}-1\\}$. Now $i\in S$ implies that the $(i+1)$-th row of $\theta(A)$ is nonzero. In order that $\text{rank}(\theta(A))=1$, one must have $\sharp(S)=1$ since $S$ cannot be empty. If $n_{\lambda}=2$ then $m_{\lambda}=2$, $\mathcal{H}^{1}_{\lambda}$ is 1-dimensional and $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ has only a nonzero element, so $b_{1}(\lambda)=1$ and $b_{2}(\lambda)=0$. If $n_{\lambda}>2$, $\text{rank}(\theta_{i}(A))=1$ if and only if $\theta_{i}([s_{1}s_{2}])=0$, which is equivalent to that $\theta_{i}(x_{1}+x_{2}+...+x_{m_{\lambda}-1})=0\Leftrightarrow i>m_{\lambda}-1$. Therefore, $b_{1}(\lambda)=n_{\lambda}-m_{\lambda}$. In this case, an easy argument shows that $b_{2}(\lambda)={{m_{\lambda}-1}\choose 1}+{{m_{\lambda}-1}\choose 2}+{{n_{\lambda}-m_{\lambda}}\choose 2}$. (3) If $n_{\lambda}=0$, then Lemma 6.1 we may take $B^{\prime}=B_{4}$ and $B^{\prime\prime}=B_{5}$, so $A_{0}=(0,[s_{3}f],...,[s_{m}f]).$ However, a direct calculation shows that for each $i$, $s_{i}f=s_{i}^{2}$, so $[s_{i}f]=0$ in $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$. Thus, $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=0$, and so $\bar{\mathcal{B}}(\lambda)=(0,0)$. ∎ ###### Theorem 6.5. Let $\lambda_{1},\lambda_{2}$ be two nontrivial colorings on $\mathrm{P}^{3}(m)$ with $m>4$. Then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic if and only if their cohomologies $H^{*}(M(\lambda_{1});\mathbb{Z}_{2})$ and $H^{*}(M(\lambda_{2});\mathbb{Z}_{2})$ are isomorphic as rings. ###### Proof. It suffices to show that if $H^{*}(M(\lambda_{1});\mathbb{Z}_{2})$ and $H^{*}(M(\lambda_{2});\mathbb{Z}_{2})$ are isomorphic, then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic. Now suppose that $H^{*}(M(\lambda_{1});\mathbb{Z}_{2})\cong H^{*}(M(\lambda_{2});\mathbb{Z}_{2})$. Then one has that $\bar{\mathcal{B}}(\lambda_{1})=\bar{\mathcal{B}}(\lambda_{2})$. We claim that $(m_{\lambda_{1}},n_{\lambda_{1}})=(m_{\lambda_{2}},n_{\lambda_{2}})$. If not, then by Lemma 6.4, the possible case in which this happens is $\bar{\mathcal{B}}(\lambda_{1})=\bar{\mathcal{B}}(\lambda_{2})=(1,0)$. Without loss of generality, assume that $(m_{\lambda_{1}},n_{\lambda_{1}})=(1,0)$ and $(m_{\lambda_{2}},n_{\lambda_{2}})=(2,2)$. Then by Lemma 6.1, one has $\Delta(\lambda_{1})=\Delta(\lambda_{2})=1$, so $\mathcal{H}^{1}_{\lambda_{1}}$ and $\mathcal{H}^{1}_{\lambda_{2}}$ contains only a nonzero element. Let $z_{0}^{(i)}$ be the unique nonzero element of $\mathcal{H}^{1}_{\lambda_{i}},i=1,2$. For each $i$, define a linear map $\Phi_{i}:H^{1}(M(\lambda_{i});\mathbb{Z}_{2})\longrightarrow H^{2}(M(\lambda_{i});\mathbb{Z}_{2})$ by $x\longmapsto z_{0}^{(i)}x$. When $i=1$, by Lemma 6.1 one may choose $B_{1}=\\{f,s_{2},s_{3},...,s_{m-1}\\}$ as a basis of $H^{1}(M(\lambda_{1});\mathbb{Z}_{2})$ and $B_{2}=\\{f\\}$ as a basis of $\mathcal{H}^{1}_{\lambda_{1}}$, so $z_{0}^{(1)}=f$. By direct calculations, one has that for $3\leq j\leq m-1$, $fs_{j}=s_{j}^{2}$. Since $fs_{2},s_{3}^{2},...,s_{m-1}^{2}$ are linearly independent, one knows that $\Phi_{1}$ has rank $m-2$. When $i=2$, by Lemma 6.1 one may choose $B_{4}=\\{s_{1},s_{2},...,s_{m-1}\\}$ as a basis of $H^{1}(M(\lambda_{2});\mathbb{Z}_{2})$ and $B_{5}=\\{s_{2}\\}$ as a basis of $\mathcal{H}^{1}_{\lambda_{2}}$, so $z_{0}^{(1)}=s_{2}$. Since $s_{2}^{2}=s_{2}s_{j}=0,j\geq 4$, one sees that $\Phi_{2}$ has rank at most $2$. Now since $m>4$, one has that $\text{rank}\Phi_{1}=m-2>2\geq\text{rank}\Phi_{2}$, but this is impossible. Thus, one must have $(m_{\lambda_{1}},n_{\lambda_{1}})=(m_{\lambda_{2}},n_{\lambda_{2}})$. Moreover, the theorem follows from Corollary 5.10. ∎ ###### Corollary 6.6. Let $\lambda_{1},\lambda_{2}$ be two nontrivial colorings on $\mathrm{P}^{3}(m)$ with $m>4$. Then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic if and only if $(m_{\lambda_{1}},n_{\lambda_{1}})=(m_{\lambda_{2}},n_{\lambda_{2}})$. Furthermore, by Corollary 5.11 one has ###### Corollary 6.7. The number of homeomorphism classes of small covers over $\mathrm{P}^{3}(m)$ $(m>4)$ with nontrivial colorings is exactly $N_{nt}(m)=\begin{cases}\sum_{0\leq k\leq{m\over 2}}([{k\over 2}]+1)&\text{ if $m$ is even }\\\ \sum_{1\leq k\leq{m\over 2}}([{k\over 2}]+1)&\text{ if $m$ is odd.}\\\ \end{cases}$ Next let us look at the case in which $\lambda$ is trivial. By Lemma 6.2 we divide our argument into two cases: (I) $\Delta(\lambda)$ is odd; (II) $\Delta(\lambda)$ is even. Case (I): $\Delta(\lambda)$ is odd. ###### Lemma 6.8. Let $\lambda$ be trivial such that $\Delta(\lambda)$ is odd. Then $\bar{\mathcal{B}}(\lambda)=\begin{cases}(0,2^{m-2}-1)&\text{if $\lambda\approx\lambda_{C_{1}}$}\\\ (0,2^{m-3}-1)&\text{if $\lambda\approx\lambda_{C_{3}}$}\\\ (2^{m-4}-1,0)&\text{if $\lambda\approx\lambda_{C_{8}}$}\\\ (2^{m-3}-1,0)&\text{if $\lambda\approx\lambda_{C_{9}}$}\\\ (2^{m-4}-1,0)&\text{if $\lambda\approx\lambda_{C_{10}}$}\end{cases}$ ###### Proof. If $\lambda\approx\lambda_{C_{1}}$, using Lemma 6.2 and by direct calculations, one has that $s_{1}s_{2}=s_{2}s_{3}=\cdots=s_{m-1}s_{m}=s_{m}s_{1}$, so $A_{0}$ may be written as follows: $\begin{bmatrix}0&x_{2}&x_{3}&x_{4}&\cdots&x_{m-2}&x_{m-1}\\\ x_{2}&0&x_{1}&0&\cdots&0&0\\\ x_{3}&x_{1}&0&x_{1}&\cdots&0&0\\\ x_{4}&0&x_{1}&0&\cdots&0&0\\\ {7}\\\ x_{m-2}&0&0&0&\cdots&0&x_{1}\\\ x_{m-1}&0&0&0&\cdots&x_{1}&0\end{bmatrix}$ where $x_{1}=[s_{3}s_{4}]$ and $x_{i}=[fs_{i+1}],i=2,...,m-1$. We see easily that $\\{x_{1},...,x_{m-1}\\}$ forms a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ so $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-1$. Then one may conclude that $\bar{\mathcal{B}}(\lambda)=(0,2^{m-2}-1)$. Also, it is easy to see that in this case $b_{\Delta(\lambda)}$ is nonzero. In a similar way as above, if $\lambda\approx\lambda_{C_{3}}$, one has that $[s_{2}s_{3}]=[s_{3}s_{4}]=[s_{4}s_{5}]=\cdots=[s_{m-1}s_{m}]=0$, so $A_{0}$ may be written as follows: $\begin{bmatrix}0&x_{3}&x_{4}&x_{5}&\cdots&x_{m-3}&\sum_{j\text{ is odd}}x_{j}&x_{1}+\sum_{j\text{ is even}}x_{j}\\\ x_{1}&0&0&0&\cdots&0&0&0\\\ x_{2}&0&0&0&\cdots&0&0&0\\\ x_{3}&0&0&0&\cdots&0&0&0\\\ {8}\\\ x_{m-3}&0&0&0&\cdots&0&0&0\\\ \sum_{j\text{ is odd}}x_{j}&0&0&0&\cdots&0&0&0\end{bmatrix}$ where $x_{i}=[fs_{i+1}],i=1,...,m-3$. And $\\{x_{1},...,x_{m-3}\\}$ forms a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ so $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-3$. A direct observation shows that $\bar{\mathcal{B}}(\lambda)=(0,2^{m-3}-1)$. If $\lambda\approx\lambda_{C_{8}}$ or $\lambda_{C_{9}}$, then $[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]=[s_{m}s_{1}]=0$, so $A_{0}$ can be reduced to a $1\times(m-3)$ matrix $([fs_{2}],[fs_{4}],...,[fs_{m-1}]).$ Also, we easily see that $\\{s_{3}^{2},fs_{2},fs_{4},...,fs_{m-1}\\}$ can be used as a basis of $\mathcal{K}_{\lambda}$ and $\\{f^{2},s_{3}^{2}\\}$ forms a basis of $\mathcal{H}_{\lambda}^{2}$ (note that $\dim\mathcal{H}_{\lambda}^{2}=m-1-\Delta(\lambda)$=2). However, when $\lambda\approx\lambda_{C_{8}}$, by direct calculations one has that $f^{2}=fs_{2}+\sum_{j>4\text{ is odd}}fs_{j}$, so $f^{2}\in\mathcal{K}_{\lambda}$ and $\mathcal{H}_{\lambda}^{2}\subset\mathcal{K}_{\lambda}$. Thus, $\dim\mathcal{H}_{\lambda}^{2}\cap\mathcal{K}_{\lambda}=2$, $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-4$ and $\\{[fs_{4}],...,[fs_{m-1}]\\}$ forms a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$. Moreover, one has that $\bar{\mathcal{B}}(\lambda_{C_{8}})=(2^{m-4}-1,0)$. When $\lambda\approx\lambda_{C_{9}}$, it is not difficult to check that $\dim\mathcal{H}_{\lambda}^{2}\cap\mathcal{K}_{\lambda}=1$ and $[fs_{2}],[fs_{4}],...,[fs_{m-1}]$ are linearly independent, so $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-3$. Thus, $\bar{\mathcal{B}}(\lambda_{C_{9}})=(2^{m-3}-1,0)$. If $\lambda\approx\lambda_{C_{10}}$, then $[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]=[s_{m}s_{1}]=[s_{3}^{2}]=0$ and $fs_{2}=f^{2}$, so $A_{0}$ can be reduced to a $1\times(m-3)$ matrix $(0,[fs_{4}],...,[fs_{m-1}])$. It is easy to see that $\dim\mathcal{H}_{\lambda}^{2}\cap\mathcal{K}_{\lambda}=1$ and $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-4$, so $\bar{\mathcal{B}}(\lambda_{C_{10}})=(2^{m-4}-1,0)$. ∎ Case (II): $\Delta(\lambda)$ is even. ###### Lemma 6.9. Let $\lambda$ be trivial such that $\Delta(\lambda)$ is even. Then $\bar{\mathcal{B}}(\lambda)=\begin{cases}(1,2^{m-2}-2)&\text{if $\lambda\approx\lambda_{C_{2}}$}\\\ (2^{m-2}-1,0)&\text{if $\lambda\approx\lambda_{C_{4}}$}\\\ (2^{m-3}-1,0)&\text{if $\lambda\approx\lambda_{C_{5}}$}\\\ (2^{m-4}-1,0)&\text{if $\lambda\approx\lambda_{C_{6}}$}\\\ (2^{m-3}-1,0)&\text{if $\lambda\approx\lambda_{C_{7}}$}\end{cases}$ ###### Proof. If $\lambda\approx\lambda_{C_{2}}$, then one can obtain by Lemma 6.2 that $[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]=[s_{m}s_{1}]=[s_{1}^{2}]=0$ and so $A_{0}$ can be reduced to the following matrix $\begin{bmatrix}0&[fs_{2}]&[fs_{4}]&\cdots&[fs_{m-1}]\\\ [fs_{2}]&0&0&\cdots&0\\\ [fs_{3}]&0&0&\cdots&0\\\ [fs_{4}]&0&0&\cdots&0\\\ {5}\\\ [fs_{m-1}]&0&0&\cdots&0\end{bmatrix}$ One may easily show that $\\{[fs_{2}],...,[fs_{m-1}]\\}$ is a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$. Then a direct observation can obtain that $\bar{\mathcal{B}}(\lambda_{C_{2}})=(1,2^{m-2}-2)$. If $\lambda\approx\lambda_{C_{4}}$, then one has that $[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]$, so $A_{0}$ can be reduced to the following matrix $\begin{bmatrix}[fs_{3}]&[fs_{4}]&[fs_{5}]&\cdots&[fs_{m-3}]&[fs_{m-2}]&[fs_{m-1}]&[fs_{m}]\\\ [s_{1}s_{2}]&0&0&\cdots&0&0&0&0\\\ 0&[s_{1}s_{2}]&0&\cdots&0&0&0&0\\\ [s_{1}s_{2}]&0&[s_{1}s_{2}]&\cdots&0&0&0&0\\\ {8}\\\ 0&0&0&\cdots&[s_{1}s_{2}]&0&[s_{1}s_{2}]&0\\\ 0&0&0&\cdots&0&[s_{1}s_{2}]&0&[s_{1}s_{2}]\end{bmatrix}$ and $\\{[s_{1}s_{2}],[fs_{3}],...,[fs_{m}]\\}$ is a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ so $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-1$. Furthermore, one knows that $\bar{\mathcal{B}}(\lambda_{C_{4}})=(2^{m-2}-1,0)$. Note that in this case $b_{\Delta(\lambda)}$ is nonzero. If $\lambda\approx\lambda_{C_{5}}$, then one has that $[s_{1}^{2}]=[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]=0$, so $A_{0}$ can be reduced to a $1\times(m-3)$ matrix $([fs_{3}],[fs_{4}],...,[fs_{m-1}])$, and $\\{[fs_{3}],[fs_{4}],...,[fs_{m-1}]\\}$ is a basis of $\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})$ so $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-3$. Note that in this case $\dim\mathcal{H}_{\lambda}^{2}\cap\mathcal{K}_{\lambda}=1$. Thus, $\bar{\mathcal{B}}(\lambda_{C_{5}})=(2^{m-3}-1,0)$, but $b_{\Delta(\lambda)}=0$. If $\lambda\approx\lambda_{C_{6}}$ or $\lambda_{C_{7}}$, similarly to the case $\lambda\approx\lambda_{C_{5}}$, then one has that $[s_{1}^{2}]=[s_{1}s_{2}]=[s_{2}s_{3}]=\cdots=[s_{m-1}s_{m}]=0$, so $A_{0}$ can be reduced to a $1\times(m-3)$ matrix $([fs_{3}],[fs_{4}],...,[fs_{m-1}]).$ As in the proof of cases $\lambda\approx\lambda_{C_{8}}$ or $\lambda_{C_{9}}$, we see that $\\{s_{2}^{2},fs_{3},fs_{4},...,fs_{m-1}\\}$ can be used as a basis of $\mathcal{K}_{\lambda}$ and $\\{f^{2},s_{2}^{2}\\}$ forms a basis of $\mathcal{H}_{\lambda}^{2}$. However, when $\lambda\approx\lambda_{C_{6}}$, it is easy to check that $\mathcal{H}_{\lambda}^{2}\subset\mathcal{K}_{\lambda}$, so $\dim\mathcal{H}_{\lambda}^{2}\cap\mathcal{K}_{\lambda}=2$ and $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-4$. Moreover, $\bar{\mathcal{B}}(\lambda_{C_{6}})=(2^{m-4}-1,0)$ and $b_{\Delta(\lambda)}=0$. When $\lambda\approx\lambda_{C_{7}}$, one may check that $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}=1$ and then $\dim\mathcal{K}_{\lambda}/(\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2})=m-3$. Thus $\bar{\mathcal{B}}(\lambda_{C_{7}})=(2^{m-3}-1,0)$ and $b_{\Delta(\lambda)}=0$. ∎ ###### Remark 6.3. We see that for $\lambda_{C_{5}}$ and $\lambda_{C_{7}}$, $\Delta(\lambda_{C_{5}})=\Delta(\lambda_{C_{7}})$ and $\bar{\mathcal{B}}(\lambda_{C_{5}})=\bar{\mathcal{B}}(\lambda_{C_{7}})$. However, we can still distinguish them by using the first Stiefel-Whitney class. Let $w_{1}(\lambda)\in H^{1}(M(\lambda);\mathbb{Z}_{2})$ denote the first Stiefel-Whitney class. It is well-known that $w_{1}(\lambda)=0$ if and only if $M(\lambda)$ is orientable. Then, by Corollary 5.6 one knows that if $\lambda\approx\lambda_{C_{5}}$, then $w_{1}(\lambda_{C_{5}})=0$; but if $\lambda\approx\lambda_{C_{7}}$, $w_{1}(\lambda_{C_{7}})\not=0$. This also happens for $\lambda_{C_{8}}$ and $\lambda_{C_{10}}$. But we can use the number $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}$ to distinguish them. Actually, by Lemma 6.8, if $\lambda\approx\lambda_{C_{8}}$, $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}=2$; but if $\lambda\approx\lambda_{C_{10}}$, $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}=1$. ###### Theorem 6.10. Let $\lambda_{1},\lambda_{2}$ be two trivial colorings on $\mathrm{P}^{3}(m)$ with $m>4$. Then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic if and only if their cohomologies $H^{*}(M(\lambda_{1});\mathbb{Z}_{2})$ and $H^{*}(M(\lambda_{2});\mathbb{Z}_{2})$ are isomorphic as rings. ###### Proof. This follows immediately from Lemmas 6.2, 6.8-6.9 and Remark 6.3. ∎ As a consequence of Collorary 5.5 and Theorem 6.10, one has ###### Corollary 6.11. The number of homeomorphism classes of small covers over $\mathrm{P}^{3}(m)(m>4)$ with trivial colorings is exactly $N_{t}(m)=\begin{cases}4&\text{ if $m$ is odd}\\\ 6&\text{ if $m$ is even}\end{cases}$ ## 7\. Proofs of Theorems 1.1 and 1.2 Now let us finish the proofs of Theorems 1.1 and 1.2. Proof of Theorem 1.1. It suffices to show that if their cohomologies $H^{*}(M(\lambda_{1});{\mathbb{Z}}_{2})$ and $H^{*}(M(\lambda_{2});{\mathbb{Z}}_{2})$ are isomorphic as rings, then $M(\lambda_{1})$ and $M(\lambda_{2})$ are homeomorphic. By Propositions 6.3, 6.5 and 6.10, this is true when $m>6$. It remains to consider the case $m\leq 6$. As stated in Remark 6.2, the cohomological rigidity holds when $m\leq 4$ (see also [LY] and [M3]). Next, we only need put our attention on the case $5\leq m\leq 6$. By Lemmas 6.1, 6.2, 6.4, 6.8, 6.9 and Remark 6.3, we may list all possible $\lambda$ with mentioned invariants in the case $5\leq m\leq 6$ whichever $\lambda$ is trivial or nontrivial. (A) Case $m=5$: $\lambda$ | Trivialization | $\Delta(\lambda)$ | $\bar{\mathcal{B}}(\lambda)$ | $(n_{\lambda},m_{\lambda})$ | $w_{1}(\lambda)$ ---|---|---|---|---|--- $\lambda_{C_{*}}$ | nontrivial | 1 | $(1,0)$ | $(1,0)$ | $\lambda_{C_{*}}$ | nontrivial | 2 | $(1,3)$ | $(2,0)$ | $\lambda_{C_{*}}$ | nontrivial | 1 | $(1,0)$ | $(2,2)$ | $\lambda_{C_{3}}$ | trivial | 3 | $(0,3)$ | | $\lambda_{C_{5}}$ | trivial | 2 | $(3,0)$ | | 0 $\lambda_{C_{6}}$ | trivial | 2 | $(1,0)$ | | $\lambda_{C_{7}}$ | trivial | 2 | $(3,0)$ | | nonzero (B) Case $m=6$: $\lambda$ | Trivialization | $\Delta(\lambda)$ | $\bar{\mathcal{B}}(\lambda)$ | $(n_{\lambda},m_{\lambda})$ | $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}$ ---|---|---|---|---|--- $\lambda_{C_{*}}$ | nontrivial | 1 | $(1,0)$ | $(0,0)$ | $\lambda_{C_{*}}$ | nontrivial | 1 | $(1,0)$ | $(1,0)$ | $\lambda_{C_{*}}$ | nontrivial | 2 | $(1,3)$ | $(2,0)$ | $\lambda_{C_{*}}$ | nontrivial | 3 | $(0,3)$ | $(3,0)$ | $\lambda_{C_{*}}$ | nontrivial | 1 | $(1,0)$ | $(2,2)$ | $\lambda_{C_{*}}$ | nontrivial | 2 | $(1,1)$ | $(3,2)$ | $\lambda_{C_{1}}$ | trivial | 5 | $(0,15)$ | | $\lambda_{C_{2}}$ | trivial | 4 | $(1,14)$ | | $\lambda_{C_{4}}$ | trivial | 4 | $(15,0)$ | | $\lambda_{C_{8}}$ | trivial | 3 | $(3,0)$ | | 2 $\lambda_{C_{9}}$ | trivial | 3 | $(7,0)$ | | $\lambda_{C_{10}}$ | trivial | 3 | $(3,0)$ | | 1 We clearly see from two tables above that by using invariants $\Delta(\lambda)$, $\bar{\mathcal{B}}(\lambda)$, $(n_{\lambda},m_{\lambda})$, $w_{1}(\lambda)$ and $\dim\mathcal{K}_{\lambda}\cap\mathcal{H}_{\lambda}^{2}$, we can distinguish all $M(\lambda)$ up to homeomorphism when $m=5,6$. This completes the proof. $\Box$ Furthermore, Theorem 1.2 follows immediately from Theorem 1.1, Corollaries 6.7, 6.11 and Remark 6.2. Finally, let us return to the invariants $\Delta(\lambda)$ and $\mathcal{B}(\lambda)$ again. We see that generally these invariants can always be defined for any small cover over a simple convex polytop $P^{n}$. We would like to pose the following problems: 1. $\bullet$ Under what condition can $\Delta(\lambda)$ and $\mathcal{B}(\lambda)$ become the combinatorial invariants? 2. $\bullet$ If $\Delta(\lambda)$ and $\mathcal{B}(\lambda)$ are the combinatorial invariants, then how can one calculate them in terms of polytopes $P^{n}$? ## References * [BP] V.M. Buchstaber and T.E. Panov, Torus actions and their applications in topology and combinatorics, University Lecture Series, vol. 24, Amer. Math. Soc., Providence, RI, 2002. * [CCL] M. Z. Cai, X. Chen, and Z. Lü, Small covers over prisms, Topology Appl. 154 (2007) 2228-2234. * [C] S. Choi, The number of small covers over cubes, Algebr. Geom. Topol. 8 (2008), 2391-2399. * [D] M. W. Davis, Groups generated by reflections and aspherical manifolds not covered by Euclidean space, Annals of Mathematics, 117 (1983), 293-324. * [DJ] M. W. Davis and T. Januszkiewicz, Convex polytopes, Coxeter orbifolds and torus Actions, Duke Mahtematicial Journal, 62 (1991), 417-451. * [GS] A. Garrison, R. Scott, Small covers of the dodecahedron and the 120-cell, Proc. Amer. Math. Soc.131 (2002) 963-971. * [I] I. V. Izmestiev, Three-dimensional manifolds defined by a coloring of the faces of a simple polytope, Math. Notes 69 (2001), no. 3-4, 340–346. * [KM] Y. Kamishima and M. Masuda, Cohomological rigidity of real Bott manifolds, arXiv:0807.4263. * [LM] Z. Lü and M. Masuda, Equivariant classification of $2$-torus manifolds, arXiv:0802.2313. * [LY] Z. Lü and L. Yu, Topological types of 3-dimensianl small covers (accepted), to appear in Forum Math., arXiv:0710.4496. * [M1] M. Masuda, Equivariant cohomology distinguishes toric manifolds, Adv. Math. 218 (2008), 2005-2012. * [M2] M. Masuda, Cohomological non-rigidity of generalized real Bott manifolds of height 2, preprint, arXiv:0809.2215. * [M3] M. Masuda, Classification of real Bott manifolds, preprint, arXiv:0809.2178. * [NN] H. Nakayama and Y. Nishimura, The orientability of small covers and coloring simple polytopes, Osaka J. Math. 42 (2005), 243-256. * [Z] G.M. Ziegler, Lectures on Polytopes, Graduate Texts in Math., Springer-Verlag, Berlin, 1994.
arxiv-papers
2009-03-23T18:50:36
2024-09-04T02:49:01.316653
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Xiangyu Cao and Zhi L\\\"u", "submitter": "Zhi L\\\"u", "url": "https://arxiv.org/abs/0903.3653" }
0903.3669
# Comment on ”Language Trees and Zipping” Xiu-Li Wang wangxiuli@ahu.edu.cn Departmant of Chinese Literature and Language Anhui University Hefei Anhui 230039 China ###### Abstract every encoding has priori information if the encoding represents any semantic information of the un- verse or object.Encoding means mapping from the un- verse to the string or strings of digits. The semantic here is used in the model-theoretic sense or denotation of the object.if encoding or strings of symbols is the adequate and true mapping of model or object,and the mapping is recursive or computable ,the distance between two strings(text)is mapping the distance between models.We then are able to measure the distance by computing the distance be- tween the two strings.Oherwise,we may take a misleading course.”language tree” may not be a family tree in the sense of historical linguistics.Rather it just means the similarity ###### pacs: showpacs ## I Comment on ”Language Trees and Zipping” Several statements that Benedetto et al.make in their Letter Benedetto et al. (2002, 2003)are not certainly true.First,We claim a statement that Benedetto et al.. make in their Letter and their reply Benedetto et al. (2002, 2003)has mixed strings of symbols with the objects or models the strings denote.In another word ,strings of symbols are different from the object or model the strings denote except when the strings only denote themselves.Moreover,a statement of the comment on the Letter by Dmitry V. Khmelev et al.is inaccurate Khmelev and Teahan (2003).That is ,”Notice that the language tree (LT) diagram [1] does not include the Russian language (Slavic family of Indo- European family of languages: $288\times 10^{6}$speakers). Our computations show that once Russian is included, it does not cluster with the other members of the Slavic group. Obviously, certain Cyrillic alphabet based languages were left out of the study , which improves results significantly and shows that a priori information about the alphabet is being taken advantage of to achieve the results outlined in their Letter .”. String of symbols and symbol may self-refer or refer to other object.When It refer to or denote another object ,we say the object is model of the string of symbols or meaning (semantics) of the string of symbols Simpson (1998); Otto (2002).The string of symbols represents the object or the model.Obviously when It refer to or denote Itself,the meaning or model and the symbol or string of symbols are the same.The alphabet or text(string of symbols) are not language.They are symbols or strings of symbols that just record the language Clearly ,every encoding has priori information if the encoding represents any semantic information of the unverse or object.Encoding means mapping from the unverse to the string or strings of digits. The semantic here is used in the model-theoretic sense or denotation of the object .By choosing a string or code that maps the entities,relation and function in the unverse to symbols and the relation,function of the symbols ,We encode our knowledge about the model or object too.If we encode the object by randomly assigning the object to a string everyone or machine can not recognize or get any information about the unverse or the object without the assignment.For instance,by isomorphism ,a group is mapped to a group which maintain any information of the former one such as relations function etc.If the group is mapped to an other structure randomly ,we can not get any information about the former one from the latter one without the mapping,even when we know there exist a mapping from the group to the structure. We may consider the a logical sentence as the code of its model.A more concrete example is the binary code of integer.If the mapping from integer to binary code is random,we can not recover the integer from its binary code without the mapping.Even the mapping is not random ,that is, the mapping is recursive or computable ,we have to make effort to get the information if we know there exists a mapping that is recursive,or we are unable to get any information about the integer.Afterall ,the mapping and the model a string correspond to are priori information that human being provide. Therefore,it is true that every encoding has priori information which is symbolization(mapping to symbol) of part or all of the human being’s knowledge about the model.Even when ”As for the objection concerning the coding chosen for our texts, one has to remember that a zipper reads the sequences of characters which one inputs to it, nothing more than this. The idea of comparing languages written with different alphabets cannot forget this simple statement. In order to compare languages written with different alphabets one should, for instance, consider texts written with the phonetic alphabet. This is the reason for not having included in our preliminary analysis of the language tree languages such as Chinese, Greek, Russian, etc.”, the phonetic alphabet with which the texts are written encodes the knowledge of human about the language. Hence,if the distance that Benedetto et al.define is capable of the measure of similarity of the compressed text,It at most measures the similarity between the two text compared .If the alphabet computationally represent some information of language ,the distance resulted from the comparison is the measure of the similarity of information of the language.Otherwise It is just the measure of the similarity of the text. When the compression technique is applied to DNA sequence to cluster DNA,the distance is just the measure of the similarity.Only under the presupposition that DNA is mapping of features of creature can we get some information of creature such as evolution relation or family tree. Secondly ,the language tree may not be a family tree .Indo-European family of languages is not a concept that describe the family composed of descendants and their ancestor H.Robins (1973). Many Languages are descendants of a same archaic one.They are very similar in spelling,syntax even meaning or semantics when they inherit or use the same alphabet.Historical linguist compare language in spelling (phonetics),syntax and meaning to reconstruct their ancestor.But unfortunately these effort and results are proved not to be solid or reliable in many cases without data such as historical text record .Rather,We know that similarity may be because of type of languages that happen to be similar in some aspect ,interaction between languages which is called linguistic union or being descendant of a same ancient father.There is no genetic relationship between languages, but they still share features, and they are spoken in the same region .Balkan linguistic union or sprachbunds, such as Albanian, Greek, Bulgarian and Romanian are all IE languages .However, they are not closely related. Classification of languages may be genetic typological or areal(linguistic union) H.Robins (1973).So,what does the term ”language tree” mean?It may not be a family tree in the sense of historical linguistics.Rather it just means the similarity H.Robins (1973).By the technique,Benedetto et al.just show the similarity between the texts ,or the similarity between the languages that may not be similarity among members of family only if the similarity between the text (strings or symbols) is the mapping of the similarity between the languages adequately and truly.The language tree is not able to be considered as a family tree in the sense of historical linguistics. Thirdly,the distance Benedetto et al.define in their Letter is similar to the NID definition by Li Ming Li and Vitanyi (1997).As we discuss relation between the encoding and model above,if encoding or strings of symbols is the adequate and true mapping of model or object,and the mapping is recursive or computable ,the distance between two strings(text)is mapping the distance between models.We then are able to measure the distance by computing the distance between the two strings.Oherwise,we may take a misleading course. There is intention (presupposition) in pure mathematic research that the mapping from model to string is not considered as a key question.But application to practical problem may cause trouble or error.In fact,it has to be solved firstly to decide wether mapping from model to string or strings contains the information of the model,although we often do the mapping that is heuristic and valid. As everyone knows,theory of physics is the ”strings”,and experiments of physics is to test or check wether the mapping is valid.The empirical science may be consider as searching for and testing mapping. ###### Acknowledgements. Thank Ming-Hui Zhang who works as a faculty in Physics Department of Anhui University for helpful discussion. ## References * Benedetto et al. (2002) D. Benedetto, E. Caglioti, and V. Loreto, Phys. Rev. Lett. 88, 048702 (2002). * Benedetto et al. (2003) D. Benedetto, E. Caglioti, and V. Loreto, Phys. Rev. Lett. 90, 089804 (2003). * Khmelev and Teahan (2003) D. V. Khmelev and W. J. Teahan, Phys. Rev. Lett. 90, 089803 (2003). * Simpson (1998) S. G. Simpson, _Model Theory_ (1998), URL http://www.math.psu.edu/simpson/courses/math563. * Otto (2002) M. Otto, _Algorithmic Model Theory for Specific Semantic Domains_ (2002), URL http://www-compsci.swan.ac.uk/~csmartin/amt.html. * H.Robins (1973) R. H.Robins, Current Trends in Linguistics 11, 3 (1973). * Li and Vitanyi (1997) M. Li and P. M. B. Vitanyi, _An Introduction to Kolmogorov Complexity and Its Applications_ (Springer-Verlag, Berlin, 1997), second edition ed.
arxiv-papers
2009-03-21T14:29:11
2024-09-04T02:49:01.331321
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Xiuli Wang", "submitter": "Xiu-Li Wang", "url": "https://arxiv.org/abs/0903.3669" }
0903.3786
# Multiple-Input Multiple-Output Gaussian Broadcast Channels with Confidential Messages Ruoheng Liu, Tie Liu, H. Vincent Poor, and Shlomo Shamai (Shitz) This research was supported by the United States National Science Foundation under Grants CNS-06-25637 and CCF-07-28208, the European Commission in the framework of the FP7 Network of Excellence in Wireless Communications NEWCOM++, and the Israel Science Foundation.Ruoheng Liu and H. Vincent Poor are with the Department of Electrical Engineering, Princeton University, Princeton, NJ 08544, USA (e-mail: {rliu,poor}@princeton.edu).Tie Liu is with the Department of Electrical and Computer Engineering, Texas A&M University, College Station, TX 77843, USA (e-mail: tieliu@tamu.edu).Shlomo Shamai (Shitz) is with the Department of Electrical Engineering, Technion-Israel Institute of Technology, Technion City, Haifa 32000, Israel (e-mail: sshlomo@ee.technion.ac.il). ###### Abstract This paper considers the problem of secret communication over a two-receiver multiple-input multiple-output (MIMO) Gaussian broadcast channel. The transmitter has two independent messages, each of which is intended for one of the receivers but needs to be kept asymptotically perfectly secret from the other. It is shown that, surprisingly, under a matrix power constraint both messages can be simultaneously transmitted at their respective maximal secrecy rates. To prove this result, the MIMO Gaussian wiretap channel is revisited and a new characterization of its secrecy capacity is provided via a new coding scheme that uses artificial noise and random binning. ###### Index Terms: Artificial noise, broadcast channel, channel enhancement, information- theoretic security, multiple-input multiple-output (MIMO) communications, wiretap channel ## I Introduction Rapid advances in wireless technology are quickly moving us toward a pervasively connected world in which a vast array of wireless devices, from iPhones to biosensors, seamlessly communicate with one another. The openness of the wireless medium makes wireless transmission especially susceptible to eavesdropping. Hence, security and privacy issues have become increasingly critical for wireless networks. Although wireless technologies are becoming more and more secure, eavesdroppers are also becoming smarter. Sole reliance on cryptographic keys in large distributed networks where terminals can be compromised is no longer sustainable from the security perspective. Furthermore, in wireless networks, secure initial key distribution is difficult and, in fact, can be performed in perfect secrecy only via physical layer techniques. Therefore, tackling security at the very basic physical layer is of critical importance. In this paper, we study the problem of secret communication over the multiple- input multiple-output (MIMO) Gaussian broadcast channel with two receivers. The transmitter is equipped with $t$ transmit antennas, and receiver $k$, $k=1,2$, is equipped with $r_{k}$ receive antennas. A discrete-time sample of the channel can be written as $\mathbf{Y}_{k}[m]=\mathbf{H}_{k}\mathbf{X}[m]+\mathbf{Z}_{k}[m],\quad k=1,2$ (1) where $\mathbf{H}_{k}$ is the (real) channel matrix of size $r_{k}\times t$, and $\\{\mathbf{Z}_{k}[m]\\}_{m}$ is an independent and identically distributed (i.i.d.) additive vector Gaussian noise process with zero mean and identity covariance matrix. The channel input $\\{\mathbf{X}[m]\\}_{m}$ is subject to the matrix power constraint: $\frac{1}{n}\sum_{m=1}^{n}\left(\mathbf{X}[m]\mathbf{X}^{\intercal}[m]\right)\preceq\mathbf{S}$ (2) where $\mathbf{S}$ is a positive semidefinite matrix, and “$\preceq$” denotes “less than or equal to” in the positive semidefinite ordering between real symmetric matrices. Note that (2) is a rather general power constraint that subsumes many other important power constraints including the average total and per-antenna power constraints as special cases. Figure 1: MIMO Gaussian broadcast channel with confidential messages. Consider the communication scenario in which there are two independent messages $W_{1}$ and $W_{2}$ at the transmitter. Message $W_{1}$ is intended for receiver 1 but needs to be kept secret from receiver 2, and message $W_{2}$ is intended for receiver 1 but needs to be kept secret from receiver 2. (See Fig. 1 for an illustration of this communication scenario.) The confidentiality of the messages at the unintended receivers is measured using the normalized information-theoretic quantities [1, 2]: $\frac{1}{n}I(W_{1};\mathbf{Y}_{2}^{n})\rightarrow 0\quad\mbox{and}\quad\frac{1}{n}I(W_{2};\mathbf{Y}_{1}^{n})\rightarrow 0$ where $\mathbf{Y}_{k}^{n}:=(\mathbf{Y}_{k}[1],\ldots,\mathbf{Y}_{k}[n])$, and the limits are taken as the block length $n\rightarrow\infty$. The goal is to characterize the entire secrecy rate region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})=\\{(R_{1},R_{2})\\}$ that can be achieved by any coding scheme. ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ is usually known as the _secrecy capacity region_ of the channel. In recent years, information-theoretic study of secret MIMO communication has been an active area of research. (See [3] for a recent survey of progress in this area.) Most noticeably, the secrecy capacity of the MIMO Gaussian wiretap channel was characterized in [4, 5, 6] for the multiple-input single-output (MISO) case and [7, 8, 9, 10] for the general MIMO case. The secrecy capacity region of the MIMO Gaussian broadcast channel with a common and a confidential messages was characterized in [11]. The problem of communicating two confidential messages over the two-receiver MIMO Gaussian broadcast channel was first considered in [12], where it was shown that under the average total power constraint, secret dirty-paper coding (S-DPC) based on double binning [13] achieves the secrecy capacity region for the MISO case. For the general MIMO case, however, characterizing the secrecy capacity region remained as an open problem. The main result of this paper is a precise characterization of the secrecy capacity region of the (general) MIMO Gaussian broadcast channel, summarized in the following theorem. ###### Theorem 1 The secrecy capacity region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ of the MIMO Gaussian broadcast channel (1) with confidential messages $W_{1}$ (intended for receiver 1 but needing to be kept secret from receiver 2) and $W_{2}$ (intended for receiver 2 but needing to be kept secret from receiver 1) under the matrix power constraint (2) is given by the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right)$ $\displaystyle\text{and}\qquad R_{2}$ $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right)$ (3) where $\mathbf{I}_{r_{k}}$ denotes the identity matrix of size $r_{k}\times r_{k}$. ###### Remark 1 Note that the rate region (3) is _rectangular_. This implies that under the matrix power constraint, both confidential messages $W_{1}$ and $W_{2}$ can be _simultaneously_ transmitted at their respective maximal secrecy rates (as if over two separate MIMO Gaussian wiretap channels). The secrecy capacity of the MIMO Gaussian wiretap channel under the matrix power constraint was characterized in [9], by which the rate region (3) can be rewritten as the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right)$ $\displaystyle\text{and}\qquad R_{2}$ $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|\right).$ (4) ###### Remark 2 Also note that if $\mathbf{B}^{\star}$ is an optimal solution to the optimization program: $\displaystyle\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right),$ (5) then $\mathbf{B}^{\star}$ _simultaneously_ maximizes both objective functions on the right-hand side (RHS) of (3). On the other hand, the optimization programs on the RHS of (4) do not, in general, admit the same optimal solution. As we will see, this makes (3) a better choice when it comes to proving the achievability part of the theorem. It is rather surprising to see that under the matrix power constraint, both confidential messages $W_{1}$ and $W_{2}$ can be simultaneously transmitted at their respective maximal secrecy rates over the MIMO Gaussian broadcast channel (1). As we will see, this is due to the fact that there are in fact two different coding schemes: one uses only random binning, and the other uses both random binning and _artificial noise_. Both of them can achieve the secrecy capacity of the MIMO Gaussian wiretap channel. Through S-DPC (double binning) [13], both schemes can be _simultaneously_ implemented in communicating confidential messages $W_{1}$ and $W_{2}$ over the MIMO Gaussian broadcast channel (1). As a corollary, we have the following characterization of the secrecy capacity region under the average total power constraint. The result is a simple consequence of [14, Lemma 1]. ###### Corollary 1 The secrecy capacity region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)$ of the MIMO Gaussian broadcast channel (1) with confidential messages $W_{1}$ (intended for receiver 1 but needing to be kept secret from receiver 2) and $W_{2}$ (intended for receiver 2 but needing to be kept secret from receiver 1) under the average total power constraint: $\frac{1}{n}\sum_{m=1}^{n}\|\mathbf{X}[m]\|^{2}\leq P$ (6) is given by the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}_{1}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}_{1}\mathbf{H}_{2}^{\intercal}\right|$ $\displaystyle\mbox{and}\quad\quad R_{2}$ $\displaystyle\leq\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}(\mathbf{B}_{1}+\mathbf{B}_{2})\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}_{1}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}(\mathbf{B}_{1}+\mathbf{B}_{2})\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}_{1}\mathbf{H}_{1}^{\intercal}}\right|$ (7) for some positive semidefinite matrices $\mathbf{B}_{1}$ and $\mathbf{B}_{2}$ such that ${\sf Tr}(\mathbf{B}_{1}+\mathbf{B}_{2})\leq{P}$. ###### Remark 3 Unlike Theorem 1, under the average total power constraint, the secrecy capacity region of the MIMO Gaussian broadcast channel is, in general, _not_ rectangular. The rest of the paper is devoted to the proof of Theorem 1. As mentioned previously, the rectangular nature of the rate region (3) suggests that the result is intimately connected to the secrecy capacity of the MIMO Gaussian wiretap channel. The secrecy capacity of the MIMO Gaussian wiretap channel under the matrix power constraint was previously characterized in [9], where it was shown that Gaussian random binning _without_ prefix coding is optimal. In Section II, we revisit the MIMO Gaussian wiretap channel problem and show that Gaussian random binning _with_ prefix coding can also achieve the secrecy capacity, provided that the prefix channel is appropriately chosen. In Section III, we prove Theorem 1 using two different characterizations of the secrecy capacity of the MIMO Gaussian wiretap channel and S-DPC (double binning) [13]. Numerical examples are provided in Section IV to illustrate the theoretical results. Finally, in Section V, we conclude the paper with some remarks. ## II MIMO Gaussian Wiretap Channel Revisited In this section, we revisit the problem of the MIMO Gaussian wiretap channel under a matrix power constraint. The problem was first considered in [9], where a precise characterization of the secrecy capacity was provided. The goal of this section is to provide an alternative characterization of the secrecy capacity which will facilitate proving Theorem 1. More specifically, we wish to provide a MIMO wiretap channel bound on the secrecy rate $R_{2}$ which will match the RHS of (3). For that purpose, consider again the MIMO Gaussian broadcast channel (1) but this time with only one confidential message $W$ at the transmitter. Message $W$ is intended for receiver 2 (the legitimate receiver) but needs to be kept secret from receiver 1 (the eavesdropper). The confidentiality of $W$ at receiver 1 is measured using the normalized information-theoretic quantity [1, 2]: $\frac{1}{n}I(W;\mathbf{Y}_{1}^{n})\rightarrow 0.$ The channel input $\\{\mathbf{X}[m]\\}_{m}$ is subject to the matrix power constraint (2). The goal is to characterize the secrecy capacity $C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$111In our notation, the first argument in $C_{s}(\cdot)$ represents the channel matrix for the legitimate receiver, and the second argument represents the channel matrix for the eavesdropper., which is the maximum achievable secrecy rate for message $W$. This communication scenario, as illustrated in Fig. 2, is widely known as the MIMO Gaussian wiretap channel [4, 6, 5, 7, 8, 9]. Figure 2: MIMO Gaussian wiretap channel. In their seminal work [2], Csiszár and Körner provided a single-letter characterization of the secrecy capacity: $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})=\max_{(U,\mathbf{X})}\left[I(U;\mathbf{Y}_{2})-I(U;\mathbf{Y}_{1})\right]$ (8) where $U$ is an auxiliary variable, and the maximization is over all jointly distributed $(U,\mathbf{X})$ such that $U\rightarrow\mathbf{X}\rightarrow(\mathbf{Y}_{1},\mathbf{Y}_{2})$ forms a Markov chain and ${\sf E}[\mathbf{X}\mathbf{X}^{\intercal}]\preceq\mathbf{S}$. Here, $I(U,\mathbf{Y}_{k})$ denotes the mutual information between $U$ and $\mathbf{Y}_{k}$. As shown in [2], the secrecy rate on the RHS of (8) can be achieved by a coding scheme that combines random binning and prefix coding [2]. More specifically, the auxiliary variable $U$ represents a precoding signal, and the conditional distribution of $\mathbf{X}$ given $U$ represents the prefix channel. In [9], Liu and Shamai further studied the optimization problem on the RHS of (8) and showed that a Gaussian $U=\mathbf{X}$ is an optimal solution. Hence, a matrix characterization of the secrecy capacity is given by [9] $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|\right).$ (9) We may conclude that Gaussian random binning _without_ prefix coding is an optimal coding strategy for the MIMO Gaussian wiretap channel. Next, we show that a different coding scheme that combines Gaussian random binning _and_ prefix coding can also achieve the secrecy capacity of the MIMO Gaussian wiretap channel. This leads to a new characterization of the secrecy capacity, summarized in the following theorem. ###### Theorem 2 The secrecy capacity $C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$ of the MIMO Gaussian broadcast channel (1) with a confidential message $W$ (intended for receiver 2 but needing to be kept secret from receiver 1) under the matrix power constraint (2) is given by: $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right).$ (10) ###### Remark 4 The achievability of the secrecy rate on the RHS of (10) can be obtained from the Csiszár-Körner expression (8) by choosing $\mathbf{X}=U+V$, where $U$ and $V$ are two independent Gaussian vectors with zero means and covariance matrices $\mathbf{S}-\mathbf{B}$ and $\mathbf{B}$, respectively. This choice of $(U,\mathbf{X})$ differs from that for (9) in two important ways: 1. 1. In (10), the input vector $\mathbf{X}$ always has a full covariance matrix $\mathbf{S}$. For (9), the covariance matrix of $\mathbf{X}$ needs to be chosen to solve an optimization program; the full covariance matrix $\mathbf{S}$ is _not_ always an optimal solution. 2. 2. In (10), the conditional distribution of $\mathbf{X}$ given $U$ may form a _nontrivial_ prefix channel. For (9), $U\equiv\mathbf{X}$ so prefix coding is never applied. ###### Remark 5 Note that the prefix channel in (10) is an additive vector Gaussian noise channel, so the auxiliary variable $V$ represents an _artificial_ noise [15] sent (on purpose) by the transmitter to confuse the eavesdropper. Since the artificial noise has no structure to it, it will add to the noise floor at both legitimate receiver and the eavesdropper. The converse part of the theorem can be proved using a _channel-enhancement_ argument, similar to that in [9]. The details of the proof are provided in Appendix A. ## III MIMO Gaussian Broadcast Channel with Confidential Messages In this section, we prove Theorem 1. To prove the converse part of the theorem, we will consider a single-message, wiretap channel bound on the secrecy rates $R_{1}$ and $R_{2}$. More specifically, note that both messages $W_{1}$ and $W_{2}$ can be transmitted at the maximum secrecy rate when the other message is absent from the transmission. Therefore, to bound from above the secrecy rate $R_{1}$, we assume that only $W_{1}$ needs to be communicated over the channel. This is precisely a MIMO Gaussian wiretap channel problem with receiver 1 as legitimate receiver and receiver 2 as eavesdropper. Reversing the roles of receiver 1 and 2, we have from (9) that $\displaystyle R_{1}$ $\displaystyle\leq C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right).$ (11) Similarly, to bound from above the secrecy rate $R_{2}$, let us assume that only $W_{2}$ needs to be communicated over the channel. This is, again, a MIMO Gaussian wiretap channel problem with receiver 2 playing the role of legitimate receiver and receiver 1 playing the role of eavesdropper. By Theorem 2, $\displaystyle R_{2}$ $\displaystyle\leq C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right).$ (12) Putting together (11) and (12), we have proved the converse part of the theorem. Next, we show that every rate pair $(R_{1},R_{2})$ within the secrecy rate region (3) is achievable. Note that (3) is rectangular, so we only need to show that the corner point $(R_{1},R_{2})$ given by $\displaystyle R_{1}$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right)$ $\displaystyle\text{and}\qquad R_{2}$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right)$ (13) is achievable. Recall from [13] that for any jointly distributed $(V_{1},V_{2},\mathbf{X})$ such that $(V_{1},V_{2})\rightarrow\mathbf{X}\rightarrow(\mathbf{Y}_{1},\mathbf{Y}_{2})$ forms a Markov chain and ${\sf E}[\mathbf{X}\mathbf{X}^{\intercal}]\preceq\mathbf{S}$, the secrecy rate pair $(R_{1},R_{2})$ given by $\displaystyle R_{1}$ $\displaystyle=I(V_{1};\mathbf{Y}_{1})-I(V_{1};V_{2},\mathbf{Y}_{2})$ $\displaystyle\text{and}\qquad R_{2}$ $\displaystyle=I(V_{2};\mathbf{Y}_{2})-I(V_{2};V_{1},\mathbf{Y}_{1})$ (14) is achievable for the MIMO Gaussian broadcast channel (1) under the matrix power constraint (2). In [13], the achievability of the rate pair (14) was proved using a _double-binning_ scheme. Specifically, the auxiliary variables $V_{1}$ and $V_{2}$ represent the precoding signals for the confidential messages $W_{1}$ and $W_{2}$, respectively. Now let $\mathbf{B}$ be a positive semidefinite matrix such that $\mathbf{B}\preceq\mathbf{S}$, and let $\displaystyle V_{1}$ $\displaystyle=\mathbf{U}_{1}+\mathbf{F}\mathbf{U}_{2}$ $\displaystyle V_{2}$ $\displaystyle=\mathbf{U}_{2}$ $\displaystyle\mbox{and}\quad\quad\mathbf{X}$ $\displaystyle=\mathbf{U}_{1}+\mathbf{U}_{2}$ (15) where $\mathbf{U}_{1}$ and $\mathbf{U}_{2}$ are two independent Gaussian vectors with zero means and covariance matrices $\mathbf{B}$ and $\mathbf{S}-\mathbf{B}$, respectively, and $\displaystyle\mathbf{F}$ $\displaystyle:=\mathbf{B}\mathbf{H}_{1}^{\intercal}(\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal})^{-1}\mathbf{H}_{1}.$ (16) By (15), $\mathbf{Y}_{k}=\mathbf{H}_{k}(\mathbf{U}_{1}+\mathbf{U}_{2})+\mathbf{Z}_{k}$ for $k=1,2$. Note that the matrix $\mathbf{F}$ defined in (16) is precisely the _precoding_ matrix for suppressing $\mathbf{U}_{2}$ from $\mathbf{Y}_{1}$ [16, Theorem 1]. Hence, $\displaystyle I(V_{1};\mathbf{Y}_{1})-I(V_{1};V_{2})$ $\displaystyle=I(V_{1};\mathbf{Y}_{1})-I(V_{1};\mathbf{U}_{2})$ $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|.$ (17) Moreover, $\displaystyle I(V_{1};\mathbf{Y}_{2}|V_{2})$ $\displaystyle=I(\mathbf{U}_{1}+\mathbf{F}\mathbf{U}_{2};\mathbf{H}_{2}(\mathbf{U}_{1}+\mathbf{U}_{2})+\mathbf{Z}_{2}|\mathbf{U}_{2})$ $\displaystyle=I(\mathbf{U}_{1};\mathbf{H}_{2}\mathbf{U}_{1}+\mathbf{Z}_{2}|\mathbf{U}_{2})$ $\displaystyle=I(\mathbf{U}_{1};\mathbf{H}_{2}\mathbf{U}_{1}+\mathbf{Z}_{2})$ $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|$ (18) where the third equality follows from the fact that $\mathbf{U}_{1}$ and $\mathbf{U}_{2}$ are independent. Putting together (17) and (18), we have $\displaystyle I(V_{1};\mathbf{Y}_{1})-I(V_{1};V_{2},\mathbf{Y}_{2})$ $\displaystyle=[I(V_{1};\mathbf{Y}_{1})-I(V_{1};V_{2})]-I(V_{1};\mathbf{Y}_{2}|V_{2})$ $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|.$ (19) Similarly, $\displaystyle I(V_{1},V_{2};\mathbf{Y}_{1})$ $\displaystyle=I(\mathbf{U}_{1}+\mathbf{F}\mathbf{U}_{2},\mathbf{U}_{2};\mathbf{H}_{1}(\mathbf{U}_{1}+\mathbf{U}_{2})+\mathbf{Z}_{2})$ $\displaystyle=I(\mathbf{U}_{1},\mathbf{U}_{2};\mathbf{H}_{1}(\mathbf{U}_{1}+\mathbf{U}_{2})+\mathbf{Z}_{2})$ $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}\right|.$ (20) Thus, $\displaystyle I(V_{2};V_{1},\mathbf{Y}_{1})$ $\displaystyle=I(V_{2};\mathbf{Y}_{1}|V_{1})+I(V_{2};V_{1})$ $\displaystyle=I(V_{1},V_{2};\mathbf{Y}_{1})-[I(V_{1};\mathbf{Y}_{1})-I(V_{1};V_{2})]$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|$ (21) where the last equality follows from (17) and (20). Moreover, $\displaystyle I(V_{2};\mathbf{Y}_{2})$ $\displaystyle=I(\mathbf{U}_{2};\mathbf{H}_{2}(\mathbf{U}_{1}+\mathbf{U}_{2})+\mathbf{Z}_{2})$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|.$ (22) Putting together (21) and (22), we have $\displaystyle I(V_{2};\mathbf{Y}_{2})-I(V_{2};V_{1},\mathbf{Y}_{1})$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|.$ (23) Finally, let $\mathbf{B}$ be an optimal solution to the optimization program (5). As mentioned previously in Remark 2, such a choice will _simultaneously_ maximize the RHS of (19) and (23). Thus, the corner point (13) is indeed achievable. This completes the proof of the theorem. ###### Remark 6 Note that in standard dirty-paper coding (DPC), the precoding matrix $\mathbf{F}$ is chosen to cancel the known interference. In our scheme, such a choice plays two important roles. First, it helps to cancel the precoding signal representing message $W_{2}$, so message $W_{1}$ sees an interference- free legitimate receiver channel. Second, it helps to boost the security for message $W_{2}$ by causing interference to its eavesdropper. For this reason, we call our scheme S-DPC, to differentiate from the standard DPC. ###### Remark 7 In S-DPC, both the legitimate receiver and the eavesdropper for message $W_{1}$ are interference free. On the other hand, for message $W_{2}$, both the legitimate receiver and the eavesdropper are subject to interference from the precoding signal representing message $W_{1}$. As we have seen in Section II, the secrecy capacity of the MIMO Gaussian wiretap channel can be achieved with or without interference in place. Therefore, both secrecy capacity achieving schemes can be simultaneously implemented via S-DPC to simultaneously communicate both confidential messages at their respective maximal secrecy rates. ## IV Numerical Examples In this section, we provide numerical examples to illustrate the secrecy capacity region of the MIMO Gaussian wiretap channel with confidential messages. As shown in (3) and (7), under both matrix and average total power constraints, the secrecy capacity regions ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ and ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)$ are expressed in terms of matrix optimization programs (though implicit in (7)). In general, these optimization programs are not convex, and hence, finding the boundary of the secrecy capacity regions is nontrivial. In [12], a precise characterization of the secrecy capacity region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)$ was obtained for the _MISO_ Gaussian broadcast channel using the generalized eigenvalue decomposition [17, Ch. 6.3]. For the _aligned_ MIMO Gaussian wiretap channel, [10] provided an explicit, closed-form expression for the secrecy capacity. In the following, we generalize the results of [10] and [12] to the general MIMO Gaussian broadcast channel under the matrix power constraint. Let $\phi_{j}$, $j=1,\ldots,t$, be the generalized eigenvalues of the pencil $\displaystyle\left(\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{1}^{\intercal}\mathbf{H}_{1}\mathbf{S}^{\frac{1}{2}},\;\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{2}^{\intercal}\mathbf{H}_{2}\mathbf{S}^{\frac{1}{2}}\right).$ (24) Since both $\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{1}^{\intercal}\mathbf{H}_{1}\mathbf{S}^{\frac{1}{2}}$ and $\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{2}^{\intercal}\mathbf{H}_{2}\mathbf{S}^{\frac{1}{2}}$ are strictly positive definite, we have $\phi_{j}>0$ for $j=1,\dots,t$. Without loss of generality, we may assume that these generalized eigenvalues are ordered as $\phi_{1}\geq\dots\geq\phi_{\rho}>1\geq\phi_{\rho+1}\geq\dots\geq\phi_{t}>0,$ i.e., a total of $\rho$ of them are assumed to be greater than $1$. We have the following characterization of the secrecy capacity of the MIMO Gaussian wiretap channel under the matrix power constraint, which is a natural extension of [10]. ###### Theorem 3 The secrecy capacity $C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ of the MIMO Gaussian broadcast channel (1) with confidential message $W$ (intended for receiver 1 but needing to be kept secret from receiver 2) under the matrix power constraint (2) is given by $\displaystyle C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})=\frac{1}{2}\sum_{j=1}^{\rho}\log\phi_{j}$ (25) where $\phi_{j}$, $j=1,\ldots,\rho$, are the generalized eigenvalues of the pencil (24) that are greater than 1. ###### Remark 8 Note that $\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{2}^{\intercal}\mathbf{H}_{2}\mathbf{S}^{\frac{1}{2}}$ is invertible, so computing the generalized eigenvalues of the pencil (24) can be reduced to the problem of finding standard eigenvalues of a related semidefinite matrix [17, Ch. 6.3]. Hence, the secrecy capacity expression (25) is computable. A proof of the theorem following the approach of [10] is provided in Appendix B. As a corollary, we have the following characterization of the secrecy capacity region of the MIMO Gaussian broadcast channel with confidential messages under the matrix power constraint. ###### Corollary 2 The secrecy capacity region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ of the MIMO Gaussian broadcast channel (1) with confidential messages $W_{1}$ (intended for receiver 1 but needing to be kept secret from receiver 2) and $W_{2}$ (intended for receiver 2 but needing to be kept secret from receiver 1) under the matrix constraint (2) is given by the set of nonnegative rate pairs $(R_{1},R_{2})$ such that $\displaystyle R_{1}$ $\displaystyle\leq\frac{1}{2}\sum_{j=1}^{\rho}\log\phi_{j}$ $\displaystyle\text{and}\qquad R_{2}$ $\displaystyle\leq\frac{1}{2}\sum_{j=\rho+1}^{t}\log\frac{1}{\phi_{j}}$ (26) where $\phi_{j}$, $j=1,\ldots,\rho$, are the generalized eigenvalues of the pencil (24) that are greater than 1, and $\phi_{j}$, $j=\rho+1,\ldots,t$, are the generalized eigenvalues of the pencil (24) that are less than or equal to 1. ###### Proof: By Theorem 1, we only need to show that the secrecy capacity $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})=\frac{1}{2}\sum_{j=\rho+1}^{t}\log\frac{1}{\phi_{j}}.$ Consider the pencil $\displaystyle\left(\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{2}^{\intercal}\mathbf{H}_{2}\mathbf{S}^{\frac{1}{2}},\;\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{H}_{1}^{\intercal}\mathbf{H}_{1}\mathbf{S}^{\frac{1}{2}}\right).$ (27) Note that the pencils (24) and (27) are generated by the same pair of semidefinite matrices but with different order. Therefore, the generalized eigenvalues of the pencil (27) are given by $0<\frac{1}{\phi_{1}}\leq\dots\leq\frac{1}{\phi_{\rho}}<1\leq\frac{1}{\phi_{\rho+1}}\leq\dots\leq\frac{1}{\phi_{t}}.$ Applying Theorem 3 for $C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$ completes the proof of the corollary. ∎ Under the average total power constraint, we have not been able to find a computable secrecy capacity expression for the general MIMO case. We can, however, write [14, Lemma 1] ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)=\bigcup_{\mathbf{S}\succeq 0,\;{\sf Tr}(\mathbf{S})\leq P}{\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S}).$ For any given semidefinite $\mathbf{S}$, ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ can be computed as given by (26). Then, the secrecy capacity region ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)$ can be found through an exhaustive search over the set $\\{\mathbf{S}:\;\mathbf{S}\succeq 0\;\mbox{and}\;{\sf Tr}(\mathbf{S})\leq P\\}$. (a) $r_{1}=r_{2}=1$ (b) $r_{1}=2$, $r_{2}=1$ (c) $r_{1}=1$, $r_{2}=2$ (d) $r_{1}=r_{2}=2$ Figure 3: Secrecy rate regions of the MIMO Gaussian broadcast channel under the average total power constraint. Let $\mathbf{h}_{11}=(0.3\;2.5)$, $\mathbf{h}_{12}=(2.2\;1.8)$, $\mathbf{h}_{21}=(1.3\;1.2)$, $\mathbf{h}_{22}=(1.5\;3.9)$ and $P=12$, and let $\displaystyle\mathbf{H}_{k}$ $\displaystyle=\left(\begin{array}[]{c}\mathbf{h}_{k1}\\\ \mathbf{h}_{k2}\\\ \end{array}\right),\quad k=1,2.$ The secrecy capacity regions ${\mathcal{C}}_{s}(\mathbf{h}_{11},\mathbf{h}_{22},P)$, ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{h}_{22},P)$, ${\mathcal{C}}_{s}(\mathbf{h}_{11},\mathbf{H}_{2},P)$ and ${\mathcal{C}}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},P)$ are illustrated in Fig. 3. For comparison, we have also plotted the secrecy rate regions achieved by the simple zero-forcing (ZF) strategy. In ZF, each of the confidential messages is encoded using a vector Gaussian signal. To guarantee confidentiality, the covariance matrices of the transmit signals are chosen in the _null_ space of the channel matrix at the unintended receiver. Hence, the achievable secrecy rate region is given by $\displaystyle{\mathcal{R}}_{S}^{\rm ZF}(\mathbf{H}_{1},\mathbf{H}_{2},P)=\bigcup_{\begin{subarray}{c}\mathbf{B}_{1}\succeq 0,\;\mathbf{B}_{2}\succeq 0,\;{\sf Tr}(\mathbf{B}_{1}+\mathbf{B}_{2})\leq P\\\ \mathbf{H}_{2}\mathbf{B}_{1}=0,\;\mathbf{H}_{1}\mathbf{B}_{2}=0\end{subarray}}\left\\{(R_{1},R_{2})\left|\;\begin{array}[]{l}R_{1}\leq\frac{1}{2}\log|\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}_{1}\mathbf{H}_{1}^{\intercal}|\\\ R_{2}\leq\frac{1}{2}\log|\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}_{2}\mathbf{H}_{2}^{\intercal}|\end{array}\right.\right\\}.$ (30) Note that unlike the secrecy capacity region expression (7), computing the rate region (30) only involves solving convex optimization programs. As shown in Fig. 3, in all four scenarios, ZF is strictly suboptimal as compared with S-DPC. In particular, if the channel matrix of the unintended receiver has full row rank, ZF cannot achieve any positive secrecy rate for the corresponding confidential message. On the other hand, S-DPC can always achieve positive secrecy rates for both confidential messages unless the MIMO Gaussian broadcast channel is degraded. Figure 4: Rate regions of the MIMO Gaussian broadcast channel under the power matrix constraint. Finally, let $\displaystyle\mathbf{H}_{1}$ $\displaystyle=\left(\begin{matrix}1.8&-2.0&2.0\\\ 1.0&-6.0&3.0\end{matrix}\right)$ $\displaystyle\mathbf{H}_{2}$ $\displaystyle=\left(\begin{matrix}2.3&2.0&-3\\\ 2.0&1.2&-1.5\end{matrix}\right)$ and $\displaystyle\mathbf{S}=\left(\begin{matrix}5.0&-0.7&-2.0\\\ -0.7&3.8&-2.5\\\ -2.0&-2.5&5.0\end{matrix}\right).$ Fig. 4 illustrates the secrecy capacity region $\mathcal{C}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ of the MIMO Gaussian broadcast channel (1) under the matrix power constraint (2). Here, the secrecy capacity region $\mathcal{C}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ is plotted based on the computable expression (26). Also in the figure are the secrecy rate region $\mathcal{R}_{s}^{\rm ZF}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ achieved by ZF strategy and the _nonsecrecy_ capacity region $\mathcal{R}^{\rm DPC}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ achieved by standard DPC [14]. As expected, we have $\mathcal{R}_{s}^{\rm ZF}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})\subset\mathcal{C}_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})\subset\mathcal{R}^{\rm DPC}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$. ## V Concluding Remarks In this paper, we have considered the problem of communicating two confidential messages over the two-receiver MIMO Gaussian broadcast channel. Each of the confidential messages is intended for one of the receivers but needs to be kept asymptotically perfectly secret from the other. Precise characterizations of the secrecy capacity region have been provided under both matrix and average total power constraints. Surprisingly, under the matrix power constraint, both confidential messages can be transmitted simultaneously at their respective maximal secrecy rates. To prove this result, we have revisited the problem of the MIMO Gaussian wiretap channel and proposed a new coding scheme that achieves the secrecy capacity of the channel. Unlike the previous scheme considered in [4, 6, 5, 7, 8, 9] where prefix coding is not applied, the new coding scheme uses artificial vector Gaussian noise as a way of prefix coding. Moreover, the optimal covariance matrix of the artificial noise coincides with that of the transmit signal in the previous scheme. This allows both schemes to be overlayed via S-DPC without sacrificing the secrecy rate performance for either of them. We believe that the new understanding of the MIMO Gaussian wiretap channel problem gained in this work will help to solve some other multiuser secret communication problems. ## Appendix A Proof of Theorem 2 In this appendix, we prove Theorem 2. As mentioned previously in Remark 4, the secrecy rate on the RHS of (10) can be achieved by a coding scheme that combines Gaussian random binning and prefix coding. We therefore concentrate on the converse part of the theorem. Following [9], we will first prove the converse result for the special case where the channel matrices $\mathbf{H}_{1}$ and $\mathbf{H}_{2}$ are square and invertible. Next, we will broaden the result to the general case by approximating arbitrary channel matrices $\mathbf{H}_{1}$ and $\mathbf{H}_{2}$ by square and invertible ones. For brevity, we will term the special case as the aligned MIMO Gaussian wiretap channel and the general case as the general MIMO Gaussian wiretap channel. ### A-A Aligned MIMO Gaussian Wiretap Channel Consider the special case of the MIMO Gaussian broadcast channel (1) where the channel matrices $\mathbf{H}_{1}$ and $\mathbf{H}_{2}$ are square and invertible. Multiplying both sides of (1) by $\mathbf{H}_{k}^{-1}$, the channel model can be equivalently written as $\mathbf{Y}_{k}[m]=\mathbf{X}[m]+\mathbf{Z}_{k}[m],\quad k=1,2$ (31) where $\\{\mathbf{Z}_{k}[m]\\}_{m}$ is an i.i.d. additive vector Gaussian noise process with zero mean and covariance matrix $\displaystyle\mathbf{N}_{k}$ $\displaystyle=\mathbf{H}_{k}^{-1}\mathbf{H}_{k}^{-\intercal}.$ (32) Denote by $C_{s}(\mathbf{N}_{2},\mathbf{N}_{1},\mathbf{S})$ the secrecy capacity of (31) (viewed as a MIMO Gaussian wiretap channel with receiver 2 as legitimate receiver and receiver 1 as eavesdropper) under the matrix power constraint (2). We have the following characterization of $C_{s}(\mathbf{N}_{2},\mathbf{N}_{1},\mathbf{S})$. ###### Lemma 1 The secrecy capacity $\displaystyle C_{s}(\mathbf{N}_{2},\mathbf{N}_{1},\mathbf{S})$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{B}+\mathbf{N}_{1}}\right|\right).$ (33) ###### Proof: The achievability of the secrecy rate on the RHS of (33) follows from the achievability of the secrecy rate on the RHS of (10) for the general case and the definition of $\mathbf{N}_{k}$ in (32). To prove the converse result, we will follow [9] and consider a channel-enhancement argument as follows. Let us first assume that $\mathbf{S}\succ 0$. In this case, let $\mathbf{B}^{\star}$ be an optimal solution to the optimization program on the RHS of (33). Then, $\mathbf{B}^{\star}$ must satisfy the following Karush- Kuhn-Tucker conditions [9]: $\displaystyle(\mathbf{B}^{\star}+\mathbf{N}_{1})^{-1}+\mathbf{M}_{1}$ $\displaystyle=(\mathbf{B}^{\star}+\mathbf{N}_{2})^{-1}+\mathbf{M}_{2}$ (34a) $\displaystyle\mathbf{B}^{\star}\mathbf{M}_{1}$ $\displaystyle=0$ (34b) $\displaystyle\text{and}\quad\quad(\mathbf{S}-\mathbf{B}^{\star})\mathbf{M}_{2}$ $\displaystyle=0$ (34c) where $\mathbf{M}_{1}$ and $\mathbf{M}_{2}$ are positive semidefinite matrices. Let $\widetilde{\mathbf{N}}_{1}$ be a real symmetric matrix such that $\displaystyle(\mathbf{B}^{\star}+\widetilde{\mathbf{N}}_{1})^{-1}$ $\displaystyle=(\mathbf{B}^{\star}+\mathbf{N}_{1})^{-1}+\mathbf{M}_{1}.$ (35) From Eqns. (23), (25), (31) and (34) of [9], we have $\displaystyle 0\prec\widetilde{\mathbf{N}}_{1}\preceq\\{\mathbf{N}_{1},\mathbf{N}_{2}\\},$ (36) $\displaystyle\left|\frac{\mathbf{B}^{\star}+\widetilde{\mathbf{N}}_{1}}{\widetilde{\mathbf{N}}_{1}}\right|=\left|\frac{\mathbf{B}^{\star}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|$ (37) and $\displaystyle\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{1}}{\mathbf{B}^{\star}+\widetilde{\mathbf{N}}_{1}}\right|$ $\displaystyle=\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{\star}+\mathbf{N}_{2}}\right|.$ (38) Now consider an enhanced MIMO Gaussian broadcast channel: $\displaystyle\mathbf{Y}_{1}[m]$ $\displaystyle=\mathbf{X}[m]+\mathbf{Z}_{1}[m]$ $\displaystyle\text{and}\qquad\mathbf{Y}_{2}[m]$ $\displaystyle=\mathbf{X}[m]+\tilde{\mathbf{Z}}_{1}[m]$ (39) where $\\{\mathbf{Z}_{1}[m]\\}_{m}$ and $\\{\tilde{\mathbf{Z}}_{1}[m]\\}_{m}$ are i.i.d. additive vector Gaussian noise processes with zero means and covariance matrices $\mathbf{N}_{1}$ and $\widetilde{\mathbf{N}}_{1}$, respectively. Denote by $C_{s}(\widetilde{\mathbf{N}}_{1},\mathbf{N}_{1},\mathbf{S})$ the secrecy capacity of (39) (viewed as a MIMO Gaussian wiretap channel with receiver 2 as legitimate receiver and receiver 1 as eavesdropper) under the matrix constraint (2). Note from (36) that $\widetilde{\mathbf{N}}_{1}\preceq\mathbf{N}_{1}$, so the enhanced MIMO Gaussian wiretap channel (39) is _degraded_. Hence, $\displaystyle C_{s}(\widetilde{\mathbf{N}}_{1},\mathbf{N}_{1},\mathbf{S})$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{1}}{\widetilde{\mathbf{N}}_{1}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{N}_{1}}\right|$ $\displaystyle=\frac{1}{2}\log\left(\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{1}}{\mathbf{S}+\mathbf{N}_{1}}\right|\left|\frac{\mathbf{N}_{1}}{\widetilde{\mathbf{N}}_{1}}\right|\right)$ $\displaystyle=\frac{1}{2}\log\left(\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{1}}{\mathbf{S}+\mathbf{N}_{1}}\right|\left|\frac{\mathbf{B}^{\star}+\mathbf{N}_{1}}{\mathbf{B}^{\star}+\widetilde{\mathbf{N}}_{1}}\right|\right)$ $\displaystyle=\frac{1}{2}\log\left(\left|\frac{\mathbf{S}+\widetilde{\mathbf{N}}_{1}}{\mathbf{B}^{\star}+\widetilde{\mathbf{N}}_{1}}\right|\left|\frac{\mathbf{B}^{\star}+\mathbf{N}_{1}}{\mathbf{S}+\mathbf{N}_{1}}\right|\right)$ $\displaystyle=\frac{1}{2}\log\left(\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{\star}+\mathbf{N}_{2}}\right|\left|\frac{\mathbf{B}^{\star}+\mathbf{N}_{1}}{\mathbf{S}+\mathbf{N}_{1}}\right|\right)$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{\star}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{B}^{\star}+\mathbf{N}_{1}}\right|$ (40) where the first equality follows from [9, Theorem 1]; the third equality follows from (37); and the fifth equality follows from (38). Finally, note from (36) that $\widetilde{\mathbf{N}}_{1}\preceq\mathbf{N}_{2}$, i.e., the legitimate receiver in the enhanced wiretap channel (39) receives a better signal that the legitimate receiver in the original wiretap channel (31). Therefore, $\displaystyle C_{s}(\mathbf{N}_{2},\mathbf{N}_{1},\mathbf{S})$ $\displaystyle\leq C_{s}(\widetilde{\mathbf{N}}_{1},\mathbf{N}_{1},\mathbf{S})$ $\displaystyle=\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{2}}{\mathbf{B}^{\star}+\mathbf{N}_{2}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{S}+\mathbf{N}_{1}}{\mathbf{B}^{\star}+\mathbf{N}_{1}}\right|$ where the last equality follows from (40). This proved the desired converse result for $\mathbf{S}\succ 0$. For the case when $\mathbf{S}\succeq 0$, $|\mathbf{S}|=0$, let $\theta={\sf Rank}(\mathbf{S})<t.$ Following the same footsteps as in the proof of [14, Lemma 2], we can define an _equivalent_ aligned MIMO Gaussian wiretap channel with $\theta$ transmit and receive antennas and a new covariance matrix power constraint that is strictly positive definite. Hence, we can convert the case when $\mathbf{S}\succeq 0$, $|\mathbf{S}|=0$ to the case when $\mathbf{S}\succ 0$ with the same secrecy capacity. This argument can be formally described as follows. Since $\mathbf{S}$ is positive semidefinite, we can write $\displaystyle\mathbf{S}=\mathbf{Q}_{\mathbf{S}}{\bf\Lambda_{\mathbf{S}}}\mathbf{Q}_{\mathbf{S}}^{\intercal}$ where $\mathbf{Q}_{\mathbf{S}}$ is an orthogonal matrix and $\displaystyle{\bf\Lambda_{\mathbf{S}}}={\sf Diag}(\underbrace{0,\dots,0}_{t-\theta},s_{1},\dots,s_{\theta})$ is diagonal with $s_{j}>0$, $j=1,\dots,\theta$. For $k=1,2$, write $\displaystyle\mathbf{Q}_{\mathbf{S}}^{\intercal}\mathbf{N}_{k}\mathbf{Q}_{\mathbf{S}}=\left(\begin{matrix}\mathbf{C}_{k}&\mathbf{D}_{k}\\\ \mathbf{D}_{k}^{\intercal}&\mathbf{E}_{k}\end{matrix}\right)$ where $\mathbf{C}_{k}$, $\mathbf{D}_{k}$ and $\mathbf{E}_{k}$ are (sub)matrices of size $(t-\theta)\times(t-\theta)$, $(t-\theta)\times\theta$ and $\theta\times\theta$, respectively. Let $\displaystyle\mathbf{A}_{k}:=\left(\begin{matrix}\mathbf{I}_{t-\theta}&0_{(t-\theta)\times\theta}\\\ -\mathbf{D}_{k}^{\intercal}\mathbf{C}_{k}^{-1}&\mathbf{I}_{\theta}\end{matrix}\right),\quad k=1,2.$ We now define an intermediate and equivalent channel by multiplying both sides of (31) by an _invertible_ matrix $\mathbf{A}_{k}\mathbf{Q}_{\mathbf{S}}^{\intercal}$: $\displaystyle\mathbf{Y}_{k}^{\prime}[m]$ $\displaystyle=\mathbf{X}^{\prime}[m]+\mathbf{Z}_{k}^{\prime}[m],\quad k=1,2$ (41) where $\displaystyle\mathbf{Y}_{k}^{\prime}[m]$ $\displaystyle=\mathbf{A}_{k}\mathbf{Q}_{\mathbf{S}}^{\intercal}\mathbf{Y}_{k}[m]$ $\displaystyle\mathbf{X}^{\prime}[m]$ $\displaystyle=\mathbf{A}_{k}\mathbf{Q}_{\mathbf{S}}^{\intercal}\mathbf{X}[m]$ $\displaystyle\mbox{and}\quad\quad\mathbf{Z}_{k}^{\prime}[m]$ $\displaystyle=\mathbf{A}_{k}\mathbf{Q}_{\mathbf{S}}^{\intercal}\mathbf{Z}_{k}[m].$ Then, the covariance matrix $\mathbf{N}_{k}^{\prime}$ of the additive Gaussian noise vector $\mathbf{Z}_{k}^{\prime}[m]$ is given by $\displaystyle\mathbf{N}_{k}^{\prime}$ $\displaystyle=\left(\begin{matrix}\mathbf{C}_{k}&0\\\ 0&\mathbf{E}_{k}-\mathbf{D}_{k}^{\intercal}\mathbf{C}_{k}^{-1}\mathbf{D}_{k}\end{matrix}\right).$ (42) and the matrix power constraint (2) becomes $\displaystyle\frac{1}{n}\sum_{m=1}^{n}\mathbf{X}^{\prime}[m]{\mathbf{X}^{\prime}}^{\intercal}[m]\preceq\mathbf{S}^{\prime}$ (43) where $\displaystyle\mathbf{S}^{\prime}$ $\displaystyle=\mathbf{A}_{k}\mathbf{Q}_{\mathbf{S}}^{\intercal}\mathbf{S}\mathbf{Q}_{\mathbf{S}}\mathbf{A}_{k}^{\intercal}$ $\displaystyle=\mathbf{A}_{k}{\bf\Lambda_{\mathbf{S}}}\mathbf{A}_{k}^{\intercal}$ $\displaystyle={\bf\Lambda_{\mathbf{S}}}.$ (44) Note from (44) that $\mathbf{S}^{\prime}$ is diagonal with first $t-\theta$ diagonal elements equal to zero. Thus, the matrix constraint (43) requires that the first $t-\theta$ elements of $\mathbf{X}^{\prime}[m]$ be zero. Moreover, from (42), the first $t-\theta$ and the rest of $\theta$ elements of $\mathbf{Z}^{\prime}_{k}[m]$ are uncorrelated and hence must be independent as $\mathbf{Z}^{\prime}_{k}[m]$ is Gaussian. Therefore, only the latter $\theta$ antennas transmit/receive information regarding message $W$. This allows us to define another _equivalent_ aligned MIMO Gaussian broadcast channel with $\theta$ antennas at the transmitter and each of the receivers: $\displaystyle\overline{\mathbf{Y}}_{k}[m]$ $\displaystyle=\overline{\mathbf{X}}[m]+\overline{\mathbf{Z}}_{k}[m],\quad k=1,2$ (45) where $\displaystyle\overline{\mathbf{Y}}_{k}[m]$ $\displaystyle=\overline{\mathbf{A}}\mathbf{Y}^{\prime}_{k}[m]$ $\displaystyle\overline{\mathbf{X}}[m]$ $\displaystyle=\overline{\mathbf{A}}\mathbf{X}^{\prime}[m]$ $\displaystyle\overline{\mathbf{Z}}_{k}[m]$ $\displaystyle=\overline{\mathbf{A}}\mathbf{Z}^{\prime}_{k}[m]$ and $\overline{\mathbf{A}}=\left[0_{\theta\times(t-\theta)}\;\mathbf{I}_{\theta}\right]$. Now, the matrix power constraint (43) becomes $\displaystyle\frac{1}{n}\sum_{m=1}^{n}\overline{\mathbf{X}}[m]\overline{\mathbf{X}}^{\intercal}[m]\preceq\overline{\mathbf{S}}$ (46) where $\displaystyle\overline{\mathbf{S}}$ $\displaystyle=\overline{\mathbf{A}}\mathbf{S}^{\prime}\overline{\mathbf{A}}^{\intercal}$ $\displaystyle={\sf Diag}(s_{1},\dots,s_{\theta}).$ (47) Note that the matrix power constraint $\overline{\mathbf{S}}$ is _strictly_ positive definite, so we can apply the previous result to the new wiretap channel (45). This completes the proof of the lemma. ∎ ### A-B General MIMO Gaussian Wiretap Channel For the general case, we may assume that the channel matrices $\mathbf{H}_{1}$ and $\mathbf{H}_{2}$ are square but not necessarily invertible. If that is not the case, we can use singular value decomposition (SVD) to show that there is an equivalent channel which does have $t\times t$ square channel matrices. That is, we can find a new channel with square channel matrices which are derived from the original ones via matrix multiplications. The new channel is equivalent to the original one in preserving the secrecy capacity under the same power constraint. Consider using SVD to write the channel matrices as follows: $\mathbf{H}_{k}=\mathbf{U}_{k}\boldsymbol{\Lambda}_{k}\mathbf{V}_{k}^{\intercal},\quad k=1,2$ where $\mathbf{U}_{k}$ and $\mathbf{V}_{k}$ are $t\times t$ orthogonal matrices, and $\boldsymbol{\Lambda}_{k}$ is diagonal. We now define a new MIMO Gaussian broadcast channel which has invertible channel matrices: $\displaystyle\mathbf{Y}_{k}[m]$ $\displaystyle=\overline{\mathbf{H}}_{k}\mathbf{X}[m]+\mathbf{Z}_{k}[m],\quad k=1,2$ (48) where $\overline{\mathbf{H}}_{k}=\mathbf{U}_{k}(\boldsymbol{\Lambda}_{k}+\alpha\mathbf{I}_{t})\mathbf{V}_{k}^{t}$ for some $\alpha>0$, and $\\{\mathbf{Z}_{k}[m]\\}_{m}$ is an i.i.d. additive vector Gaussian noise process with zero mean and identity covariance matrix. Note that the channel matrices $\overline{\mathbf{H}}_{k}$, $k=1,2$, are invertible. By Lemma 1, the secrecy capacity $C_{s}(\overline{\mathbf{H}}_{2},\overline{\mathbf{H}}_{1},\mathbf{S})$ of (31) (viewed as a MIMO Gaussian wiretap channel with receiver 2 as legitimate receiver and receiver 1 as eavesdropper) under the matrix power constraint (2) is given by $C_{s}(\overline{\mathbf{H}}_{2},\overline{\mathbf{H}}_{1},\mathbf{S})=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{t}+\overline{\mathbf{H}}_{2}\mathbf{S}\overline{\mathbf{H}}_{2}^{\intercal}}{\mathbf{I}_{t}+\overline{\mathbf{H}}_{2}\mathbf{B}\overline{\mathbf{H}}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{t}+\overline{\mathbf{H}}_{1}\mathbf{S}\overline{\mathbf{H}}_{1}^{\intercal}}{\mathbf{I}_{t}+\overline{\mathbf{H}}_{1}\mathbf{B}\overline{\mathbf{H}}_{1}^{\intercal}}\right|\right).$ Finally, let $\alpha\downarrow 0$. We have $\overline{\mathbf{H}}_{k}\rightarrow\mathbf{H}_{k}$, $k=1,2$ and hence $\displaystyle C_{s}(\overline{\mathbf{H}}_{2},\overline{\mathbf{H}}_{1},\mathbf{S})\rightarrow\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right).$ Moreover, by Eqns. (45) and (46) of [9], $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$ $\displaystyle\leq C_{s}(\overline{\mathbf{H}}_{2},\overline{\mathbf{H}}_{1},\mathbf{S})+\mathcal{O}(\alpha)$ (49) where $\mathcal{O}(\alpha)\rightarrow 0$ in the limit as $\alpha\downarrow 0$. Thus, we have the desired converse result $\displaystyle C_{s}(\mathbf{H}_{2},\mathbf{H}_{1},\mathbf{S})$ $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{S}\mathbf{H}_{2}^{\intercal}}{\mathbf{I}_{r_{2}}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}}\right|-\frac{1}{2}\log\left|\frac{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{S}\mathbf{H}_{1}^{\intercal}}{\mathbf{I}_{r_{1}}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}}\right|\right)$ by letting $\alpha\downarrow 0$ on the RHS of (49). This completes the proof of the theorem. ## Appendix B Proof of Theorem 3 In this appendix, we prove Theorem 3. Without loss of generality, we may assume that the matrix power constraint $\mathbf{S}$ is strictly positive definite and the channel matrices $\mathbf{H}_{1}$ and $\mathbf{H}_{2}$ are square but not necessarily invertible. We start with the following simple lemma. ###### Lemma 2 For any $t\times t$ matrices $\mathbf{B}$ and $\mathbf{H}$ such that $\mathbf{B}\succeq 0$, we have $\displaystyle\left|\mathbf{I}_{t}+\mathbf{H}\mathbf{B}\mathbf{H}^{\intercal}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\mathbf{H}^{\intercal}\mathbf{H}\mathbf{B}\right|.$ (50) In particular, if $\mathbf{B}=\mathbf{I}_{t}$, we have $\displaystyle\left|\mathbf{I}_{t}+\mathbf{H}\mathbf{H}^{\intercal}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\mathbf{H}^{\intercal}\mathbf{H}\right|.$ (51) ###### Proof: Note that if $\mathbf{H}$ is invertible, the equalities in (50) and (51) are trivial. Otherwise, consider using SVD to rewrite $\mathbf{H}$ as $\displaystyle\mathbf{H}=\mathbf{U}\boldsymbol{\Lambda}\mathbf{V}^{\intercal}$ where $\mathbf{U}$ and $\mathbf{V}$ are $t\times t$ orthogonal matrices, and $\displaystyle{\bf\Lambda}={\sf Diag}(\underbrace{0,\dots,0}_{t-b},\lambda_{1},\dots,\lambda_{b})$ is diagonal with $\lambda_{j}>0$, $j=1,\dots,b$. Write $\displaystyle\mathbf{V}^{\intercal}\mathbf{B}\mathbf{V}=\left(\begin{matrix}\mathbf{C}_{\mathbf{B}}&\mathbf{D}_{\mathbf{B}}\\\ \mathbf{D}_{\mathbf{B}}^{\intercal}&\mathbf{E}_{\mathbf{B}}\end{matrix}\right)$ where $\mathbf{C}_{\mathbf{B}}$, $\mathbf{D}_{\mathbf{B}}$ and $\mathbf{E}_{\mathbf{B}}$ are (sub)matrices of size $(t-b)\times(t-b)$, $(t-b)\times b$ and $b\times b$, respectively. Then, $\displaystyle\left|\mathbf{I}_{t}+\mathbf{H}\mathbf{B}\mathbf{H}^{\intercal}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\mathbf{U}\boldsymbol{\Lambda}\mathbf{V}^{\intercal}\mathbf{B}\mathbf{V}\boldsymbol{\Lambda}\mathbf{U}^{\intercal}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\boldsymbol{\Lambda}\mathbf{V}^{\intercal}\mathbf{B}\mathbf{V}\boldsymbol{\Lambda}\right|$ $\displaystyle=\left|\mathbf{I}_{b}+\overline{\boldsymbol{\Lambda}}\mathbf{E}_{\mathbf{B}}\overline{\boldsymbol{\Lambda}}\right|$ (52) where $\overline{\boldsymbol{\Lambda}}={\sf Diag}(\lambda_{1},\dots,\lambda_{b})$. On the other hand, $\displaystyle\left|\mathbf{I}_{t}+\mathbf{H}^{\intercal}\mathbf{H}\mathbf{B}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\mathbf{V}\boldsymbol{\Lambda}^{2}\mathbf{V}^{\intercal}\mathbf{B}\right|$ $\displaystyle=\left|\mathbf{I}_{t}+\boldsymbol{\Lambda}^{2}\mathbf{V}^{\intercal}\mathbf{B}\mathbf{V}\right|$ $\displaystyle=\left|\mathbf{I}_{b}+\overline{\boldsymbol{\Lambda}}^{2}\mathbf{E}_{\mathbf{B}}\right|$ $\displaystyle=\left|\mathbf{I}_{b}+\overline{\boldsymbol{\Lambda}}\mathbf{E}_{\mathbf{B}}\overline{\boldsymbol{\Lambda}}\right|$ (53) where the last equality follows from the fact that $\overline{\boldsymbol{\Lambda}}$ is invertible. Putting together (52) and (53) proves the equality in (50). This completes the proof of the lemma. ∎ We are now ready to prove Theorem 3, following the approach of [10]. Let $\displaystyle\mathbf{O}_{k}:=\mathbf{H}_{k}^{\intercal}\mathbf{H}_{k}\quad k=1,2,$ (54) and let $\boldsymbol{\Phi}$ denote the generalized eigenvalue matrix of the pencil $\left(\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{O}_{1}\mathbf{S}^{\frac{1}{2}},\;\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{S}^{\frac{1}{2}}\right)$ such that $\displaystyle\boldsymbol{\Phi}=\left(\begin{matrix}\overline{\boldsymbol{\Phi}}_{1}&0\\\ 0&\overline{\boldsymbol{\Phi}}_{2}\end{matrix}\right)$ where $\overline{\boldsymbol{\Phi}}_{1}={\rm Diag}\\{\phi_{1},\dots,\phi_{\rho}\\}$ and $\overline{\boldsymbol{\Phi}}_{2}={\rm Diag}\\{\phi_{\rho+1},\dots,\phi_{t}\\}$. Let $\mathbf{G}$ be the corresponding generalized eigenvector matrix such that $\displaystyle\mathbf{G}^{\intercal}\left(\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{O}_{1}\mathbf{S}^{\frac{1}{2}}\right)\mathbf{G}$ $\displaystyle=\boldsymbol{\Phi}$ $\displaystyle\text{and}\qquad\mathbf{G}^{\intercal}\left(\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{S}^{\frac{1}{2}}\right)\mathbf{G}$ $\displaystyle=\mathbf{I}_{t}.$ (55) Now define $\displaystyle\widetilde{\mathbf{O}}:=\mathbf{S}^{-\frac{1}{2}}\left[\mathbf{G}^{-\intercal}\left(\begin{matrix}\overline{{\boldsymbol{\Phi}}}_{1}&0\\\ 0&\mathbf{I}_{t-\rho}\end{matrix}\right)\mathbf{G}^{-1}-\mathbf{I}_{t}\right]\mathbf{S}^{-\frac{1}{2}}.$ (56) Since the generalized eigenvalues are ordered as $\phi_{1}\geq\dots\geq\phi_{\rho}>1\geq\phi_{\rho+1}\geq\dots\geq\phi_{t}>0,$ we have $\displaystyle\left(\begin{matrix}\overline{{\boldsymbol{\Phi}}}_{1}&0\\\ 0&\mathbf{I}_{t-\rho}\end{matrix}\right)\succeq\boldsymbol{\Phi}$ $\displaystyle\mbox{and}\quad\quad\left(\begin{matrix}\overline{{\boldsymbol{\Phi}}}_{1}&0\\\ 0&\mathbf{I}_{t-\rho}\end{matrix}\right)\succeq\mathbf{I}_{t}.$ Hence by (55) and (56), $\displaystyle\widetilde{\mathbf{O}}\succeq\\{\mathbf{O}_{1},\mathbf{O}_{2}\\}.$ (57) It follows that $\displaystyle C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{H}_{1}\mathbf{B}\mathbf{H}_{1}^{\intercal}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{H}_{2}\mathbf{B}\mathbf{H}_{2}^{\intercal}\right|\right)$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{H}_{1}^{\intercal}\mathbf{H}_{1}\mathbf{B}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{H}_{2}^{\intercal}\mathbf{H}_{2}\mathbf{B}^{\frac{1}{2}}\right|\right)$ (58) $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{O}_{1}\mathbf{B}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{B}^{\frac{1}{2}}\right|\right)$ (59) $\displaystyle\leq\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\widetilde{\mathbf{O}}\mathbf{B}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{B}^{\frac{1}{2}}\right|\right)$ (60) $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\widetilde{\mathbf{O}}^{\frac{1}{2}}\mathbf{B}\widetilde{\mathbf{O}}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{O}_{2}^{\frac{1}{2}}\mathbf{B}\mathbf{O}_{2}^{\frac{1}{2}}\right|\right)$ (61) $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{t}+\widetilde{\mathbf{O}}^{\frac{1}{2}}\mathbf{S}\widetilde{\mathbf{O}}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{O}_{2}^{\frac{1}{2}}\mathbf{S}\mathbf{O}_{2}^{\frac{1}{2}}\right|$ (62) $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\widetilde{\mathbf{O}}\mathbf{S}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{S}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{S}^{\frac{1}{2}}\right|$ (63) $\displaystyle=\frac{1}{2}\log\left|\overline{{\boldsymbol{\Phi}}}_{1}\right|$ (64) $\displaystyle=\frac{1}{2}\sum_{j=1}^{\rho}\log\phi_{j}$ (65) where (58), (61) and (63) follow from (51); (59) follows from the definition of $\mathbf{O}_{1}$ in (54); (60) follows from the fact that $\mathbf{O}_{1}\preceq\widetilde{\mathbf{O}}$ (see (57)); (62) follows from the fact that $\mathbf{O}_{2}\preceq\widetilde{\mathbf{O}}$ (see (57)); and (64) follows (55) and the definition of $\widetilde{\mathbf{O}}$ in (56). To prove the reverse inequality, let $\mathbf{G}=[\mathbf{G}_{1}\,\mathbf{G}_{2}]$ where $\mathbf{G}_{1}$ and $\mathbf{G}_{2}$ are (sub)matrices of size $t\times\rho$ and $t\times\rho$, respectively, and let $\displaystyle\mathbf{B}^{\star}:=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\mathbf{G}^{\intercal}\mathbf{S}^{\frac{1}{2}}.$ (66) Then, $\mathbf{B}^{\star}$ is positive semidefinite. Moreover, we may verify that $\mathbf{B}^{\star}\preceq\mathbf{S}$ as follows. Note that $\mathbf{G}$ is invertible, so it is enough to show that $\displaystyle\left(\begin{matrix}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&0\\\ 0&0\end{matrix}\right)\preceq\left(\mathbf{G}^{\intercal}\mathbf{G}\right)^{-1}.$ Note that $\displaystyle\mathbf{G}^{\intercal}\mathbf{G}$ $\displaystyle=\left(\begin{matrix}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}&\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\\\ \mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}&\mathbf{G}_{2}^{\intercal}\mathbf{G}_{2}\end{matrix}\right).$ Using block inversion, we may obtain $\displaystyle\left(\mathbf{G}^{\intercal}\mathbf{G}\right)^{-1}$ $\displaystyle=\left(\begin{matrix}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}+(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\mathbf{E}_{\mathbf{G}}^{-1}\mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\mathbf{E}_{\mathbf{G}}^{-1}\\\ \mathbf{E}_{\mathbf{G}}^{-1}\mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&\mathbf{E}_{\mathbf{G}}^{-1}\end{matrix}\right)$ where $\displaystyle\mathbf{E}_{\mathbf{G}}=\mathbf{G}_{2}^{\intercal}\mathbf{G}_{2}-\mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}.$ Since $\mathbf{G}^{\intercal}\mathbf{G}$ is positive definite, we have $\mathbf{E}_{\mathbf{G}}\succ 0$ and hence $\displaystyle\left(\mathbf{G}^{\intercal}\mathbf{G}\right)^{-1}-\left(\begin{matrix}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&0\\\ 0&0\end{matrix}\right)$ $\displaystyle=\left(\begin{matrix}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\mathbf{E}_{\mathbf{G}}^{-1}\mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\mathbf{E}_{\mathbf{G}}^{-1}\\\ \mathbf{E}_{\mathbf{G}}^{-1}\mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&\mathbf{E}_{\mathbf{G}}^{-1}\end{matrix}\right)$ $\displaystyle=\left(\begin{matrix}\mathbf{I}_{\rho}&(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\\\ 0&\mathbf{I}_{t-\rho}\end{matrix}\right)\left(\begin{matrix}0&0\\\ 0&\mathbf{E}_{\mathbf{G}}^{-1}\end{matrix}\right)\left(\begin{matrix}\mathbf{I}_{\rho}&0\\\ \mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1})^{-1}&\mathbf{I}_{t-\rho}\end{matrix}\right)$ $\displaystyle\succeq 0.$ By (59), $\displaystyle C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ $\displaystyle=\max_{0\preceq\mathbf{B}\preceq\mathbf{S}}\left(\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{O}_{1}\mathbf{B}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+\mathbf{B}^{\frac{1}{2}}\mathbf{O}_{2}\mathbf{B}^{\frac{1}{2}}\right|\right)$ $\displaystyle\geq\frac{1}{2}\log\left|\mathbf{I}_{t}+{\mathbf{B}^{\star}}^{\frac{1}{2}}\mathbf{O}_{1}{\mathbf{B}^{\star}}^{\frac{1}{2}}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+{\mathbf{B}^{\star}}^{\frac{1}{2}}\mathbf{O}_{2}{\mathbf{B}^{\star}}^{\frac{1}{2}}\right|$ $\displaystyle=\frac{1}{2}\log\left|\mathbf{I}_{t}+{\mathbf{B}^{\star}}\mathbf{O}_{1}\right|-\frac{1}{2}\log\left|\mathbf{I}_{t}+{\mathbf{B}^{\star}}\mathbf{O}_{2}\right|$ (67) where the last equality follows from (50). From (55), we have $\displaystyle\mathbf{O}_{1}$ $\displaystyle=\mathbf{S}^{-\frac{1}{2}}\left(\mathbf{G}^{-\intercal}\boldsymbol{\Phi}\mathbf{G}^{-1}-\mathbf{I}_{t}\right)\mathbf{S}^{-\frac{1}{2}}$ $\displaystyle\text{and}\qquad\mathbf{O}_{2}$ $\displaystyle=\mathbf{S}^{-\frac{1}{2}}\left(\mathbf{G}^{-\intercal}\mathbf{G}^{-1}-\mathbf{I}_{t}\right)\mathbf{S}^{-\frac{1}{2}}.$ (68) Hence, $\displaystyle\mathbf{B}^{\star}\mathbf{O}_{1}$ $\displaystyle=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\mathbf{G}^{\intercal}\left(\mathbf{G}^{-\intercal}\boldsymbol{\Phi}\mathbf{G}^{-1}-\mathbf{I}_{t}\right)\mathbf{S}^{-\frac{1}{2}}$ $\displaystyle=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left[\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\boldsymbol{\Phi}-\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\mathbf{G}^{\intercal}\mathbf{G}\right]\mathbf{G}^{-1}\mathbf{S}^{-\frac{1}{2}}$ $\displaystyle=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left[\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\left(\begin{matrix}\overline{\boldsymbol{\Phi}}_{1}&0\\\ 0&\overline{\boldsymbol{\Phi}}_{2}\end{matrix}\right)-\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}&0\\\ 0&0\end{matrix}\right)\left(\begin{matrix}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}&\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\\\ \mathbf{G}_{2}^{\intercal}\mathbf{G}_{1}&\mathbf{G}_{2}^{\intercal}\mathbf{G}_{2}\end{matrix}\right)\right]\mathbf{G}^{-1}\mathbf{S}^{-\frac{1}{2}}$ $\displaystyle=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}\overline{\boldsymbol{\Phi}}_{1}-\mathbf{I}_{\rho}&-\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\\\ 0&0\end{matrix}\right)\mathbf{G}^{-1}\mathbf{S}^{-\frac{1}{2}}$ giving $\displaystyle\left|\mathbf{I}_{t}+{\mathbf{B}^{\star}}\mathbf{O}_{1}\right|=\left|\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right|^{-1}\left|\overline{\boldsymbol{\Phi}}_{1}\right|.$ (69) Similarly, we may obtain $\displaystyle\mathbf{B}^{\star}\mathbf{O}_{2}$ $\displaystyle=\mathbf{S}^{\frac{1}{2}}\mathbf{G}\left(\begin{matrix}\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}-\mathbf{I}_{\rho}&-\left(\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right)^{-1}\mathbf{G}_{1}^{\intercal}\mathbf{G}_{2}\\\ 0&0\end{matrix}\right)\mathbf{G}^{-1}\mathbf{S}^{-\frac{1}{2}}$ and $\displaystyle\left|\mathbf{I}_{t}+\mathbf{B}^{\star}\mathbf{O}_{2}\right|$ $\displaystyle=\left|\mathbf{G}_{1}^{\intercal}\mathbf{G}_{1}\right|^{-1}.$ (70) Substituting (69) and (70) into (67), we may obtain $\displaystyle C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ $\displaystyle\geq\frac{1}{2}\log\left|\overline{\boldsymbol{\Phi}}_{1}\right|$ $\displaystyle=\frac{1}{2}\sum_{j=1}^{\rho}\log\phi_{j}.$ (71) Putting together (65) and (71) establishes the desired equality $\displaystyle C_{s}(\mathbf{H}_{1},\mathbf{H}_{2},\mathbf{S})$ $\displaystyle=\frac{1}{2}\sum_{j=1}^{\rho}\log\phi_{j}.$ This completes the proof of the theorem. ## References * [1] A. D. Wyner, “The wire-tap channel,” _Bell Syst. Tech. J._ , vol. 54, no. 8, pp. 1355–1387, Oct. 1975. * [2] I. Csiszár and J. Körner, “Broadcast channels with confidential messages,” _IEEE Trans. Inf. Theory_ , vol. 24, no. 3, pp. 339–348, May 1978\. * [3] Y. Liang, H. V. Poor, and S. Shamai (Shitz), _Information Theoretic Security_. Dordrecht, The Netherlands: Now Publishers, 2009. * [4] Z. Li, W. Trappe, and R. D. Yates, “Secret communication via multi-antenna transmission,” in _Proc. Forty-First Annual Conference on Information Sciences and Systems_ , Baltimore, MD, Mar. 2007. * [5] A. Khisti and G. Wornell, “Secure transmission with multiple antennas: The MISOME wiretap channel,” _IEEE Trans. Inf. Theory_ , submitted for publication. * [6] S. Shafiee, N. Liu, and S. Ulukus, “Towards the secrecy capacity of the Gaussian MIMO wire-tap channel: The 2-2-1 channel,” _IEEE Trans. Inf. Theory_ , to appear. * [7] A. Khisti and G. W. Wornell, “The secrecy capacity of the MIMO wiretap channel,” in _Proc. 45th Annual Allerton Conf. Comm., Contr., Computing_ , Monticello, IL, Sep. 2007. * [8] F. Oggier and B. Hassibi, “The secrecy capacity of the MIMO wiretap channel,” in _Proc. IEEE Int. Symp. Information Theory_ , Toronto, Canada, July 2008, pp. 524–528. * [9] T. Liu and S. Shamai (Shitz), “A note on the secrecy capacity of the multiantenna wiretap channel,” _IEEE Trans. Inf. Theory_ , to appear. * [10] R. Bustin, R. Liu, H. V. Poor, and S. Shamai (Shitz), “A MMSE approach to the secrecy capacity of the MIMO Gaussian wiretap channel,” _EURASIP Journal on Wireless Communications and Networking (Special Isssue on Wireless Physical Layer Security)_ , submitted November 2008. * [11] H. D. Ly, T. Liu, and Y. Liang, “MIMO broadcasting with common, private and confidential messages,” in _Proc. Int. Symp. Inform. Theory Applications_ , Auckland, New Zealand, Dec. 2008. * [12] R. Liu and H. V. Poor, “Secrecy capacity region of a multi-antenna Gaussian broadcast channel with confidential messages,” _IEEE Trans. Inf. Theory_ , vol. 55, no. 3, pp. 1235–1249, Mar. 2009. * [13] R. Liu, I. Maric, P. Spasojevic, and R. D. Yates, “Discrete memoryless interference and broadcast channels with confidential messages: Secrecy rate regions,” _IEEE Trans. Inf. Theory_ , vol. 54, no. 6, pp. 2493–2507, Jun. 2008. * [14] H. Weingarten, Y. Steinberg, and S. Shamai (Shitz), “The capacity region of the Gaussian multiple-input multiple-output broadcast channel,” _IEEE Trans. Inf. Theory_ , vol. 52, pp. 3936–3964, Sep. 2006. * [15] S. Goel and R. Negi, “Guaranteeing secrecy using artificial noise,” _IEEE Trans. Wireless Comm._ , vol. 7, pp. 2180–2189, Jun. 2008. * [16] W. Yu and J. M. Cioffi, “Sum capacity of Gaussian vector broadcast channels,” _IEEE Trans. Inf. Theory_ , vol. 50, pp. 1875–1892, Sep. 2004\. * [17] G. Strang, _Linear Algebra and Its Applications_. Wellesley, MA: Wellesley-Cambridge Press, 1998.
arxiv-papers
2009-03-23T04:26:25
2024-09-04T02:49:01.337650
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Ruoheng Liu, Tie Liu, H. Vincent Poor, Shlomo Shamai (Shitz)", "submitter": "Ruoheng Liu", "url": "https://arxiv.org/abs/0903.3786" }
0903.3810
# Simulations for Terrestrial Planets Formation Niu ZHANG11affiliation: Graduate School of Chinese Academy of Sciences, Beijing 100049, China 22affiliation: Purple Mountain Observatory, Chinese Academy of Sciences, Nanjing 210008, China , Jianghui JI22affiliation: Purple Mountain Observatory, Chinese Academy of Sciences, Nanjing 210008, China 33affiliation: National Astronomical Observatory, Chinese Academy of Sciences,Beijing 100012, China jijh@pmo.ac.cn ###### Abstract In this paper, we investigate the formation of terrestrial planets in the late stage of planetary formation using two-planet model. At that time, the protostar has formed for about 3 Myr and the gas disk has dissipated. In the model, the perturbations from Jupiter and Saturn are considered. We also consider variations of the mass of outer planet, and the initial eccentricities and inclinations of embryos and planetesimals. Our results show that, terrestrial planets are formed in 50 Myr, and the accretion rate is about $60\%-80\%$. In each simulation, 3 - 4 terrestrial planets are formed inside ”Jupiter” with masses of $0.15-3.6M_{\oplus}$. In the 0.5 \- 4 AU, when the eccentricities of planetesimals are excited, planetesimals are able to accrete material from wide radial direction. The plenty of water material of the terrestrial planet in the Habitable Zone may be transferred from the farther places by this mechanism. Accretion could also happen a few times between two major planets only if the outer planet has a moderate mass and the small terrestrial planet could survive at some resonances over time scale of $10^{8}$ yr. In one of our simulations, com-mensurability of the orbital periods of planets is very common. Moreover, a librating-circulating 3:2 configuration of mean motion resonance is found. ###### Subject headings: astrophysics-exoplanet-planetary formation-n-body simulation ## 1\. Introduction Since the discovery of the first extrasolar planet around Solar-Type star, the detection of the extrasolar planets develops rapidly. To date, more than $300$ planets are found orbiting their center stars beyond our solar system, including 35 multiple planetary systems. Recently, scientists have found evidences of methane and carbon dioxide in the atmosphere of a Hot-Jupiter (HD 189733 b) (http://planetquest.jpl.nasa.gov). Of $\sim 300$ known extrasolar planets, the minimum mass is generally several Jupiter masses. There are also several terrestrial planets (Super-Earth), but their orbital characteristic is unsuitable for the formation or development of life. Along with the development of survey techniques and incoming high definition space missions, people will definitely discover more and more Earth-like planets in the extrasolar planetary systems. The research of formation and evolution of the terrestrial planet now becomes important topics in astrophysics, astrobiology, astrochemistry and so on. Planet formation has certain order (Zhou et al., 2005), and Jupiter-like planets at greater distance are formed faster than those near the Sun. It is generally believed that the planet formation may experience the following stages: The grains condensed in the initial stage grow to km-sized planetesimals in the early stage, and then, in the middle stage, Moon-to-Mars sized embryos are formed by accretion of the planetesimals. The size of embryos correlates with the feeding zone of the planetesimals. According to the formula of Hill radius: $R_{H}=r(m/3M_{\odot})^{1/3}$ (where $r$,$m$ are the heliocentric distance and the mass of planetesimal), the distant planetesimals have wider feeding zones, so the formed embryos are larger. When the embryos grow to the core of mass ($\sim 10M_{\oplus}$ ), runaway accretion may take place accordingly. With more atmosphere accreted, the embryos contract, growing ever denser and more massive, eventually collapse to form giant Jovian planets (Hu & Xu, 2008; Ida & Lin, 2004). However, at the same period, the inner planetesimals accrete in respective accretion scope, and then the embryos of terrestrial planet (namely kind of the terrestrial planet core matter) are formed. At the end of the third stage, it is around that the protostar has formed for about $3$ Myr, the gas disk has dissipated. A few larger bodies with low $e$ and $i$ are in crowds of planetesimals with certain eccentricities $e$, and inclinations $i$. In the late stage, the terrestrial planetary embryos are excited to high eccentricity orbit by gravitational perturbation. Then, the orbital crossing makes the planets accreting material in the broader radial area. Solid residue is either scattered out of the planetary system or accreted by the massive planet. However, it also has the possibility of being captured at the resonance position of the major planets (Nagasawa & Ida, 2000; Hu & Xu, 2008). Taking our Solar System as the background, Chambers (2001) made a study of terrestrial planet formation in the late stage by numerical simulations. He set $150-160$ Moon-to-Mars size planetary embryos in the area of $0.3-2.0$ AU, include gravitational perturbations from Jupiter and Saturn. He also examined two initial mass distributions: approximately uniform masses, and a bimodal mass distribution. The results show that $2-4$ planets are formed in $50$ Myr, and finally survive over $200$ Myr timescale. The space distribution and concentration (see Section 4 in Chambers (2001)) of planets formed in the simulations are similar to our solar system. However, the planets produced by the simulations usually have eccentric orbits with higher eccentricities $e$, and inclinations $i$ than Venus. Raymond, Quinn & Lunine (2004, 2006) also studied the formation of terrestrial planets. In the simulations, they took into account Jupiter’s gravitational perturbation, wider distribution of material ($0.5-4.5$ AU) and higher resolution. The results confirm a leading hypothesis for the origin of Earth’s water: they may come from the material in the outer area by impacts in the late stage of planet formation. Raymond, Mandell, & Sigurdsson (2006) explored the planet formation under planetary migration of the giant. In the simulations, super Hot Earth form interior to the migrating giant planet, and water-rich, Earth-size terrestrial planet are present in the Habitable Zone ($0.8-1.5$ AU) and can survive over $10^{8}$ yr timescale. In our model, Solar System is taken as the background. But several changes are worth noting : 1) we use two-planet (Jupiter and Saturn, see Fig.1) model. 2) in the model, Jupiter and Saturn are supposed to be formed at the beginning of the simulation, with two swarms of planetesimals distributed among $0.5-4.2$ AU and $6.2-9.6$ AU respectively. 3) The initial eccentricities and inclinations of planetesimals are considered. 4) The variations of the mass of Saturn are examined. 5) The exchange of material in the radial direction is also studied by the parameter of water mass fraction. 6) We perform the simulations over longer timescale ($400$ Myr) in order to check the stability and the dynamical structure evolution of the system. Our results show that the terrestrial planets produced interior to Jupiter have higher mass accretion rate, and share the similar architecture as the Solar System. However, the structure beyond Jupiter correlates with the initial mass of Saturn. Almost each simulation has a water-rich terrestrial planet in the Habitable Zone ($0.8-1.5$ AU). In Section 2, the initial conditions, algorithm and integration procedure are described in detail. Section 3 presents the main results. We conclude the outcomes in Section 4. ## 2\. Model ### 2.1. Initial conditions Generally, the time scale for formation of Jupiter-like planet is less than $10$ Myr (Briceño, 2001). Nevertheless, as we know, the formation scenario of planet embryos is related to their heliocentric distances and the initial mass of the star nebular. If we consider the model of $1.5$ MMSN (minimum mass solar nebular), the upper bound of the time scale for Jupiter-like planet formation corresponds to the time scale for the embryo formation at $2.5$ AU (Kokubo & Ida, 2002), which is just at $3:1$ resonance location of Jupiter. In the region $2.5-4.2$ AU, embryos will be cleared off by strong gravitational perturbation arising from Jupiter. There should be some much smaller solid residue among Jupiter and Saturn, even though the ’clearing effect’ may throw out most of the material in this area. That’s why we set embryos only in the region $0.5-2.5$ AU and planetesimals in the $0.5-4.2$ AU and $6.2-9.6$ AU. We adopt the surface density profile as follows (Raymond, Quinn & Lunine, 2004): $\Sigma(r)=\left\\{\begin{array}[]{ll}\Sigma_{1}r^{-3/2},&r<snow~{}line,\\\ \Sigma_{snow}(\frac{r}{5AU})^{-3/2},&r>snow~{}line.\end{array}\right.$ (1) In (1), $\Sigma_{snow}=10~{}g/cm^{2}$ is the surface density at snowline, the snowline is at $2.5$ AU with $\Sigma_{1}=4~{}g/cm^{2}$.As mentioned earlier, the mass of planetary embryos is proportional to the width of the feeding zone, which is associated with Hill Radius, $R_{H}$, so the mass of an embryo increases as $M_{embryo}\propto r\Sigma(r)R_{H}$ (2) The embryos among $0.5-2.5$ AU are spaced by $\Lambda$ ($\Lambda$ varying randomly between 2 and 5) mutual Hill Radii, $R_{H,m}$ , which is defined as $R_{H,m}=(\frac{a_{1}+a_{2}}{2})(\frac{m_{1}+m_{2}}{3M_{\odot}})^{1/3}$ (3) where $a_{1,2}$ and $m_{1,2}$ are the semi-major axes and masses of the embryos respectively. Replacing $R_{H}$ in (2) with $R_{H,m}$ , and substituting (1) in (2), then, we get relations between the mass of embryos and the parameter $\Lambda$ as $M_{embryo}\propto r\Sigma(r)R_{H,m}\propto r^{3/4}\Lambda^{3/2}\Sigma^{3/2}$ (4) As shown in Fig. 1, the initial planetesimals are spread over $0.5-9.6$ AU (excluding $3$ Hill Radii around Jupiter); the distribution of them should meet (1). Here, we equally set the masses of planetesimals inside and outside Jupiter respectively as shown in (5). Consequently, the number distribution of the planetesimals is only needed to satisfy $N\propto r^{-1/2}$. Additionally, we keep the total number of planetesimals and embryos inside Jupiter, and the number of planetesimals outside Jupiter both equal to $200$. $\left\\{\begin{array}[]{ll}\sum N_{embryo}+\sum N_{planetesimal,~{}~{}r<r_{Jupiter}}\\\ ~{}~{}~{}~{}=\sum N_{planetesimal,~{}r>r_{Jupiter}}=200,\\\ \sum M_{embryo}+\sum M_{planetesimal,~{}r<r_{Jupiter}}\\\ ~{}~{}~{}~{}=\sum M_{planetesimal,~{}r>r_{Jupiter}}=7.5M_{\oplus},\\\ M_{planetesimal,~{}r<r_{Jupiter}}=\\\ ~{}~{}~{}~{}(7.5M_{\oplus}-\sum M_{embryo})/(200-\sum N_{embryo}),\\\ M_{planetesimal,~{}r>r_{Jupiter}}=7.5M_{\oplus}/200.\end{array}\right.$ (5) The water mass fraction of the bodies is same as Raymond, Quinn & Lunine (2004), i.e., the planetesimals beyond 2.5 AU have $5\%$ water material by mass, those between $2-2.5$ AU have $0.1\%$ water material by mass, and the others have $0.001\%$ water material by mass. The eccentricities and inclinations vary in ($0-0.02$) and ($0-0.05^{\circ}$), respectively. The mass of Saturn in simulations 1a/1b,2a/2b and 3a/3b are $0.5M_{\oplus}$, $5M_{\oplus}$, $50M_{\oplus}$ respectively. Each simulation is carried out twice with a) considering, b) not considering self-gravitation of planetesimals among Jupiter and Saturn. ### 2.2. Algorithm In regular coordinate system, the motion equations of an n-body system are (Murray & Dermott, 1999) $\left\\{\begin{array}[]{ll}\frac{dx_{i}}{dt}&=\frac{\partial H}{\partial p_{i}},\\\ \frac{dp_{i}}{dt}&=-\frac{\partial H}{\partial x_{i}}.\end{array}\right.$ (6) where the index $i=1,2,\cdots,n$ denotes the body $i$ , and $x_{i}$ , $p_{i}$ are the generalized coordinate and momentum of the body $i$, respectively. The Hamiltonian, $H=\sum\limits_{i=1}^{n}\frac{p_{i}^{2}}{2m_{i}}-G\sum\limits_{i=1}^{n}m_{i}\sum\limits_{j=i+1}^{n}\frac{m_{j}}{r_{ij}}$, is the sum of the kinetic and potential energy for the system. From (6), we know that the rate of any quantity, $q$ , can be conveniently expressed in the following form, $\begin{array}[]{ll}\frac{dq}{dt}&=\sum\limits_{i=1}^{n}(\frac{\partial q}{\partial x_{i}}\frac{dx_{i}}{dt}+\frac{\partial q}{\partial p_{i}}\frac{dp_{i}}{dt})\\\ &=\sum\limits_{i=1}^{n}(\frac{\partial q}{\partial x_{i}}\frac{\partial H}{\partial p_{i}}-\frac{\partial q}{\partial p_{i}}\frac{\partial H}{\partial x_{i}}).\end{array}$ (7) If we define an operator $F=\sum\limits_{i=1}^{n}(\frac{\partial~{}}{\partial x_{i}}\frac{\partial H}{\partial p_{i}}-\frac{\partial~{}}{\partial p_{i}}\frac{\partial H}{\partial x_{i}})$ (Chambers, 1999), then we can rewrite (7) as $\frac{dq}{dt}=Fq$. Integral the differential equation over time $t_{1}-t_{2}$ ($t_{2}>t_{1}$), and so we get $q_{2}=e^{(t_{2}-t_{1})F}q_{1},$ (8) where $q_{1}$ and $q_{2}$ are the values of $q$ corresponding to the time $t_{1}$ and $t_{2}$ respectively. If we define $h=t_{2}-t_{1}$ ($h$ actually is the internal time step), then expand (8) at zero, we have $q_{2}=(1+hF+\frac{h^{2}F^{2}}{2}+\cdots)q_{1},$ (9) The symplectic integrator is to divide $H$ into pieces, each piece could be individually solved, and then they approximate the solution of the problem via applying the solutions once a time. For example, we split the Hamiltonian $H=H_{1}+H_{2}$ , and hence have the operators $F_{1},F_{2}$ . It is easy to obtain $q_{2}=e^{h(F_{1}+F_{2})}q_{1}$ from (8). By expanding the exponential (attn. $F_{1}F_{2}\neq F_{2}F_{1}$), ignoring the second- and higher-order small quantities of $h$ , then we have $\begin{array}[]{ll}e^{h(F_{1}+F_{2})}&=e^{hF_{1}}e^{hF_{2}}+\frac{h^{2}(F_{2}F_{1}-F_{1}F_{2})}{2}\\\ &=1+h(F_{1}+F_{2})+\frac{h^{2}(F_{1}^{2}+2F_{1}F_{2}+F_{2}^{2})}{2}+\cdots\end{array}$ (10) We can get a second-order integrator $q_{2}=e^{hF_{2}/2}e^{hF_{1}}e^{hF_{2}/2}q_{1}$ by applying a small equivalence transformation. The key point for symplectic algorithm is how to split Hamiltonian $H$ into pieces. Considering a dynamical system composed of $N$ bodies orbiting a massive central body, we can split the Hamiltonian $H$ into the primary and the secondary parts. Chambers (1999) proposed a hybrid symplectic algorithm, in which the Hamiltonian is divided into the following parts: $\left\\{\begin{array}[]{ll}H_{1}&=\sum\limits_{i=1}^{N}(\frac{p_{i}^{2}}{2m_{i}}-\frac{Gm_{\odot}m_{i}}{r_{i\odot}}),\\\ H_{2}&=-G\sum\limits_{i=1}^{N}\sum\limits_{j=i+1}^{N}\frac{m_{i}m_{j}}{r_{ij}},\\\ H_{3}&=\frac{1}{2m_{\odot}}(\sum\limits_{i=1}^{N}{\bf\it p_{i}})^{2},\end{array}\right.$ (11) where $H_{1}$ is the unperturbed Keplerian motion of the $N$ smaller bodies, $H_{2}$ is the total interaction potential energy of the $N$ smaller bodies, and $H_{3}$ is the kinetic energy of the center body (Note That: $N$ has different meaning from $n$ above, $N$ refers to the numbers of bodies excluding the central body). The term of ’hybrid’ means that, for the convenience of calculation, heliocentric coordinates and barycentric velocities are used while solving (11) (Chambers, 1999; Duncan, Levison & Lee, 1998). From (10), we can infer that all of the higher terms depend on both $F_{1}$ and $F_{1}$. If $F_{2}\sim\epsilon F_{1}$ ($\epsilon=\sum m_{i}/m_{\odot}$), and therefore, the second-order integrator $q_{2}=e^{hF_{2}/2}e^{hF_{3}/2}e^{hF_{1}}e^{hF_{3}/2}e^{hF_{2}/2}q_{1}$ is correct to $O(\epsilon h^{3})$ only when the different parts of Hamiltonian meet the conditions $H_{1}\gg H_{2},H_{1}\gg H_{3}$. However, when close encounter occurs between two bodies, the distance between them $r_{ij}$ approaches zero, hence the $H_{1}\gg H_{2}$ can not be satisfied. Chambers (1999) introduced a changeover function $K(r_{ij})$ to translate part of $H_{2}$ associated with the close encounter to $H_{1}$, and then integrate it using Bulirsch-Stoer method (Stoer & Bulirsch, 1980). The modified $H_{1},H_{2}$ are present as $\left\\{\begin{array}[]{ll}H_{1}&=\sum\limits_{i=1}^{N}(\frac{p_{i}^{2}}{2m_{i}}-\frac{Gm_{\odot}m_{i}}{r_{i\odot}})\\\ &~{}~{}~{}~{}-G\sum\limits_{i=1}^{N}\sum\limits_{j=i+1}^{N}\frac{m_{i}m_{j}}{r_{ij}}[1-K(r_{ij})],\\\ H_{2}&=-G\sum\limits_{i=1}^{N}\sum\limits_{j=i+1}^{N}\frac{m_{i}m_{j}}{r_{ij}}K(r_{ij}).\end{array}\right.$ (12) $K(r_{ij})$ tends to zero when $r_{ij}$ is small, while tending to one when $r_{ij}$ is large (Chambers, 1999). We use the hybrid symplectic integrator (Chambers, 1999) in MERCURY package to integrate all the simulations. We take into account that collision and coalescence will occur, when the minimum distance between any of the two objects is equal to or less than the sum of their physical radii. While they were separated by not more than 3 Hill radii, we consider close encounters will take place. When the distance from the central star is more than $100$ AU, these bodies are removed, because they are so far from the central star that they play an insignificant role of the interaction. In addition, we adopt $6$ days as the length of time step, which is a twentieth period of the innermost body at $0.5$ AU. The $6$ simulations are carried out over $400$ Myr time scale. At the end of the intergration, the changes of energy and angular momenta are $10^{-3}$ and $10^{-11}$ respectively. The $6$ simulations are performed on a workstation composed of $12$ CPUs with $1.2$ GHz, and each costs roughly $45$ days. ## 3\. Results All of $6$ simulations exhibit some classical processes on planet formation. Firstly, we will analyse simulation 2a/2b to discuss the physical processes which can apply to every simulation. Next, we will make a statistical analysis in order to find out that how the planet formation may rely on different physical factors. ### 3.1. Simulation 2a/2b At the end of the calculation, $3-4$ terrestrial planets are formed in 2a/2b. Table 1 shows the properties of the terrestrial planets from simulations 2a and 2b. We label the planets as b, c, d, and so on, according to the heliocentric distance (hereinafter). The masses of the terrestrial planets range from several Mars masses to several Earth masses. All of them are water- rich, except the planet e in simulation 2b. Some parameters of a certain planet are comparable with the terrestrial planets in solar system. For example, the orbital eccentricity of planet b in simulation 2b is $0.0309$, which is very close to that of Earth. Fig. 2 is a snapshot of simulation 2a. At $0.1$ Myr, it is clear that the planetesimals are excited at the $3:2$ ($3.97$ AU),$2:1$ ($3.28$ AU) and $3:1$ ($2.5$ AU) resonance locations with Jupiter, and this is similar to the Kirkwood gaps of the asteroidal belt in solar system. For about $1$ Myr, planetesimals and embryos are deeply intermixed, most of the bodies have large eccentricities. Collisions and accretions emerge among planetesimals and embryos. This process continues until about $50$ Myr, the planetary embryos are mostly formed, and then dynamical evolution is start. The formation time scale in our work is in accordance with that of (Ida & Lin, 2004). Finally, inside Jupiter, $3$ terrestrial planets are formed with masses of $0.15-3.6M_{\oplus}$. However, at the outer region, planetesimals are continuously scattered out of the system at $0.1$ Myr. For about $10$ Myr, there are no survivals except at some resonances with the giant planet. As shown in Fig. 2, there is a small body at the $1:2$ resonance with Jupiter. Due to the planetesimals’ scattering, Jupiter (Saturn) migrates inward (outward) $0.13$ AU ($1.19$ AU) toward the sun respectively. Such kind of migration agrees with the work of Fernandez et al. (Fernandez & Ip, 1984) Hence, the $2:5$ mean motion resonance is destroyed, then the ratios of periods between Jupiter and Saturn degenerate to $1:3$. Therefore, the ratio of periods for Jupiter, small body and Saturn is approximate to $1:2:3$. Fig. 3 is a snapshot of simulation 2b. In comparison with Fig. 2, it is apparent that planetesimals are excited more quickly at the $3:2$ ($3.97$ AU), $2:1$ ($3.28$ AU) and $3:1$ ($2.5$ AU) resonance location with Jupiter. The several characteristic time scales are the same as simulation 2a for the bodies within Jupiter. 4 planets are formed in simulation 2b, the changes of position of Jupiter and Sat-urn are about the same as simulation 2a. We note simulations 2a and 2b have the same initial conditions, the only difference between them is whether we consider the self-gravitation among the outer planetesimals. The results of simulation 2b are shown to be a consequence of being expected but not surprising. There is a little stack planetesimals survival over $400$ Myr among $7-8$ AU, located in the area of $2:3$ ($6.63$ AU) and $1:2$ ($8.03$ AU) resonances with Jupiter. Planets in 55 cnc planetary system have similar spatial distribution to the solar system (Fischer et al., 2008), From Table 1 and Fig. 3, it is not difficult to see that 4 terrestrial planets formed in simulation 2b move on the nearly-circular orbit. Mars is ever regarded as a survivor of an original planetary embryo, according to its unique chemical and isotopic characteristics. As a matter of fact, the planet e in simulation 2b is a survivor of the initial planetary embryos. Planet e in simulation 2b does not accrete anything over $400$ Myr integration time. Comparing the semi-major axis of Mars with that of planet e, we notice that the planetesimals of simulation 2b are located in the asteroidal belt. Furthermore, the ratio of periods of the planet e and Jupiter is nearly $1:2$. The total mass of the main-belt in solar system is about $5\times 10^{-5}M_{\oplus}$, being $0.1\%-0.12\%$ (Hu & Xu, 2008) of the initial solid material. If the assumed planet e in simulation 2b would break into thousands of fragments, they may undergo re-accretion or ejection by the perturbation of Jupiter over secular evolution. If it is similar to the same ratio of mass of the belt in solar system, then the leftovers of the solid materials almost bear a total mass of $6.3\times 10^{-5}-7.56\times 10^{-5}M_{\oplus}$ . In this sense, an asteroidal belt is very likely to form in the system quite similar to that of our solar system. Fig. 4a is the mass curve of terrestrial planets for simulation 2b. We can find that the accrete velocity is not uniform. At $10$ Myr, planets reach half mass of their final mass, and then, the accretion velocity slows down, because the planetesimals are only a quarter left. Until about $50$ Myr, the terrestrial planets are formed. The accretion rate and mass concentration (the mass rate of the largest terrestrial planet and the total formed objects) are $73\%$ and $43\%$, respectively. The corresponding parameters in simulation 2a are $60\%$ and $81\%$ respectively. However, in the area outside Jupiter, $81\%$ initial material is scattered out of the system. Planet embryos are formed from feeding zones where the planetesimals are located. A feeding zone has unique chemical and isotopic characteristics. It is helpful to study the trace of the planetesimals to understand the composition of terrestrial planet, vice versa, for example, if we can investigate the origin and formation process by revealing the chemical or isotopic characteristics of the moon. In Fig. 4b is shown the trace of survivals. We note that all the materials accreted by terrestrial planets come from the inner swarm of planetesimals or embryos. Here Jupiter is like a wall, which separates the inner and outer planetesimals from exchanging materials. Once again, Fig. 4b verifies that Jupiter may protect the inner terrestrial planets from colliding with the outer bodies (Wetherill, 1990). We set a water mass fraction on each body, it is easy to work out how much water-material of the finally terrestrial planet bears. Take planet c in simulation 2b for example, the water material is approximately $1.1\times 10^{22}kg$ , about 8 times than Earth. Fig. 4b can also verify that terrestrial planet accrete material in broad radial direction. ### 3.2. Statistical analysis The production efficiency of the terrestrial planet in our model is high, and the accretion rate inside Jupiter is $60\%-80\%$ in the simulations. $3-4$ terrestrial planets formed in $50$ Myr. 5 of 6 simulations have a terrestrial planet in the Habitable Zone ($0.8-1.5$ AU) (see Fig. 5). The planetary systems are formed to have nearly circular orbit and coplanarity, similar to the solar system (see Table 2). We suppose that the above characteristics are correlated with the initial small eccentricities and inclinations. Such adoption could generate more close encounters or collisions in the early several Myr, which may increase viscosity of the system and then make the orbits more nested on circular orbit on the orbital plane. The concentration in Table 2 means the ratio of maximum terrestrial planet formed in the simulation and the total terrestrial planets mass. It represents different capability on accretion, and is not associated with self-gravitation. The average value of this parameter is similar to the solar system. Considering the self-gravitation of planetesimals among Jupiter and Saturn, the system has a better viscosity, so that the planetesimals will be excited slower. The consideration of self-gravitation may not change the formation time scale of terrestrial planets, but will affect the initial accretion speed and the eventual accretion rate. In Table 2, the simulations 1b, 2b, 3b have a bit higher accretion rate. When the self-gravitation is not considered, the planetesimals may be excited quickly. The accretion has a faster speed at the early several Myr, so this can promote the accretion rate. From Fig. 4b, we have to be aware of that Saturn accretes a few planetesimals, this is uncommon in simulations 1a, 1b, 3a, 3b. And Fig. 5 shows the finally structure of the simulations, it is clear that different Saturn mass will affect the outer structure of the system beyond Jupiter. In simulation 3a (3b), the Saturn mass is $50M_{\oplus}$ . Now it is large enough to clear the area among Jupiter and Saturn. In simulation 1a (1b), Saturn’s mass is $0.5M_{\oplus}$ , more or less equal to the embryos’ mass. In this case, it is too small to clear off any planetesimal amongst the region of Jupiter and Saturn. Therefore, we draw the conclusion that only the Saturn’s mass is close to be $5-10M_{\oplus}$ , then accretion may happen. Saturn and Jupiter in our solar system may form in same stage. If there exist embryos of $10M_{\oplus}$ outside Saturn, the giant Jupiter-mass planets may form. The scattering of planetesimals could cause the migration of planets, for example, Jupiter migrated from $5.2$ AU to $5.06$ AU while Saturn traveled from $9.6$ AU to $10.71$ AU. There are plenty of ratios of semi-major axis of the survival planets nearly $2:1$. In this case, the planet is easily to be captured on $2:1$ mean motion resonance (Lee & Peale, 2002; Lee, 2004; Zhou et al., 2005; Fischer et al., 2008). There are still some ratios of periods between the survival bodies close to a simple ratio of integers (see Fig. 5). In the very long process of dynamical evolution after planetary formation, the planets also have the possibility of been captured onto resonant orbit. For example, the orbits show the $2:3$ mean motion resonance be-tween Jupiter and outer small body in simulation 1b, and the $3:1$ resonance between Jupiter and the planet d in simulation 3a and so on. Many researchers have studied the resonance and stability of the planetary systems (Ji et al., 2003; Zhou & Sun, 2003; Zhou et al., 2004). As shown in Fig. 6, in simulation 2a, two planets are on crossing orbits. When a close encounter occurs, $3:2$ mean motion resonance is formed, with resonance angle $\theta_{1}=2\lambda_{1}-3\lambda_{2}+\varpi_{2}$ (where $\lambda_{1,2}$ are the mean longitude and the longitudes of periapse, the footnotes 1, 2 means the inner and outer planets respectively.) librating around $180^{\circ}$ , while $\theta_{2}=2\lambda_{1}-3\lambda_{2}+\varpi_{1}$ circulating, and $e_{1}$ shows large oscillations. Such ’librating-circulating’ configuration is similar to the configuration of $2:1$ resonance in HD 73526 planetary system. There have been several hypotheses about its origin (Tinney et al., 2006; Sándor & Kley, 2006; Sándor, Kley & Klagyivik, 2007). However, it still needs further study in the future. ## 4\. Conclusions We simulate the terrestrial planets formation by using two-planet model. In the simulation, the variations of the mass of outer planet, the initial eccentricities and inclinations of embryos and planetesimals are also considered. The results show that, during the terrestrial planets formation, planets can accrete material from different regions inside Jupiter. Among $0.5-4.2$ AU, the accretion rate of terrestrial planet is $60\%-80\%$, i.e., about $20\%-40\%$ initial mass is removed during the progress. The planetesimals will improve the efficiency of accretion rate for certain initial eccentricities and inclinations, and this also makes the newly-born terrestrial planets have lower orbital eccentricities. It is maybe a common phenomenon in the planet formation that the water-rich terrestrial planet is formed in the Habitable Zone. The structure, which is similar to that of solar system, may explain the results of disintegration of a terrestrial planet. Most of the planetesimals among Jupiter and Saturn are scattered out of the planetary systems, and this migration caused by scattering (Fernandez & Ip, 1984) or long-term orbital evolution can make planets capture at some mean motion resonance location. Accretion could also happen a few times between two planets if the outer planet has a moderate mass, and the small terrestrial planet could survive at some resonances over $10^{8}$ yr time scale. Structurally, Saturn has little effect on the architecture inside Jupiter, owing to its protection. However, obviously, a different Saturn mass could play a vital role of the structure outer Jupiter. Jupiter and Saturn in the solar system may form over the same period. In our simulations, neither terrestrial planets are formed within $0.1$ AU, nor planetesimals or embryos are left. However, a lot of exoplanets with orbital semi-major less than $0.1$ AU are observed, and several Super-Earths are discovered. It is usually believed that they were formed far from the center star and then migrated into current location (Raymond, Mandell, & Sigurdsson, 2006). We do not consider the migration in the simulations, which is caused by the interaction between the giant planets or planetesimals in the gaseous disk (Ou et al., 2007). So the simulation in this work can be applied to the case of the dissipation of gas disk, in the late stage of planet formation. In the future study, we will consider the giant planets under inward migration, and in such circumstances short-period terrestrial planet could be produced. To date, terrestrial planets are not detected in the observations, due to the reasons of the selection effect of detection methods and the low resolution precision. Both Doppler velocities and transit method are sensitive to the objects moving in smaller orbits. The current research of extrasolar terrestrial planets has greatly contributed to the origin and evolution of our own solar system. Kepler has been launched successfully on March 6, 2009, whose main scientific objective is detecting the Earth-like terrestrial planets. Along with high accuracy incoming space projects, it is predictable that more and more extrasolar planetary systems with similar structure to the solar system will be discovered. We are very grateful to Prof. Jilin Zhou of Nanjing University for reading carefully and giving valuable suggestion to improve the manuscript. We thank Prof. Qinglin Zhou and Dr. Xiaosheng Wan of Ministry of Education Key Modern Astronomy and Astrophysics Laboratory of Nanjing University for their kind help. This work is financially supported by the National Natural Science Foundation of China (Grants 10573040, 10673006, 10833001, 10233020) and the Foundation of Minor Planets of Purple Mountain Observatory. ## References * Briceño (2001) Briceño, C. et al., 2001, Science, 291, 93 * Chambers (1999) Chambers, J. E. 1999, MNRAS, 304, 793 * Chambers (2001) Chambers, J. E. 2001, Icarus, 152, 205 * Duncan, Levison & Lee (1998) Duncan, M., Levison, H. F., & Lee, M. H. 1998, AJ, 116, 2067 * Fernandez & Ip (1984) Fernandez, J. A., & Ip, W. H. 1984, Icarus, 58, 109 * Fischer et al. (2008) Fischer, D., et al. 2008, ApJ, 675, 790 * Hu & Xu (2008) Hu, Z. W., & Xu, W. B. 2008, Planet Science, Beijing: Science Press (in Chinese) * Ida & Lin (2004) Ida, S., & Lin, D. N. C. 2004, ApJ, 604, 388 * Ji et al. (2003) Ji, J. H., et al.2003, ApJ, 585, L139 * Ji et al. (2003) Ji, J. H., et al. 2003, ApJ, 591, L57 * Ji et al. (2003) Ji, J. H., et al. 2003, Chin. Astron. Astrophysics, 27, 127 * Kokubo & Ida (2002) Kokubo, E., & Ida, S. 2002, ApJ, 581, 666 * Lee & Peale (2002) Lee, M. H., & Peale, S. J. 2002, ApJ, 567, 596 * Lee (2004) Lee, M. H. 2004, ApJ, 611, 517 * Murray & Dermott (1999) Murray, C. D., & Dermott, S. F. 1999, Solar System Dynamics, New York: Cambridge University Press * Nagasawa & Ida (2000) Nagasawa, M., & Ida, S. 2000, AJ, 120, 3311 * Ou et al. (2007) Ou, S. L., et al. 2007, ApJ, 667, 1220 * Raymond, Quinn & Lunine (2004) Raymond, S. N., Quinn, T., & Lunine, J. I. 2004, Icarus, 168, 1 * Raymond, Quinn & Lunine (2006) Raymond, S. N., Quinn, T., & Lunine, J. I. 2006, Icarus, 183, 265 * Raymond, Mandell, & Sigurdsson (2006) Raymond, S. N., Mandell, A. M., & Sigurdsson, S. 2006, Science, 313, 1413 * Sándor & Kley (2006) Sándor, Z., & Kley, W. 2006, A&A, 451, L31 * Sándor, Kley & Klagyivik (2007) Sándor, Z., Kley, W., & Klagyivik, P. 2007, å, 472, 981 28 * Stoer & Bulirsch (1980) Stoer, J., & Bulirsch, R. 1980, Introduction to Numerical Analysis, New York: Springer-Verlag * Tinney et al. (2006) Tinney, C. G., et al. 2006, ApJ, 2006, 647, 594 * Wetherill (1990) Wetherill, G. W. 1990, Ann. Rev. Earth Planet Sci., 18, 205 * Zhou et al. (2004) Zhou, L. Y., et al. 2004, MNRAS, 350, 1495 * Zhou & Sun (2003) Zhou, J. L., & Sun, Y. S. 2003, ApJ, 598, 1290 * Zhou et al. (2005) Zhou, J. L., et al. 2005, ApJ, 631, L85 Table 1Properties of terrestrial planets from simulations 2a and 2b. Planet | $a$ (AU) | $e$ | $i(deg)$ | $m(m_{\oplus})$ | water mass ---|---|---|---|---|--- 2a b | 0.6174 | 0.1098 | 7.452 | 3.6421 | 0.0316% c | 1.7796 | 0.1935 | 33.890 | 0.1528 | 0.1040% d | 2.3304 | 0.3291 | 9.393 | 0.6925 | 0.5218% 2b b | 0.5274 | 0.0309 | 4.041 | 2.3527 | 0.1539% c | 1.0451 | 0.1080 | 4.915 | 1.3880 | 0.1316% d | 1.4783 | 0.0520 | 5.189 | 1.6696 | 0.7795% e | 3.1162 | 0.2086 | 6.421 | 0.0630 | 0.0010% Table 2Properties of terrestrial planets from different systems System | accretion rate | $n$ | $\bar{m}(m_{\oplus})$ | concentration | $\bar{e}$ | $\bar{i}(^{\circ})$ ---|---|---|---|---|---|--- 1a | 73.2518% | 3 | 1.8313 | 0.4606 | 0.1381 | 7.6963 1b | 80.3853% | 3 | 2.0096 | 0.4262 | 0.0937 | 1.7790 2a | 59.8322% | 3 | 1.4958 | 0.8116 | 0.2108 | 16.9117 2b | 72.9779% | 4 | 1.3683 | 0.4299 | 0.0999 | 5.1415 3a | 65.1098% | 3 | 1.6277 | 0.5337 | 0.2063 | 5.9153 3b | 66.9694% | 3 | 1.6742 | 0.5040 | 0.1839 | 5.2447 1a-3b | 69.7544% | 3.2 | 1.6678 | 0.5276 | 0.1554 | 7.1148 solar | - | 4 | 0.4943 | 0.5058 | 0.0764 | 3.0624 Figure 1.— Two-planet model and initial conditions. Figure 2.— Snapshot of simulation 2a with $M_{Saturn}=5M_{\oplus}$. The total mass of embryos is $2.4M_{\oplus}$, the masses of planetesimals inside Jupiter are $0.0317M_{\oplus}$, and those outside Jupiter are $0.0375M_{\oplus}$. Planetesimals among Jupiter and Saturn were nonself-gravitational (see Section 2.1). Note the size of each object is relative, and the value bar is log of water mass fraction, e.g. the wettest body has water mass fraction $\log_{10}(5\%)=-1.3$. Figure 3.— Snapshot of simulation 2b. Figure 4.— (a) Mass curve in simulation 2b. Figure 4.— (b) Trace of the objects’ in simulation 2b. Figure 5.— Results of six simulations. The $\bullet$ and $\times$ denote formed terrestrial planets and survival planetesimals. Jupiter and Saturn locate at about 5 AU and 10 AU, respectively. $H$ zone marked with dotted lines is so called Habitable Zone in 0.8 - 1.5 AU. Some mean motion resonance locations with Jupiter are also labeled in the figure. Figure 6.— Resonant variable $\theta_{1}$ of the 3:2 mean motion resonance of two terrestrial planets and the curve of eccentricities and semi-major axes in simulation 2a. ($\theta_{1}=2\lambda_{1}-3\lambda_{2}+\varpi_{2}$, where $\lambda_{1,2}$ are the mean longitudes and the longitudes of periapse, the footnotes 1, 2 mean the inner and outer planets respectively.)
arxiv-papers
2009-03-23T09:02:05
2024-09-04T02:49:01.348962
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zhang Niu (1,2), Ji Jianghui (2,3) ((1)Graduate School of Chinese\n Academy of Sciences, (2) Purple Mountain Observatory, (3) NAOC)", "submitter": "Jianghui Ji", "url": "https://arxiv.org/abs/0903.3810" }
0903.3836
11institutetext: † Centre de Physique Théorique de Luminy, Université de la Méditerranée, F-13288 Marseille FR, and “Sapienza” Università di Roma, Dipartimento di Fisica and ICRA, P.le A. Moro 5, 00185 Rome IT, battisti@icra.it ‡ Institut des Hautes Etudes Scientifiques, 91440 Bures-sur-Yvette FR, and “Sapienza” Università di Roma, Dipartimento di Fisica and ICRA, P.le A. Moro 5, 00185 Rome IT, lecian@ihes.fr § ICRA, ICRANet, ENEA and “Sapienza” Università di Roma, Dipartimento di Fisica, P.le A. Moro 5, 00185 Rome IT, montani@icra.it # GUP vs polymer quantum cosmology: the Taub model Marco Valerio Battisti† Orchidea Maria Lecian‡ Giovanni Montani§ ###### Abstract The fate of the cosmological singularity in the Taub model is discussed within the two frameworks. An internal time variable is ruled out and the only remaining degree of freedom (the anisotropy) of the Universe is quantized according to such schemes. The resulting GUP Taub Universe is singularity- free, differently from the second case, where the classical singularity is not tamed by the polymer-loop quantum effects. ## 1 Introduction Two different quantum cosmology approaches are applied to the Taub model. The study is performed at the classical and at the quantum level in both schemes. In particular, the generalized uncertainty principle (GUP) and the polymer (loop) frameworks are implemented to this system. In the first case [1], the cosmological singularity appears to be probabilistically suppressed, while, in the second one [2], the Universe is still singular. Such a feature then allows us to better understand the avoidance of the cosmological singularity in other different quantum gravity toy models. The Taub Universe arises as a particular case of the Bianchi IX model, i.e. the most general scheme allowed by the homogeneity constraint (for reviews see [3]). It is obtained by restricting the dynamics to that of a one-dimensional particle bouncing against a wall, when only one degree of freedom (the Universe anisotropy) is taken into account. The relevance of the Taub Universe in quantum cosmology is then due to the fact that it is a necessary step towards the Bianchi IX model, being a generalization of other isotropic models. In particular, it has been used to test the validity of the minisuperspace scheme [4] and to explore the application of the extrinsic cosmological time [5]. The paper is organized as follows. In Section 2 the Taub model and the formalisms are reviewed. Section 3 and 4 are devoted to the classical and quantum analysis respectively. Comparisons with other approaches follow in Section 5. We adopt $\hbar=c=16\pi G=1$ units. ## 2 Taub Universe and formalisms The Taub cosmological model is a particular case of the Bianchi IX Universe, of which only one anisotropy is taken into account. The Bianchi IX model, together with Bianchi VIII, is the most general spatially-homogeneous model and is described by the line element $ds^{2}=N^{2}dt^{2}-e^{2\alpha}\left(e^{2\gamma}\right)_{ij}\omega^{i}\otimes\omega^{j}$ [3]. Here $N=N(t)$ is the lapse function, $\omega^{i}=\omega^{i}_{a}dx^{a}$ are the $SO(3)$ left-invariant 1-forms, $\alpha=\alpha(t)$ describes the isotropic expansion of the Universe and $\gamma_{ij}=\gamma_{ij}(t)$ is a traceless symmetric matrix, which determines the anisotropies via $\gamma_{\pm}$. The dynamics of this Universe towards the singularity is described by the motion of a two-dimensional particle (the two physical degree of freedom of the gravitational field) in a dynamically-closed domain [3]. In the Misner picture, such a domain depends on the time variable $\alpha$, while, in the Misner-Chitré one, it becomes stationary in time. Performing the ADM reduction of the dynamics (according to which the classical constraints are solved with respect to the given momenta before implementing any quantization algorithm), an effective Hamiltonian is obtained, which depends only on the physical degrees of freedom of the system. In particular, the scalar constraint is solved with respect to the momentum conjugated to the time variable $p_{\tau}$ (we adopt the time gauge $\dot{\tau}=1$) and, performing another change of variables, we obtain $-p_{\tau}\equiv H^{IX}_{ADM}=v\sqrt{p_{u}^{2}+p_{v}^{2}}.$ (1) The dynamics of such a system is equivalent to a billiard ball on a Lobatchevsky plane and the three corners of the Misner scheme are replaced by the points $(0,0)$, $(-1,0)$ and $v\rightarrow\infty$ in the $(u,v)$-plane, as in Fig. 1. Figure 1: The dynamical-allowed domain in the $(u,v)$-plane where the dynamics is restricted. The Taub cosmological model is described by $\gamma_{-}=0$. The dynamics of this Universe is equivalent to the motion of a particle in a one-dimensional closed domain. Such a domain corresponds the choice of only one of the three equivalent potential walls of the Bianchi IX model. The ADM Hamiltonian (1) rewrites $H_{ADM}^{T}=vp_{v}$, where $v\in[1/2,\infty)$. This Hamiltonian can be further simplified defining the new variable $x=\ln v$, and becomes $H_{ADM}^{T}=p_{x}\equiv p$ (2) where the configuration variable $x$ is related to the Universe anisotropy $\gamma_{+}$ by the equation $\gamma_{+}=e^{\tau-x}(e^{2x}-3/4)/\sqrt{3}$. The Hamiltonian (2) will be the starting point of our analysis. It is worth noting that the classical singularity now appears for $\tau\rightarrow\infty$. ### 2.1 GUP quantum mechanics Some issues and results of a non-relativistic quantum mechanics with non-zero minimal uncertainties in position are briefly reviewed [6]. In one dimension, we consider the Heisenberg algebra generated by $q$ and $p$ obeying the commutation relation $[q,p]=i(1+\beta p^{2}),$ (3) where $\beta>0$ is a deformation parameter. This commutation relation leads to the generalized uncertainty relation $\Delta q\Delta p\geq\frac{1}{2}\left(1+\beta(\Delta p)^{2}+\beta\langle p\rangle^{2}\right)$, which appears in string theory [7]. The canonical Heisenberg algebra can be recovered in the limit $\beta=0$, and the generalization to more dimension is straightforward, leading naturally to a “noncommutative geometry” for the space coordinates. It is immediate to verify that a finite minimal uncertainty in position $\Delta q_{min}=\sqrt{\beta}$ is predicted. The existence of a non-zero uncertainty in position is relevant since it implies that there cannot be any physical state that is a position eigenstate. In fact, an eigenstate of an observable necessarily has a vanishing uncertainty on it. Although it is possible to construct position eigenvectors, they are only formal eigenvectors and not physical states. The deformed Heisenberg algebra (3) can be represented in the momentum space as $p\psi(p)=p\psi(p),\qquad q\psi(p)=i(1+\beta p^{2})\partial_{p}\psi(p),$ (4) on a dense domain $S$ of smooth functions. To recover information on position we have to study those states, which realize the maximally-allowed localization. Such states $|\psi^{ml}_{\zeta}\rangle$, which are proper physical states around a position $\zeta$, have the proprieties $\langle\psi^{ml}_{\zeta}|q|\psi^{ml}_{\zeta}\rangle=\zeta$ and $(\Delta q)_{|\psi^{ml}_{\zeta}\rangle}=\Delta q_{min}$. We can project an arbitrary state $|\psi\rangle$ on the maximally-localized states $|\psi^{ml}_{\zeta}\rangle$ to obtain the probability amplitude for a particle being maximally localized around the position $\zeta$ (i.e. with standard deviation $\Delta q_{min}$). We call these projections the quasiposition wave function $\psi(\zeta)=\langle\psi^{ml}_{\zeta}|\psi\rangle$, and explicitly we have the generalized Fouries transformation $\psi(\zeta)\sim\int^{+\infty}_{-\infty}\frac{dp}{(1+\beta p^{2})^{3/2}}\exp\left(i\frac{\zeta}{\sqrt{\beta}}\tan^{-1}(\sqrt{\beta}p)\right)\psi(p).$ (5) As $\beta\rightarrow 0$, the ordinary position wave function $\psi(\zeta)=\langle\zeta|\psi\rangle$ is recovered. ### 2.2 Polymer quantum mechanics The polymer representation of quantum mechanics consists in defining abstract kets, labeled by a real number and assumed to form an orthonormal basis, and then considering a suitable finite subset of them, whose Hilbert space is defined by the corresponding inner product [8]. This procedure helps one gain insight onto some particular features of quantum mechanics, when an underlying discrete structure is somehow hypothesized. The request that the Hamiltonian associated to the system be of direct physical interpretation defines the polymer phase space, and the continuum limit can be recovered by the introduction of the concept of the scale [9]. In the particular case of a discrete position variable in the momentum polarization, the Hamiltonian variable $p$ cannot be implemented as an operator, so that some restrictions on the model have to be required. If the set of kets is restricted by the introduction of a regular graph $\gamma_{\mu_{0}}$, the kynetic term of the Hamiltonian is approximated by the polymer substitution $p\rightarrow\frac{1}{\mu_{0}}\sin(\mu_{0}p),$ (6) where the incremental ratio is evluated for an exponentiated operator. The Hamiltonian operator $H_{\mu_{0}}$, which lives in $\mathcal{H}_{\gamma_{\mu_{0}}}$, reads $H_{\mu_{0}}=\frac{\hat{p}_{\mu_{0}}^{2}}{2m}+V(\hat{q}).$ (7) The definition of a scale, $C_{n}$, eables one to approximate continuous functions with functions that are constant on the intervals. As a result, at any given scale $C_{n}$, the kinetic term of the Hamiltonian operator can be approximated, and effective theories at given scales are related by coarse- graining maps. ## 3 Deformed classical dynamics The ordinary Taub model can be interpreted as a massless scalar relativisitic particle moving in the Lorentzian minisuperspace ($\tau,x$)-plane, whose the classical trajectory is its light-cone. More precisely, the incoming particle ($\tau<0$) bounces on the wall ($x=x_{0}=\ln(1/2)$) and falls into the classical cosmological singularity ($\tau\rightarrow\infty$). Investigating the modification of the dynamics within the two frameworks will show that the two behaviors can be interpreted as complementary. ### 3.1 GUP framework The GUP-classical dynamics is contained in the modified symplectic geometry arising from the classical limit of (3), as soon as the parameter $\beta$ is regarded as an independent constant with respect $\hbar$. It is then possible to replace the quantum-mechanical commutator (3) via its Poisson brackets, i.e. $-i[q,p]\Longrightarrow\\{q,p\\}=(1+\beta p^{2})$. The Poisson brackets for any two-dimensional phase space function are $\\{F,G\\}=\left(\frac{\partial F}{\partial q}\frac{\partial G}{\partial p}-\frac{\partial F}{\partial p}\frac{\partial G}{\partial q}\right)(1+\beta p^{2}).$ (8) Applying this scheme to the Hamiltonian (2), we immediately obtain the equations of motion for the model [1], $x(\tau)=(1+\beta A^{2})\tau+cost,\qquad p(\tau)=cost=A,$ (9) where $x\in[x_{0},\infty)$. Therefore, at the classical level, the effects of the deformed Heisenberg algebra (3) on the Taub Universe are as follows. The angular coefficient is $(1+\beta A^{2})>1$ for $\beta\neq 0$, and thus the angle between the two straight lines $x(\tau)$, for $\tau<0$ and $\tau>0$, becomes smaller as the values of $\beta$ grows. The trajectories of the particle (Universe), before and after the bounce on the potential wall at $x=x_{0}\equiv\ln(1/2)$, are closer to each other then in the canonical case ($\beta=0$). ### 3.2 Polymer framework The polymer-classical dynamics relies on the substitution (6) in the Hamiltonian of the model (2). This way, the equations of motion rewrite [2] $\dot{x}=\left\\{x,H\right\\}=\cos(ap),\qquad\dot{p}=\left\\{p,H\right\\}=0,$ (10) where a dot denotes differentiation with respect to the time variable $\tau$. The equations of motion are immediately solved as $x(\tau)=\cos(ap)\tau,\qquad p(\tau)=A,$ (11) where $A$ is a constant. In the discretized (polymer) case, i.e. for $a\neq 0$, the one-parameter family of trajectories flattens. In fact, the angle between the incoming trajectory and the outgoing one is greater than $\pi/2$, since $p\in\left(-\pi/a,\pi/a\right)$. As these trajectories diverge rather than converge, we expect the polymer quantum effects to be reduced with respect to the classical case, as we will verify below. ## 4 Deformed quantum dynamics The quantum dynamics of the Taub Universe is here investigated according to the two different approaches. Particular attention is paid to the wave-packet evolution and the consequential fate of the classical cosmological singularity. In both frameworks, the variable $\tau$ is regarded as a time coordinate and therefore ($\tau,p_{\tau}$) are treated in the canonical way. The deformed quantization (GUP or polymer) is then implemented only to the submanifold describing the only degree of freedom of the Universe, i.e. the phase space spanned by ($x,p$). We then deal with a Schrödinger-like equation $i\partial_{\tau}\Psi(\tau,p)=\hat{H}_{ADM}^{T}\Psi(\tau,p),$ (12) where the operator $\hat{H}_{ADM}^{T}$ accounts for the modifications due to the two frameworks. We have to square the eigenvalue problem in order to correctly impose the boundary condition: in agreement with the analysis developed in [10], we make the well-grounded hypothesis that the eigenfunctions form be independent of the presence of the square root, since its removal implies the square of the eigenvalues only. The wave packets, which are superposition of the eigenfunctions $\Psi(\tau,x)=\int_{0}^{\infty}dkA(k)\psi_{k}(x)e^{-ik\tau}$, are then constructed for both models, taking $A(k)$ as a Gaussian-like weighting function. The differences between the two approaches are due to the features of the eigenfunctions $\psi_{k}(x)$. Analyzing such an evolution, we show that the GUP Taub Universe appears to be probabilistically singularity-free, differently from the polymer case, where the singularity is not tamed by the cut-off-scale effects. ### 4.1 GUP framework We now analyze the model in the GUP approach [1]. As explained before, we lost all informations on the position itself, so that the boundary conditions have to be imposed on the quasiposition wave function (5), i.e. $\psi(\zeta_{0})=0$ (where $\zeta_{0}=\langle\psi^{ml}_{\zeta}|x_{0}|\psi^{ml}_{\zeta}\rangle$, in agreement with the previous discussion). The solution of the eigenvalue problem is the Dirac $\delta$-distribution $\psi_{k}(p)=\delta(p^{2}-k^{2})$, and therefore the quasiposition wave function (5) reads $\psi_{k}(\zeta)=\frac{A}{k(1+\beta k^{2})^{3/2}}\left[\exp\left(i\frac{\zeta}{\sqrt{\beta}}\tan^{-1}(\sqrt{\beta}k)\right)-\exp\left(i\frac{(2\zeta_{0}-\zeta)}{\sqrt{\beta}}\tan^{-1}(\sqrt{\beta}k)\right)\right],$ (13) where $A$ is a constant and the boundary condition $\psi(\zeta_{0})=0$ has been imposed. The deformation parameter $\beta$, i.e. the presence of a non- zero minimal uncertainty for the configuration variable, is responsible for the GUP effects on the dynamics. The physical interpretation of $\beta$ is then a non-zero minimal uncertainty in the anisotropy of the Universe. To better understand the modifications induced by the deformed Heisenberg algebra on the canonical Universe dynamics, we have to analyze different $\beta$-regions. In fact, when $\beta$ becomes more and more important, i.e. when we are at some scale that allows us to appreciate the GUP effects, the evolution of the wave packets is different from the canonical case. More precisely, these effects are present when the product $k_{0}\sqrt{\beta}$ becomes remarkable, i.e. when $k_{0}\sqrt{\beta}\sim\mathcal{O}(1)$, and therefore when $\beta$ is comparable to $1/k_{0}^{2}$. In fact, the correct semiclassical behaviors of the model far away from the singularity is described by wave packets peaked at energies much smaller then $1/\sqrt{\beta}$ [1]. In particular, for $k_{0}=1$, we can distinguish between three different $\beta$-regimes: * • $\beta\sim\mathcal{O}(10^{-2})$ regime. The wave packets begin to spread and a constructive and destructive interference between the incoming and outgoing wave appears. The probability amplitude to find the Universe is still peaked around the classical trajectory. * • $\beta\sim\mathcal{O}(10^{-1})$ regime. It is no more possible to distinguish an incoming or outgoing wave packet and, at this level, the notion of a wave packet following a classical trajectory becomes meaningless. * • $\beta\sim\mathcal{O}(1)$ regime. A dominant probability peak “near” the potential wall appears. There are also other small peaks for growing values of $\zeta$, but they are widely suppressed for bigger $\beta$. The motion of wave packets shows a stationary behavior, i.e. these are independent of $\tau$. See Fig. 2. Following this picture we are able to learn the GUP modifications to the WDW wave packets evolution. In fact, from small to big values of $\beta$, we can see how the wave packets escape from the classical trajectories and approach a stationary state close to the potential wall. Figure 2: Wave packets $|\Psi(\tau,\zeta)|$ in the GUP framework as $\beta k_{0}^{2}=1$ ($k_{0}=1$ and $\sigma=4$). Such a behavior is, in some sense, expected from a classical point of view. In fact, at classical level the ingoing and the outgoing trajectories shrink each other. So a quantum probability interference is a fortiori predicted. On the other hand, the stationarity feature exhibited by the Universe in the ($\beta\sim\mathcal{O}(1)$)-region is a purely quantum GUP effect. Such a behavior cannot be inferred from a deformed classical analysis. From this point of view, the classical singularity ($\tau\rightarrow\infty$) is widely probabilistically suppressed, because the probability to find the Universe is peaked just around the potential wall. This way we claim that the GUP-Taub Universe is singularity-free. ### 4.2 Polymer framework We now analyze the model in the polymer approach [2]. For the quantum analysis of the model, we choose a discretized $x$ space, and solve the corresponding eigenvalue problem in the $p$ polarization. Considering the time evolution for the wave function $\Psi$ as given by $\Psi_{k}(p,\tau)=e^{-ik\tau}\psi_{k}(p)$ and the results of [10], we obtain the following eigenvalue problem $(p^{2}-k^{2})\psi_{k}(p)=\left[\frac{2}{a^{2}}\left(1-\cos(ap)\right)-k^{2}\right]\psi_{k}(p),$ (14) solved by $\displaystyle k^{2}=k^{2}(a)=\frac{2}{a^{2}}\left(1-\cos(ap)\right)\leq k^{2}_{max}=\frac{4}{a^{2}}$ (15a) $\displaystyle\psi_{k,a}(p)=A\delta(p-p_{k,a})+B\delta(p+p_{k,a})$ (15b) $\displaystyle\psi_{k,a}(x)=A\left[\exp(ip_{k,a}x)-\exp(ip_{k,a}(2x_{0}-x))\right]:$ (15c) (15b) is the momentum wave function, with $A$ and $B$ two arbitrary integration constant, and (15c) is the coordinate wave function, where an integration constant has been eliminated by imposing suitable boundary conditions. Moreover, we have defined the modified dispersion relation $p_{k,a}\equiv\frac{1}{a}\arccos\left(1-\frac{k^{2}a^{2}}{2}\right)$ (16) from (15a). Furthermore, we stress that $k^{2}$ is bounded from above, as illustrated in (15a), but it is its square root, considered for its positive determination, which accounts for the time evolution of the wave function. We now construct suitable wave packets $\Psi(x,\tau)$ taking into account the previous discussion (note that a maximum energy $k_{max}$ is now predicted). Three relevant cases can be distinguished: Figure 3: The spread polymer wave packet $|\Psi(x,\tau)|$ as $k_{0}a=1/2$ ($a=50$, $k_{0}=0.01$, $\sigma=0.125$). * • $k_{0}a\sim\mathcal{O}(1)$ and peaked weighting function. The resulting wave packet is well approximated by a purely monochromatic wave. A small interference phenomenon between the wave and the wall is then predicted. * • $k_{0}a\sim\mathcal{O}(1)$ and spread weighting function. A strong interference phenomenon between the wave and the wall now appears. Nevertheless, this interference phenomenon is not able to probabilistically tame the singularity, as it takes place in the ’outer’ region, in a way complementary to that of the GUP approach (see Fig. 3). The polymer-Taub Universe is then still a singular cosmological model. * • $k_{0}a\ll\mathcal{O}(1)$ regime. This can be considered as the semi-classical limit of the model. In fact, differently from the other cases, the value of $k_{0}$ around which the wave packet is peaked is not arbitrary, but constrained by the characteristic scale $a$ under investigation. The ordinary WDW behavior is therefore recasted. ## 5 Comparison with other approaches The Taub cosmological model offers a suitable scenario, where different quantization techniques can be applied. In fact, it is possible to single out a time variable, so that the anisotropy describes the real degree of freedom of the Universe. It is therefore reasonable to investigate the fate of the cosmological singularity without modifying the time variable. The comparison with analysis of the cosmological singularity in other cosmological models outlines how the features of the Taub model allow one to pick the cut off effects out of those due to the choice of the Hamiltonian variables. In the cosmological isotropic sector of GR, i.e. the FRW models, the singularity is removed by loop quantum effects. The wave function of the universe exhibits a non-singular behavior at the classical singularity, and the big-bang is replaced by a big-bounce, when a free scalar field is taken as the relational time [11]. The scale factor of the universe is directly quantized by the use of the polymer (loop) techniques, so that the evolution itself of the wave packet of the universe is deeply modified by such an approach. The Hamiltonian constraint does not allow for a constant solution of the variable conjugated to the scale factor, so that it is not possible to choose a scale, such that the polymer modifications are negligible throughout the whole evolution, so that the comparison with the ordinary representation is not always possible. Anyhow, we stress that, for the Taub model, the cosmological singularity is probabilistically suppressed, regardless to the fact whether the system can appreciated or not the cut off during the whole evolution. In [12], all the degrees of freedom of the Bianchi cosmological models in the ADM reduction of the dynamics are quantized by loop techniques. In particular, also the time variable, i.e. the Universe volume, is treated at the same level as the others. In most cases, the time variable is defined by a phase space variable, i.e. it is an internal one. As a result, also the Bianchi Universes are singularity-free [13]. In this respect, our analysis is based on considering the time variable as an ordinary Heisenberg variable, while the cut off is imposed on the anisotropy only. The GUP dynamics of other cosmological models has been investigated in different approaches. In particular, the big-bang singularity appears to be tamed by GUP effects showing a stationary behavior of the wave packets [14]. Such a prediction is in agreement with those achieved in a noncommutative quantum cosmology [15]. However, in order to predict a big bounce à la LQC, a Snyder-deformed quantum cosmology has to be addressed [16]. As the last point, it is interesting to notice that the GUP-Mixmaster Universe is still a chaotic model [17], as opposite to the LQC one [18], the difference being essentially based on the application of the deformed scheme to the time variable too. Acknowledgments. The “Angelo Della Riccia” Fellowship and the “Sapienza CUN 2” Fellowship are gratefully acknowledged. ## References * [1] M.V.Battisti and G.Montani, Phys.Rev.D 77 (2008) 023518. * [2] M.V.Battisti, O.M.Lecian and G.Montani, Phys.Rev.D 78 (2008) 103514. * [3] G.Montani, M.V.Battisti, R.Benini and G.Imponente, Int.J.Mod.Phys.A 23 (2008) 2353; J.M.Heinzle and C.Uggla, arXiv:0901.0776. * [4] K.Kuchar and M.P.Ryan, Phys.Rev.D 40 (1989) 3982. * [5] G.Catren and R.Ferraro, Phys.Rev.D 63 (2001) 023502. * [6] A.Kempf, G.Mangano and R.B.Mann, Phys.Rev.D 52 (1995) 1108; A.Kempf, J.Math.Phys. 38 (1997) 1347. * [7] D.J.Gross and P.F.Mendle, Nucl.Phys.B 303 (1988) 407; D.Amati, M.Ciafaloni and G.Veneziano, Phys.Lett.B 216 (1989) 41. * [8] A.Ashtekar, S.Fairhurst and J.L.Willis, Class.Quant.Grav. 20 (2003) 1031; A.Corichi, T.Vukasinac and J.A.Zapata, Phys.Rev.D 76 (2007) 0440163. * [9] A.Corichi, T.Vukasinac and J.A.Zapata, Class.Quant.Grav. 24 (2007) 1495. * [10] R.Puzio, Class.Quant.Grav. 11 (1994) 609. * [11] A.Ashtekar, T.Pawlowski and P.Singh, Phys.Rev.Lett. 96 (2006) 141301; Phys.Rev.D 73 (2006) 124038. * [12] M.Bojowald, G.Date and K.Vandersloot, Class.Quant.Grav. 21 (2004) 1253; M.Bojowald, Class.Quant.Grav. 20 (2003) 2595. * [13] D.W.Chiou, Phys.Rev.D 76 (2007) 124037; G.Date, Phys.Rev.D 71 (2005) 127502. * [14] M.V.Battisti and G.Montani, Phys.Lett.B 656 (2007) 96. * [15] B.Vakili and H.R.Sepangi, Phys.Lett.B 651 (2007) 79; H.R.Sepangi, B.Shakerin and B.Vakili, Class.Quant.Grav. 26 (2009) 065003. * [16] M.V.Battisti, arXiv:0805.1178; J.Phys.Conf.Ser. (at press), arXiv:0810.5039. * [17] M.V.Battisti and G.Montani, arXiv:0808.0831. * [18] M.Bojowald and G.Date, Phys.Rev.Lett. 92 (2004) 071302.
arxiv-papers
2009-03-23T11:25:05
2024-09-04T02:49:01.357246
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Marco Valerio Battisti, Orchidea Maria Lecian and Giovanni Montani", "submitter": "Marco Valerio Battisti", "url": "https://arxiv.org/abs/0903.3836" }
0903.3837
11institutetext: † Centre de Physique Théorique de Luminy, Université de la Méditerranée, F-13288 Marseille FR, and “Sapienza” Università di Roma, Dipartimento di Fisica and ICRA, P.le A. Moro 5, 00185 Rome IT, battisti@icra.it ‡ “Sapienza” Università di Roma, Dipartimento di Fisica and ICRA, P.le A. Moro 5, 00185 Rome IT, riccardo.belvedere@icra.it § ICRA, ICRANet, ENEA and “Sapienza” Università di Roma, Dipartimento di Fisica, P.le A. Moro 5, 00185 Rome IT, montani@icra.it # Semi-classical isotropization of the Mixmaster Universe Marco Valerio Battisti† Riccardo Belvedere‡ Giovanni Montani§ ###### Abstract A semi-classical mechanism which leads to the isotropization of the Mixmaster Universe is developed. A wave function of this Universe, which has a meaningful probabilistic interpretation, is constructed and it describes the evolution of the anisotropies of the Universe with respect to the isotropic scale factor, which plays the external observer-like role. We show that, once large volume regions are investigated, the closed Friedmann-Robertson-Walker configuration is deeply privileged. Quantum cosmology denotes the application of the quantum theory to the entire Universe [1]. It can be then viewed as a natural arena to investigate as part of a more general drive to understood quantum gravity. In canonical quantum gravity, the quantum state $\Psi$ of the system is generally represented by a wave functional describing the dynamics of the three metric $h_{ij}$ as well as matter fields $\phi$, i.e. $\Psi=\Psi[h_{ij}(x),\phi(x)]$. This state is defined on the the Wheeler superspace and, since of the diffeomorphisms invariance of GR, it has no explicit dependence on time. In particular, it (formally) satisfies the Dirac quantum implementation of the first-class constraints of GR. A complete quantum theory of gravity is not yet available and therefore this problem is not properly defined. To overcame such a feature the fields are usually restricted (by hand) to a finite dimensional subspace of the superspace, i.e. we deal with the minisuperspace representation. Quantum cosmology is explicitly defined as the minisuperspace quantization of homogeneous (finite degrees of freedom) cosmological models. From the peculiarity of the system-Universe, fundamental interpreting difficulties of the wave function of the Universe $\Psi$ arise. The question about the interpretation (i.e. extracting physical statements) of quantum cosmology clearly appears as soon as the differences with respect to ordinary quantum mechanics are addressed [2, 3]. The standard interpretation of quantum mechanics (the Copenhagen one) involves the following basic assumptions. (i) There exist an external observer to the quantum system, i.e. the model under investigation is not genuinely closed. (ii) Predictions are probabilistic in nature and performed by a measurement of an external agency. (iii) Time plays a central and peculiar role. By contrast quantum cosmology is defined by the following features. (i) The analyzed model is the Universe as whole, i.e. it is closed without external observers. (ii) No external measurement crutch is available and an internal one can not plays the observer-like role since of the extreme conditions a very early Universe is subjected on. (iii) The time coordinate is not an observable in GR and at quantum level it is known as the problem of time. The most developed idea to solve these features relies in accepting that a meaningfully interpretation of the wave function of the Universe can be only formulated at semi-classical level. More precisely, it is only possible to quantum-mechanically interpret a small subsystem of the entire Universe, i.e. in the domain where at least some of the minisuperspace variables are semi- classical in the sense of the Wentzel-Kramers-Brillouin (WKB) approximation. In this work such a scheme is implemented to the most general homogeneous cosmological model, i.e. the Mixmaster Universe. The relevance of this model relies on the fact that a generic solution of the Einstein equations toward the cosmological singularity is formulated by a collection of causal independent Bianchi IX horizons [4]. In particular, a wave function of the Universe which has a clear probabilistic interpretation when the isotropic scale factor $a$ of the Universe is regarded as semi-classical is obtained. It describes the quantum evolution of the Mixmaster anisotropies and its dynamics is traced with respect to $a$, which can be regarded as a semi-classical variable as soon as the Universe expands enough. The main result is that the wave function of the Universe is spread over all values of anisotropy near the cosmological singularity but, when the radius of the Universe grows, it is asymptotically peaked around the isotropic configuration. The closed Friedmann-Robertson-Walker (FRW) cosmological model is thus the naturally privileged state far enough from the classical singularity. A semi-classical isotropization mechanism for the Mixmaster Universe is then predicted. The dynamics of the homogeneous cosmological models (the Bianchi Universes) is summarized, in the canonical formalism, by the scalar constraint (for reviews see [5]) $\mathcal{H}=\kappa\left[-\frac{p_{a}^{2}}{a}+\frac{1}{a^{3}}\left(p_{+}^{2}+p_{-}^{2}\right)\right]+\frac{a}{4\kappa}V(\beta_{\pm})+U(a)=0,$ (1) where the potential term $V(\beta_{\pm})$ accounts for the spatial curvature of the model. Here $\kappa=8\pi G$, the variable $a=a(t)$ describes the isotropic expansion of the Universe and its shape changes (anisotropies) are associated to $\beta_{\pm}=\beta_{\pm}(t)$. The phase space of this model is thus six dimensional and the cosmological singularity appears for $a\rightarrow 0$. In the Universe dynamics we have assumed the matter terms to be negligible with respect to the cosmological constant $\Lambda$, i.e. the isotropic potential $U(a)$ reads $U(a)=-a/4\kappa+\Lambda a^{3}/\kappa$. As matter of fact, far enough from the singularity, the cosmological constant term dominates on the other ordinary matter fields and such a contribution is necessary in order to the inflationary scenario takes place [6, 7]. As we said, a correct definition of probability in quantum cosmology can be formulated by distinguishing between semi-classical and quantum variables [2]. More precisely, the variables which satisfy the Hamilton-Jacobi equation are regarded as semi-classical and is assumed that the quantum variables do not affect the dynamics generated by the semi-classical ones. In this respect we claim that the quantum variables describe a small subsystem of the Universe and is then natural to regard the isotropic expansion variable $a$ as the semi-classical one while considering the anisotropy coordinates $\beta_{\pm}$ (the two physical degrees of freedom of the Universe) as the purely quantum variables. We are thus requiring ab initio that the radius of the Universe is of different nature with respect to the anisotropies. To implement such a picture, the wave function of the Universe $\Psi=\Psi(a,\beta_{\pm})$ is assumed to be [2] $\Psi=\Psi_{0}\chi=A(a)e^{iS(a)}\chi(a,\beta_{\pm}).$ (2) This wave function is WKB-like in the $a$ coordinate and the additional function $\chi$ depends on the quantum variables $\beta_{\pm}$ and only parametrically, in the sense of the Born-Oppenheimer approximation, on $a$. The canonical quantization of this model is achieved by the use of the Dirac prescription for quantizing constrained systems [8], i.e. imposing that the physical states are those annihilated by the self-adjoint operator $\hat{\mathcal{H}}$ corresponding to the classical counterpart (1). Considering (2), we obtain from the quantum operator version of (1) the Hamilton-Jacobi equation for $S$ and the continuity equation for the amplitude $A$ $-\kappa A\left(S^{\prime}\right)^{2}+aUA+\mathcal{V}_{q}=0,\qquad\frac{1}{A}\left(A^{2}S^{\prime}\right)^{\prime}=0,$ (3) respectively. Here the prime denotes differentiation with respect to the scale factor $a$ and $\mathcal{V}_{q}=\kappa A^{\prime\prime}$ is the so-called quantum potential, which in this model is negligible far from the classical singularity even if the $\hbar\rightarrow 0$ limit is not taken into account (see below). As usual $S(a)$ defines a congruence of classical trajectories. The new equation we find is a Schrödinger-like one describing the evolution of the proper quantum state $\chi$. Neglecting higher order correction terms in $\hbar$, it reads $-2ia^{2}S^{\prime}\partial_{a}\chi=\hat{H}_{q}\chi,\qquad H_{q}=p_{+}^{2}+p_{-}^{2}+\frac{a^{4}}{4\kappa^{2}}V(\beta_{\pm}).$ (4) Such an equation is in agreement with the assumption that the anisotropies describe a quantum subsystem of the whole Universe, i.e. that the wave function $\chi$ depends only on $\beta_{\pm}$ (in the Born-Oppenheimer sense). As matter of fact, the smallness of such a quantum subsystem can be formulated requiring that its Hamiltonian $H_{q}$ is of order $\mathcal{O}(\epsilon^{-1})$, where $\epsilon$ is a small parameter proportional to $\hbar$. Since the action of the semi-classical Hamiltonian operator $\hat{H}_{0}=a^{2}\partial_{a}^{2}+a^{3}U/\kappa$ on the wave function $\Psi$ is of order $\mathcal{O}(\epsilon^{-2})$, the idea that the anisotropies do not influence the isotropic expansion of the Universe can be formulated as $\hat{H}_{q}\Psi/\hat{H}_{0}\Psi=\mathcal{O}(\epsilon)$. Such a requirement is physically reasonable since, the semi-classical proprieties of the Universe as well as the smallness of the quantum subsystem, are both related to the fact that the Universe is large enough [2]. A purely Schrödinger equation for the wave function $\chi$ is obtained taking into account the tangent vector to the classical path. Using $p_{a}=S^{\prime}$, the equations of motion (3) and considering the time gauge $da/dt=1$, is possible to define the new time variable $\tau$ such that $d\tau=(N\kappa/a^{3})da$. In the asymptotic interesting region ($a\gg l_{\Lambda}\equiv 1/\sqrt{\Lambda}$) the evolution equation (4) rewrites as $i\partial_{\tau}\chi=\left(-\Delta_{\beta}+\frac{a^{4}}{4\kappa^{2}}V(\beta_{\pm})\right)\chi,$ (5) where $\tau=(\kappa/12\sqrt{\Lambda})a^{-3}+\mathcal{O}(a^{-5})$. This is the Schrödinger equation for the wave function $\chi$ describing the quantum variables $\beta_{\pm}$. The wave function (2) defines a probability distribution $\rho(a,\beta_{\pm})$ which appears to be $\rho(a,\beta_{\pm})=\rho_{0}(a)\rho_{\chi}(a,\beta_{\pm})$, where $\rho_{0}(a)$ is the classical probability distribution for the semi-classical variable $a$ and $\rho_{\chi}=|\chi|^{2}$ denotes the probability distribution for the quantum variables $\beta_{\pm}$ on the classical trajectories (3) where the wave function $\chi$ can be normalized. In order to enforce the idea that the anisotropies can be considered as the only quantum degrees of freedom of the Universe, we consider the quasi- isotropic regime $|\beta_{\pm}|\ll 1$. Moreover, since we are interested at the link between the isotropic and anisotropic dynamics, the Universe has to be get through to such a quasi-isotropic era. In this regime, the potential term reads $V(\beta_{\pm})=8(\beta_{+}^{2}+\beta_{-}^{2})+\mathcal{O}(\beta^{3})$ and the Schrödinger equation (5) can be then written as $i\partial_{\tau}\chi=\frac{1}{2}\left(-\Delta_{\beta}+\omega^{2}(\tau)(\beta_{+}^{2}+\beta_{-}^{2})\right)\chi,$ (6) where $\omega^{2}(\tau)=C/\tau^{4/3}$ and $C$ being a constant given by $2C=1/6^{4/3}(\kappa\Lambda)^{2/3}$. In other words, we are dealing with a time-dependent bi-dimensional harmonic oscillator with frequency $\omega(\tau)$. The quantum theory of an harmonic oscillator with time- dependent frequency is well known [9] and the solution of the Schrödinger equation (6) can be analytically obtained. Through the introduction of the generalized invariant state, whose eigenstates are connected with those of a time-independent harmonic oscillator, and via an unitary transformation, the wave function $\chi_{n}=\chi_{+}\chi_{-}$ reads $\chi_{\pm}=\chi_{n}(\beta_{\pm},\tau)=A\frac{e^{i\alpha_{n}(\tau)}}{\sqrt{\rho}}h_{n}(\beta_{\pm}/\rho)\exp\left[\frac{i}{2}\left(\dot{\rho}\rho^{-1}+i\rho^{-2}\right)\beta_{\pm}^{2}\right].$ (7) In this formula $A$ denotes the normalization constant, $h_{n}$ are the usual Hermite polynomial of order $n$ and $\rho(\tau)$ and the phase $\alpha(\tau)$ are respectively given by $\rho=\sqrt{\frac{\tau}{\sqrt{C}}\left(1+\frac{\tau^{-2/3}}{9C}\right)},\qquad\alpha_{n}=-\left(n+\frac{1}{2}\right)\int\frac{d\tau}{\rho^{2}(\tau)}.$ (8) It is immediate to verify that, when $\omega(\tau)\rightarrow\omega_{0}$ and $\rho(\tau)\rightarrow\rho_{0}=1/\sqrt{\omega_{0}}$ (namely $\alpha(\tau)\rightarrow-\omega_{0}(n+1/2)\tau$), the solution of a time- independent harmonic oscillator is recovered. Let us now investigate the probability density to find the quantum subsystem of the Universe at a given state. The anisotropies appear to be probabilistically suppressed as soon as the Universe expands enough far from the cosmological singularity (which we remember appears for $a\rightarrow 0$ or $\tau\rightarrow\infty$). Such a feature can be immediately observed from the behavior of the squared modulus of the wave function (7) which is given by $|\chi_{n}|^{2}\sim\frac{1}{\rho^{2}}|h_{n_{+}}(\beta_{+}/\rho)|^{2}|h_{n_{-}}(\beta_{-}/\rho)|^{2}e^{-\beta^{2}/\rho^{2}},$ (9) where $\beta^{2}=\beta^{2}_{+}+\beta^{2}_{-}$ and with $\sim$ we omit the normalization constant. This probability density is still time-dependent through $\rho=\rho(\tau)$ since the evolution of the wave function $\chi$ is not traced by an unitary time operator. As we can see from (9), when a large enough isotropic cosmological region is considered (namely when the limit $a\rightarrow\infty$ or $\tau\rightarrow 0$ is taken into account), the probability density to find the Universe is sharply peaked at the isotropic configuration, i.e. for $|\beta_{\pm}|\simeq 0$. In this limit (which corresponds to $\rho\rightarrow 0$) the probability density $|\chi_{n=0}|^{2}$ of the ground state ($n=n_{+}+n_{-}=0$) is given by $|\chi_{n=0}|^{2}\stackrel{{\scriptstyle\tau\rightarrow 0}}{{\longrightarrow}}\delta(\beta,0)$, thus is proportional to the Dirac $\delta$-distribution centered on $\beta=0$ (see Fig. 1). Figure 1: The ground state of the wave function $\chi(\beta_{\pm},\tau)$ far from the cosmological singularity, i.e. in the $\tau\rightarrow 0$ limit. In the plot we take $C=1$. Summarizing, when the Universe moves away from the cosmological singularity, the probability density to find it is asymptotically peaked around the closed FRW configuration. Near the initial singularity all values of anisotropy $\beta$ are almost equally favored from a probabilistic point of view. On the other hand, as the radius of the Universe grows, the isotropic state become the most probable one. (For other similar approaches see [10].) It is worth noting that the key feature of such a result relies on the fact that the isotropic scalar factor $a$ was considered as an intrensically different variable with respect to the anisotropies. It was treated as a semi- classical variable while only the two physical degrees of freedom of the Universe ($\beta_{\pm}$) were described as real quantum coordinates. This way, a positive semidefinite probability density for the wave function of the quantum subsystem of the Universe can be constructed and a clear interpretation of it considered. The validity of such an assumption can be verified from the analysis of the Hamilton-Jacobi equations (3). In particular, the WKB function $\Psi_{0}=\exp(iS+\ln A)$ approaches the quasi- classical limit $e^{iS}$ as soon as $a\gg l_{\Lambda}$ ($l_{\Lambda}$ being the inflation characteristic length [7]). To corroborate the model, we have studied the classical limit too. Splitting the $S$-function in two terms, respectively for the time variable $a$ and for the anisotropies $\beta_{\pm}$, we achieve, if $a\gg l_{\Lambda}$, an analogous behavior of the anisotropies, i.e. them go to reduce themselves once one moves away from the cosmological singularity. Acknowledgments. M. V. B. thanks ”Fondazione Angelo Della Riccia” for financial support. ## References * [1] D.L.Wiltshire, gr-qc/0101003; C.Kiefer and B.Sandhoefer, arXiv:0804.0672. * [2] A.Vilenkin, Phys.Rev.D 39 (1989) 1116; Phys.Rev.D 33 (1986) 3560. * [3] J.Halliwell and S.Hawking, Phys.Rev.D 31 (1985) 1777; J.J.Halliwell, gr-qc/9208001; F.Embacher, gr-qc/9605019. * [4] V.A.Belinski, I.M.Khalatnikov and E.M.Lifshitz, Adv.Phys. 31 (1982) 639. * [5] G. Montani, M. V. Battisti, R. Benini and G. Imponente, Int.J.Mod.Phys.A 23 (2008) 2353; J. M. Heinzle and C. Uggla, arXiv:0901.0776. * [6] S.Coleman and E.Weinberg, Phys.Rev.D 7 (1973) 1888; A.A.Kirillov and G.Montani, Phys.Rev.D 66 (2002) 064010. * [7] E.W.Kolb and M.S.Turner, The Early Universe, (Adison-Wesley Reading, 1990). * [8] M.Henneaux and C.Teitelboim, Quantization of Gauge Systems (PUP, Princeton, 1992). * [9] H.R.Lewis, J.Math.Phys. 9 (1968) 1976; H.R.Lewis and W.B.Riesenfeld, it J.Math.Phys. 10 (1969) 1458. * [10] V.Moncrief and M.P.Ryan, Phys.Rev.D 44 (1991) 2375; N.Pinto-Neto, A.F.Velasco and R.Colistete, Phys.Lett.A 277 (2000) 194; W.A.Wright and I.G.Moss, Phys.Lett.B 154 (1985) 115.
arxiv-papers
2009-03-23T11:31:48
2024-09-04T02:49:01.363890
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Marco Valerio Battisti, Riccardo Belvedere and Giovanni Montani", "submitter": "Marco Valerio Battisti", "url": "https://arxiv.org/abs/0903.3837" }
0903.3852
# Accelerating numerical solution of Stochastic Differential Equations with CUDA M. Januszewski, M. Kostur Institute of Physics, University of Silesia, 40-007 Katowice, Poland ###### Abstract Numerical integration of stochastic differential equations is commonly used in many branches of science. In this paper we present how to accelerate this kind of numerical calculations with popular NVIDIA Graphics Processing Units using the CUDA programming environment. We address general aspects of numerical programming on stream processors and illustrate them by two examples: the noisy phase dynamics in a Josephson junction and the noisy Kuramoto model. In presented cases the measured speedup can be as high as $675\times$ compared to a typical CPU, which corresponds to several billion integration steps per second. This means that calculations which took weeks can now be completed in less than one hour. This brings stochastic simulation to a completely new level, opening for research a whole new range of problems which can now be solved interactively. ###### keywords: Josephson junction, Kuramoto, graphics processing unit, advanced computer architecture, numerical integration, diffusion, stochastic differential equation, CUDA, Tesla, NVIDIA ## 1 Introduction The numerical integration of stochastic differential equations (SDEs) is a valuable tool for analysis of a vast diversity of problems in physics, ranging from equilibrium transport in molecular motors [1], phase dynamics in Josephson junctions [2, 3], stochastic resonance [4] to dissipative particle dynamics [5] to finance [6]. Stochastic simulation, as it is referred to as, is specially interesting when the dimensionality of the problem is larger than three, and in that case it is often the only effective numerical method. A prominent example of this is the stochastic variation of molecular dynamics: Brownian dynamics. Direct stochastic simulations require a significant computational effort, and therefore merely a decade ago have been used mostly as validation tools. The precise numerical results in theory of low-dimensional stochastic problems were coming from solutions of the corresponding Fokker-Planck equations. Many different sophisticated, but often complicated, tools have been applied: spectral methods [7, 8, 9], finite element methods [10] and numerical path integrals [11, 12]. Stochastic simulation gained acceptance due to its straightforward implementation and generic robustness with respect to different sorts of problems. The continuous increase of the efficiency of available computer hardware has been acting in favour of stochastic simulation, making it increasingly more popular. The recent evolution of computer architectures towards multiprocessor and multicore platforms also resulted in improved performance of stochastic simulation. Let us note that in the case of a low- dimensional system, stochastic simulation often uses ensemble averaging to obtain the values of observables, which in turn is an example of a so-called ,,embarrassingly parallel problem” and it can, though with embarrassment, directly benefit from a parallel architecture. In other cases, mostly where a large number of interacting subsystems are investigated, the implementation of the problem on a parallel architecture is less trivial, but still possible. The recent emergence of techniques collectively known as general-purpose computing on graphics processing units (GPUs) has caused a breakthrough in computational science. The current state of the art GPUs are now capable of performing computations at a rate of about 1 TFLOPS per single silicon chip. It must be stressed that 1 TFLOPS is a performance level which only in 1996 was achievable exclusively by huge and expensive supercomputers such as the ASCI Red Supercomputer (which had a peak performance of $1.8$ TFLOPS [13]) The numerical simulations of SDEs can easily benefit from the parallel GPU architecture. This however requires careful redesign of the employed algorithms and in general cannot be done automatically. In this paper we present a practical introduction to solving SDEs on NVIDIA GPUs using Compute Unified Device Architecture (CUDA) [14] based on two examples: the model of phase diffusion in a Josephson junction and the Kuramoto model of coupled phase oscillators. The paper is organized as follows: first, we briefly introduce the features and capabilities of the NVIDIA CUDA environment and describe the two physical models, then we present the implementation of stochastic algorithms and compare their efficiency with a corresponding pure-CPU implementation executed on an Intel Core2 Duo E6750 processor. We also provide the source code [15] of three small example programs: PROG1, PROG2, and PROG3, which demonstrate the techniques described in the paper. They can easily be extended to a broad range of problems involving stochastic differential equations. ## 2 The CUDA environment Figure 1: A schematic view of a CUDA streaming multiprocessor with 8 scalar processor cores. CUDA (Compute Unified Device Architecture) is the name of a general purpose parallel computing architecture of modern NVIDIA GPUs. The name _CUDA_ is commonly used in a wider context to refer to not only the hardware architecture of the GPU, but also to the software components used to program that hardware. In this sense, the CUDA environment also includes the NVIDIA CUDA compiler and the system drivers and libraries for the graphics adapter. From the hardware standpoint, CUDA is implemented by organizing the GPU around the concept of a streaming multiprocessor (SM). A modern NVIDIA GPU contains tens of multiprocessors. A multiprocessor consists of 8 scalar processors (SPs), each capable of executing an independent thread (see Fig. 1). The multiprocessors have four types of on-chip memory: * 1. a set of 32-bit registers (local, one set per scalar processor) * 2. a limited amount of shared memory (16 kB for devices having Compute Capability 1.3 or lower, shared between all SPs in a MP) * 3. a constant cache (shared between SPs, read-only) * 4. a texture cache (shared between SPs, read-only) The amount of on-chip memory is very limited in comparison to the total global memory available on a graphics device (a few kilobytes vs hundreds of megabytes). Its advantage lies in the access time, which is two orders of magnitude lower than the global memory access time. The CUDA programming model is based upon the concept of a _kernel_. A kernel is a function that is executed multiple times in parallel, each instance running in a separate thread. The threads are organized into one-, two- or three-dimensional blocks, which in turn are organized into one- or two- dimensional grids. The blocks are completely independent of each other and can be executed in any order. Threads within a block however are guaranteed to be run on a single multiprocessor. This makes it possible for them to synchronize and share information efficiently using the on-chip memory of the SM. In a device having Compute Capability 1.2 or higher, each multiprocessor is capable of concurrently executing 1024 active threads [16]. In practice, the number of concurrent threads per SM is also limited by the amount of shared memory and it thus often does not reach the maximum allowed value. The CUDA environment also includes a software stack. For CUDA v2.1, it consists of a hardware driver, system libraries implementing the CUDA API, a CUDA C compiler and two higher level mathematical libraries (CUBLAS and CUFFT). CUDA C is a simple extension of the C programming language, which includes several new keywords and expressions that make it possible to distinguish between host (i.e. CPU) and GPU functions and data. ## 3 Specific models In this work, we study the numerical solution of stochastic differential equations modeling the dynamics of Brownian particles. The two models we concentrate upon are of particular interest in many disciplines and illustrate the flexibility of the employed methods of solution. The first model describes a single Brownian particle moving in a symmetric periodic potential $V(x)=\sin(2\pi x)$ under the influence of a constant bias force $f$ and a periodic unbiased driving with amplitude $a$ and frequency $\omega$: $\ddot{x}+\gamma\dot{x}=-V^{\prime}(x)+a\cos(\omega t)+f+\sqrt{2\gamma k_{B}T}\xi(t)$ (1) where $\gamma$ is the friction coefficient and $\xi(t)$ is a zero-mean Gaussian white noise with the auto-correlation function $\langle\xi(t)\xi(s)\rangle=\delta(t-s)$ and noise intensity $k_{B}T$. Equation 1 is known as the Stewart-McCumber model [3] describing phase differences across a Josephson junction. It can also model a rotating dipole in an external field, a superionic conductor or a charge density wave. It is particularly interesting since it exhibits a wide range of behaviors, including chaotic, periodic and quasi-periodic motion, as well as the recently detected phenomenon of absolute negative mobility [17, 18]. The second model we analyze is that of $N$ globally interacting overdamped Brownian particles, with the dynamics of the $i$-th particle described by: $\displaystyle\gamma\dot{x_{i}}=\omega_{i}+\sum_{j=1}^{N}K_{ij}\sin(x_{j}-x_{i})+$ $\displaystyle\sqrt{2\gamma k_{B}T}\xi_{i}(t),i=1,\ldots,N$ (2) This model is known as the Kuramoto model [19] and is used as a simple paradigm for synchronization phenomena. It has found applications in many areas of science, including neural networks, Josephson junction and laser arrays, charge density waves and chemical oscillators. ## 4 Numerical solution of SDEs Most stochastic differential equations of practical interest cannot be solved analytically, and thus direct numerical methods have to be used to obtain the solutions. Similarly as in the case of ordinary differential equations, there is an abundance of methods and algorithms for solving stochastic differential equations. Their detailed description can be found in references: [20, 21, 22, 23, 24, 25]. Here, we present the implementation of a standard stochastic algorithm on the CUDA architecture in three distinctive cases: 1. 1. Multiple realizations of a system are simulated, and an ensemble average is performed to calculate quantities of interest. The large degree of parallelism inherent in the problem makes it possible to fully exploit the computational power of CUDA devices with tens of multiprocessors capable of executing hundreds of threads simultaneously. The example system models the stochastic phase dynamics in a Josephson junction and is implemented in program PROG1 (the source code is available in [15]). 2. 2. The system consists of $N$ globally interacting particles. In each time step $N^{2}$ interaction terms are calculated. The example algorithm is named PROG2 and solves the Kuramoto model (Eq. 3.) 3. 3. The system consists of $N$ globally interacting particles as in the previous case but the interaction can be expressed in terms of a parallel reduction operation, which is much more efficient than PROG2. The example algorithm in PROG3 also solves the Kuramoto model (Eq. 3.) We will now outline the general patterns used in the solutions of all models. We start with the model of a single Brownian particle, which will form a basis upon which the solution of the more general model of $N$ globally interacting particles will be based. ### 4.1 Ensemble of non-interacting stochastic systems Algorithm 1 A CUDA kernel to advance a Brownian particle by $m\cdot\Delta t$ in time. 1: local $i\leftarrow blockIdx.x\cdot blockDim.x+threadIdx.x$ 2: load $x_{i}$, $v_{i}$ and system parameters $\\{par_{ji}\\}$ from global memory and store them in local variables 3: load the RNG seed $seed_{i}$ and store it in a local variable 4: for $s=1$ to $m$ do 5: generate two uniform variates $n_{1}$ and $n_{2}$ 6: transform $n_{1}$ and $n_{2}$ into two Gaussian variates 7: advance $x_{i}$ and $v_{i}$ by $\Delta t$ using the SRK2 algorithm 8: local $t\leftarrow t_{0}+s\cdot\Delta t$ 9: end for 10: save $x_{i}$, $v_{i}$ and $seed_{i}$ back to global memory Algorithm 2 The Stochastic Runge-Kutta algorithm of the 2nd order (SRK2) to integrate $\dot{x}=f(x)+\xi(t)$, $\langle\xi(t)\rangle=0$, $\langle\xi(t)\xi(s)\rangle=2D\delta(t-s)$. 1: $F_{1}\leftarrow f(x_{0})$ 2: $F_{2}\leftarrow f(x_{0}+\Delta tF_{1}+\sqrt{2D\Delta t}\psi$) {with $\langle\psi\rangle=0$, $\langle\psi^{2}\rangle=1$} 3: $x(\Delta t)\leftarrow x_{0}+\frac{1}{2}\Delta t(F_{1}+F_{2})\sqrt{2D\Delta t}\psi$ For the Josephson junction model described by Eq. 1 we use a single CUDA kernel, which is responsible for advancing the system by a predefined number of timesteps of size $\Delta t$. We employ fine-grained parallelism – each path is calculated in a separate thread. For CUDA devices, it makes sense to keep the number of threads as large as possible. This enables the CUDA scheduler to better utilize the available computational power by executing threads when other ones are waiting for global memory transfers to be completed [16]. It also ensures that the code will execute efficiently on new GPUs, which, by the Moore’s law, are expected to be capable of simultaneously executing exponentially larger numbers of threads. We have found that calculating $10^{5}$ independent realizations is enough to obtain a satisfactory level of convergence and that further increases of the number of paths do not yield better results (see Fig. 5). In order to increase the number of threads, we structured our code so that Eq. 1 is solved for multiple values of the system parameters in a single run. The default setup calculates trajectories for $100$ values of the amplitude parameter $a$. This makes it possible to use our code to efficiently analyze the behavior of the system for whole regions of the parameter space $\\{a,\omega,\gamma\\}$. Multiple timesteps are calculated in a single kernel invocation to increase the efficiency of the code. We observe that usually only samples taken every $M$ steps are interesting to the researcher running the simulation, the sampling frequency $M$ being chosen so that the relevant information about the analyzed system is retained. In all following examples $M=100$ is used. It should be noted that the results of the intermediate steps do not need to be copied to the host (CPU) memory. This makes it possible to limit the number of global memory accesses in the CUDA threads. When the kernel is launched, path parameters $x$, $v=\dot{x}$ and $a$ are loaded from the global memory and are cached in local variables. All calculations are then performed using these variables and at the end of the kernel execution, their values are written back to the global memory. Each path is associated with its own state of the random number generator (RNG), which guarantees independence of the noise terms between different threads. The initial RNG seeds for each thread are chosen randomly using a standard integer random generator available on the host system. Since CUDA does not provide any random number generation routines by default, we implemented a simple xor-shift RNG as a CUDA device function. In our kernel, two uniform variates are generated per time step and then transformed into Gaussian variates using the Box-Muller transform. The integration is performed using a Stochastic Runge-Kutta scheme of the 2nd order, which uses both Gaussian variates for a single time step. Figure 2: The ensemble of $524288$ Brownian particles, modeling the noisy dynamics of phase in a Josephson junction described by Eq. 1 is simulated for time $t\in(0,2000\frac{2\pi}{\omega})$ with time step $\Delta t=0.01\frac{2\pi}{\omega}$. On the left panel sample trajectories are drawn with black lines and the background colors represent the coarse-grained (averaged over a potential period) density of particles in the whole ensemble. The right panel shows the coarse-grained probability distribution of finding a particle at time $t=2000\frac{2\pi}{\omega}$ obtained by means of a histogram with $200$ bins. The histogram is calculated with both single and double precision on a GPU with Compute Capability v1.3. The same calculation has also been performed on the CPU but their identical results are not presented for clarity purposes. The total simulation times were: 20 seconds and 13 minutes on NVIDIA Tesla 1060C when using single and double precision floating-point arithmetics, respectively. The CPU-based version of the same algorithm needed over three hours. Used parameters: $a=4.2$, $\gamma=0.9$, $\omega=4.9$, $D_{0}=0.001$, $f=0.1$ correspond to the anomalous response regime (cf. [17]). In the example in Fig. 2 we present the results coming from the simultaneous solution of $N=2^{19}=524288$ independent Eqs. 1 for the same set of parameters. The total simulation time was less than $20$ seconds. In this case the CUDA platform turns out to be extremely effective, outperforming the CPU by a factor of $675$. In order to highlight the amount of computation, let us note that the size of the intermediate file with all particle positions used for generation of the background plot was about $30$ GB. ### 4.2 $N$ globally interacting stochastic systems Algorithm 3 The AdvanceSystem CUDA kernel. 1: local $i\leftarrow blockIdx.x\cdot blockDim.x+threadIdx.x$ 2: local $mv\leftarrow 0$ 3: local $mx\leftarrow x_{i}$ 4: for all tiles do 5: local $tix\leftarrow threadIdx.x$ 6: $j\leftarrow tile\cdot blockDim.x+threadIdx.x$ 7: shared $sx_{tix}\leftarrow x_{j}$ 8: synchronize with other threads in the block 9: for $k=1$ to $blockDim.x$ do 10: $mv\leftarrow mv+\sin(mx-sx_{k})$ 11: end for 12: synchronize with other threads in the block 13: end for 14: $v_{i}\leftarrow mv$ Figure 3: All-pairs interaction of 12 particles calculated using the tile- based approach with 9 tiles of size 4x4. The chosen number of particles and the size of the tiles are made artificially low for illustration purposes only. A small square represents the computation of a single particle-particle interaction term. The highlighted part of the schematic depicts a single tile. The bold lines represent synchronization points where data is loaded into the shared memory of the block. The filled squares with circles represent the start of computation for a new tile. Threads in the red box are executed within a single block. For the general Kuramoto model described by Eqs. 3 or other stochastic systems of $N$ interacting particles, the calculation of $\mathcal{O}(N^{2})$ interaction terms for all pairs $(x_{j},x_{i})$ is necessary in each integration step. In this case the program PROG2 is split into two parts, implemented as two CUDA kernels launched sequentially. The first kernel, called UpdateRHS calculates the right hand side of Eq. 3 for every $i$. The second kernel AdvanceSystem actually advances the system by a single step $\Delta t$ and updates the positions of all particles. In our implementation the second kernel uses a simple first-order Euler scheme. It is straightforward to modify the program to implement higher-order schemes by interleaving calls to the UpdateRHS kernel with calls to kernels implementing the sub-steps of the scheme. The UpdateRHS kernel is organized around the concept of _tiles_ , introduced in [26]. A tile is a group of $T$ particles interacting with another group of $T$ particles. Threads are executed in blocks of size $T$ and each block is always processing a single tile. There is a total of $N/T$ blocks in the grid. The $i$-th thread computes the interaction of the $i$-th particle with all other particles. The execution proceeds as follows. The $i$-th thread loads the position of the $i$-th particle and caches it as a local variable. It then loads the position of another particle from the current tile, stores it in shared memory and synchronizes with other threads in the block. When this part is completed, the positions of all particles from the current tile are cached in the shared memory. The computation of the interaction is then commenced, with the $i$-th thread computing the interaction of the $i$-th particle with all particles from the current tile. Afterwards, the kernel advances to the following tile, the positions stored in shared memory are replaced with new ones, and the whole process repeats. This approach might seem wasteful since it computes exactly $N^{2}$ interaction terms, while only $(N-1)N/2$ are really necessary for a symmetric interaction. It is however very efficient, as it minimizes global memory transfers at the cost of an increased number of interaction term computations. This turns out to be a good trade-off in the CUDA environment, as global memory accesses are by far the most costly operations, taking several hundred clock cycles to complete. Numerical computations are comparatively cheap, usually amounting to just a few clock cycles. Figure 4: An example result of the integration of the Kuramoto system (Eq. 3). The time evolution of the probability density $P(x;t)$ is shown for $\omega_{i}=0$, $K_{ij}=4$, $T=1$. The density is a position histogram of $2^{24}$ particles. The total time of simulation was approximately $20$ seconds using the single precision capabilities of NVIDIA Tesla C1060. The special form of the interaction term in the Kuramoto model when $K_{ij}=K=\mathrm{const}$, allows us to significantly simplify the calculations. Using the identity: $\displaystyle\sum_{j=1}^{N}\sin(x_{j}-x_{i})=$ $\displaystyle\cos(x_{i})\sum_{j=1}^{N}\sin(x_{j})-\sin(x_{i})\sum_{j=1}^{N}\cos(x_{j})$ (3) we can compute two sums: $\sum_{j=1}^{N}\sin(x_{j})$ and $\sum_{j=1}^{N}\cos(x_{j})$ only once per integration step, which has a computational cost of $\mathcal{O}(N)$. The calculation of the sum of a vector of elements is an example of the vector reduction operation, which can be performed very efficiently on the CUDA architecture. Various methods of implementation of such an operation are presented in the sample code included in the CUDA SDK 2.1 [27]. The integration of the Kuramoto system taking advantage of Eq. 4.2 and using a simple form of a parallel reduction is implemented in PROG3. In Fig. 4 we present a solution of the classical Kuramoto system described by Eqs. 3 for parameters as in Fig. 10 of the review paper [19]. In this case we apply the program PROG3 which makes use of the relation from Eq. 4.2. The number of particles $N=2^{24}\approx 16.8\cdot 10^{6}$ and the short simulation time clearly demonstrate the power of the GPU for this kind of problems. ## 5 Note on single precision arithmetics The fact that the current generation of CUDA devices only implements single precision operations in an efficient way is often considered a significant limitation for numerical calculations. We have found out that for the considered models this does not pose a problem. Figure 2 presents sample paths and position distribution functions of a Brownian particle whose dynamics is determined by Eq. 1 (colored background on the left panel and right panel). Let us note that we present coarse-grained distribution functions where the position is averaged over a potential period by taking a histogram with bin size being exactly equal to the potential period. We observe that the use of single precision floating-point numbers does not significantly impact the obtained results. Results obtained by single precision calculations even after a relatively long time $t=2000\frac{2\pi}{\omega}$ differ from their double precision counterparts only up to the statistical error, which in this case can be estimated by the fluctuations of the relative particle number in a single histogram bin. Since in the right panel of Fig. 2 we have approximately $10^{4}$ particles in one bin, the error is of the order of $1\%$. If time- averaged quantities such as the asymptotic velocity $\langle\langle v\rangle\rangle=\lim_{t\to\infty}\langle v(t)\rangle$ are calculated, the differences are even less pronounced. However, the single and double precision programs produce different individual trajectories as a direct consequence of the chaotic nature of the system given by Eq. 1. Moreover, we have noticed that even when changing between GPU and CPU versions of the same program, the individual trajectories diverged after some time. The difference between paths calculated on the CPU and the GPU, using the same precision level, can be explained by differences in the floating-point implementation, both in the hardware and in the compilers. When doing single precision calculations special care must be taken to ensure that numerical errors are not needlessly introduced into the calculations. If one is used to having all variables defined as double precision floating-point numbers, as is very often the case on a CPU, it is easy to forget that operations which work just fine on double precision numbers might fail when single precision numbers are used instead. For instance, consider the case of keeping track of time in a simulation by naively increasing the value of a variable $t$ by a constant $\Delta t$ after every step. By doing so, one is bound to hit a problem when $t$ becomes large enough, in which case $t$ will not change its value after the addition of a small value $\Delta t$, and the simulation will be stuck at a single point in time. With double precision numbers this issue becomes evident when there is a difference of 17 orders of magnitude between $t$ and $\Delta t$. With single precision numbers, a 8-orders-of-magnitude difference is enough to trigger the problem. It means that if, for instance, $t$ is $10^{5}$ and $\Delta t$ is $10^{-4}$, the addition will no longer work as expected. $10^{5}$ and $10^{-4}$ are values not uncommon in simulations of the type we describe here, hence the need for extra care and reformulation of some of the calculations so that very large and very small quantities are not used at the same time. In our implementations, we avoided the problem of spurious addition invariants by keeping track of simulation time modulo the system period $2\pi/\omega$. This way, the difference between $t$ and $\Delta t$ was never large enough to cause any issues. ## 6 Performance evaluation In order to evaluate the performance of our numerical solution of Eqs. 1 and 3, we first implemented Algs. 3 and 1 using the CUDA Toolkit v2.1. We then translated the CUDA code into C++ code by replacing all kernel invocations with loops and removing unnecessary elements (such as references to shared memory, which does not exist on a CPU). We used the NVIDIA CUDA Compiler (NVCC) and GCC 4.3.2 to compile the CUDA code and the Intel C++ Compiler (ICC) v11.0 for Linux to compile the C++ version. We have determined through numerical experiments that enabling floating-point optimizations significantly improves the performance of our programs (by a factor of $7$ on CUDA) and does not affect the results in a quantitative or qualitative way. We have therefore used the -fast -fp-model fast=2 ICC options and \--use_fast_math in the case of NVCC. Figure 5: (Left panel) Performance estimate for the programs _PROG1_ -_PROG3_ as a function of the number of particles $N$. (Right panel) Performance estimate for the programs _PROG1_ -_PROG3_ on an Intel Core2 Duo E6750 CPU and NVIDIA Tesla C1060 GPU. We have counted $79$, $44+6N$ and $66$ operations per one integration step of programs _PROG1_ , _PROG2_ and _PROG3_ , respectively. All tests were conducted on recent GNU/Linux systems using the following hardware: * 1. for the CPU version: Intel Core2 Duo E6750 @ 2.66GHz and 2 GB RAM (only a single core was used for the calculations) * 2. for the GPU version: NVIDIA Tesla C1060 installed in a system with Intel Core2 Duo CPU E2160 @ 1.80GHz and 2 GB RAM Our tests indicate that speedups of the order of 600 and 100 are possible for the models described by Eqs. 1 and 3, respectively. The performance gain is dependent on the number of paths used in the simulation. Figure 5 shows that it increases monotonically with the number of paths, and then saturates at a number dependent on the used model: $450$ and $106$ GFLOPS for the Eqs. 1 and 3, respectively (which corresponds to speedups: $675$ and $106$). The saturation point indicates that for the corresponding number of particles the full computational resources of the GPU are being exploited. The problem of lower performance gain for small numbers of particles could be rectified by dividing the computational work between threads in a different way, i.e. by decreasing the amount of calculations done in a single thread, while increasing the total number of threads. This is a relatively straightforward thing to do, but it increases the complexity of the code. We decided not to do it since for models like 1 and 3 one is usually interested in calculating observables for whole ranges of system parameters. Instead of modifying the code to run faster for lower number of paths, one can keep the number of paths low but run the simulation for multiple system parameters simultaneously, which results in a higher number of threads. ## 7 Conclusions In this paper we have demonstrated the suitability of a parallel CUDA-based hardware platform for solving stochastic differential equations. The observed speedups, compared to CPU versions, reached an astonishing value $670$ for non-interacting particles and $120$ for a globally coupled system. We have also shown that for this kind of calculations single precision arithmetics poses no problems with respect to accuracy of the results, provided that some kind of operations, such as adding small and large numbers, are avoided. The availability of cheap computer hardware which is over two orders of magnitude faster clearly announces a new chapter in high performance computing. Let us note that the development of stream processing technology for general-purpose computing has just started and its potential is surely not yet fully revealed. In order to take advantage of the new hardware architecture, the software and its algorithms must be substantially redesigned. ## 8 Appendix: Estimation of FLOPS We counted the floating-point operations performed by the kernels in our code, and the results in the form of the collective numbers of elementary operations are presented in Table 1. The number of MAD (Multiply and Add) operations can vary, depending on how the compiler processes the source code. For the purposes of our performance estimation, we assumed the most optimistic version. A more conservative approach would result in a lower number of MADs, and correspondingly a higher total number of GFLOPS. Table 1: Number of elementary floating-point operations performed per one time step in the AdvanceSystem kernel for Eq. 1. count | type | FLOPs | total FLOPs ---|---|---|--- 22 | multiply, add | 1 | 22 11 | MAD | 1 | 11 2 | division | 4 | 8 3 | sqrt | 4 | 12 1 | $\sin$ | 4 | 4 5 | $\cos$ | 4 | 20 1 | $\log$ | 2 | 2 TOTAL: | 79 The amount of FLOPs for functions such as sin, log, etc. is based on [16], assuming $1$ FLOP for elementary arithmetical operations like addition and multiplication and scaling the FLOP estimate for complex functions proportionately to the number of processor cycles cited in the manual. The numbers of floating-point operations are summarized in Table 1. On a Tesla C1060 device our code PROG1 evaluates $6.178\cdot 10^{9}$ time steps per second. The cost of each time step is $79$ FLOPs, which implies that the overall performance estimate accounts for $490$ GFLOPS. In the case of PROG2 the number of operations per one integration step depends on the number of particles $N$. A similar operation count as the one presented in Table 1 resulted in the formula $44+6N$ FLOPs per integration step. ## References * [1] Reimann, P., Physics Reports 361 (2002) 57 . * [2] Kostur, M., Machura, L., Talkner, P., Hänggi, P., and Łuczka, J., Physical Review B (Condensed Matter and Materials Physics) 77 (2008) 104509. * [3] Kautz, R. L., Reports on Progress in Physics 59 (1996) 935. * [4] Gammaitoni, L., Hänggi, P., Jung, P., and Marchesoni, F., Rev. Mod. Phys. 70 (1998) 223. * [5] Groot, R. and Warren, P., J. Chem. Phys. 107 (1997) 4423. * [6] McLeish, D. L., Monte Carlo Simulation and Finance, John Wiley and Sons, 2005. * [7] Bartussek, R., Reimann, P., and Hänggi, P., Phys. Rev. Lett. 76 (1996) 1166. * [8] Lindner, B., Schimansky-Geier, L., Reimann, P., Hänggi, P., and Nagaoka, M., Phys. Rev. E 59 (1999) 1417. * [9] Kalmykov, Y. P., Phys. Rev. E 61 (2000) 6320. * [10] Kostur, M., Internat. J. Modern Phys. C 13 (2002) 1157. * [11] Yu, J. and Lin, Y., Internat. J. Non-Linear Mech. 39 (2004) 1493. * [12] Naess, A., Dimentberg, M. F., and Gaidai, O., Physical Review E (Statistical, Nonlinear, and Soft Matter Physics) 78 (2008) 021126. * [13] http://www.computermuseum.li/testpage/asci-red-supercomputer.htm. * [14] Nvidia cuda webpage, http://www.nvidia.com/object/cuda_home.html. * [15] Source code of all examples can be found on http://fizyka.us.edu.pl/cuda. * [16] Corporation, N., Nvidia cuda programming guide v2.1, available from nvidia cuda webpage, http://www.nvidia.com/object/cuda_home.html, 2008. * [17] Machura, L., Kostur, M., Talkner, P., Łuczka, J., and Hänggi, P., Physical Review Letters 98 (2007) 040601. * [18] Speer, D., Eichhorn, R., and Reimann, P., EPL (Europhysics Letters) 79 (2007) 10005 (5pp). * [19] Acebron, J. A., Bonilla, L. L., Vicente, C. J. P., Ritort, F., and Spigler, R., Reviews of Modern Physics 77 (2005) 137. * [20] Mannella, R. and Palleschi, V., Phys. Rev. A 40 (1989) 3381. * [21] Mannella, R., Internat. J. Modern Phys. C 13 (2002) 1177. * [22] Sancho, J. M., Miguel, M. S., Katz, S. L., and Gunton, J. D., Phys. Rev. A 26 (1982) 1589. * [23] Fox, R. F., Gatland, I. R., Roy, R., and Vemuri, G., Phys. Rev. A 38 (1988) 5938. * [24] Honeycutt, R. L., Phys. Rev. A 45 (1992) 600. * [25] Kloeden, P. E. and Platen, E., Numerical Solution of Stochastic Differential Equations (Stochastic Modelling and Applied Probability), Springer, 2000. * [26] L. Nyland, M. Harris, J. P., GPU Gems 3 - Fast N-body simulation with CUDA, chapter 31, pages 677–695, Addison-Wesley Professional, 2007. * [27] Nvidia cuda software development kit, available from nvidia cuda webpage, http://www.nvidia.com/object/cuda_home.html.
arxiv-papers
2009-03-23T14:13:12
2024-09-04T02:49:01.369693
{ "license": "Public Domain", "authors": "M. Januszewski, M. Kostur (University of Silesia, Katowice, Poland)", "submitter": "Marcin Kostur dr", "url": "https://arxiv.org/abs/0903.3852" }
0903.4080
# A Review of Nucleon Spin Calculations in Lattice QCD Huey-Wen Lin ###### Abstract We review recent progress on lattice calculations of nucleon spin structure, including the parton distribution functions, form factors, generalization parton distributions, and recent developments in lattice techniques. ###### Keywords: Lattice QCD, nucleon spin structures, form factors, GPDs ###### : 12.38.-t 12.38.Gc 13.40.Gp 14.20.Dh 13.60.Fz ## 1 Introduction Quantum chromodynamics (QCD) has been successful in describing many properties of the strong interaction. In the weak-coupling regime, we can rely on perturbation theory to work out the path integral which describes physical observables of interest. However, for long distances perturbative QCD no longer converges. Instead, we use a discretization of space and time in a finite volume to calculate these quantities from first principles numerically; such research forms the regime of lattice QCDDeGrand and Detar (2006). To keep the systematic error due to discretization under control, one follows Symanzik improvement order by order in terms of the ultraviolet cutoff ($a$) for both the action and operators. However, the breaking of continuous (Euclidean) SO(4) symmetry allows many new degrees of freedom, leading to various lattice actions that return to the same continuum action once the symmetry is restored. Thus, there exist many gauge and fermion actions for us to choose from. Today, most gauge actions used are $O(a^{2})$-improved and leave small discretization effects ($O(a^{3}\Lambda_{\rm QCD}^{3})$) due to gauge choices. On the other hand, most fermion actions are only $O(a)$-improved and have systematic errors of $O(a^{2}\Lambda_{\rm QCD}^{2})$ that become dominant. For this reason, lattice calculations are generally distinguished according to the fermion action used. Differences among the actions are benign once all systematics are included, and the choice of fermion action is constrained by limits of computational and human power and by the main physics focus. The commonly used actions are: domain-wall fermions (DWF), overlap fermions, Wilson/clover fermions, twisted-Wilson fermions and staggered fermions. Since the real world is effectively continuous and infinitely large, we will have to take limits of $a\rightarrow 0$ and $V\rightarrow\infty$ to eliminate the artifacts introduced in a discretized finite box. With the most state-of- the-art supercomputer, we are close but yet to simulate at the physical pion mass. Using calculations at multiple heavier pion masses, which are affordable for available computational resources, we can apply chiral perturbation theory to extrapolate quantities of interest to the physical limit. A recent work by the BMW collaborationDurr et al. (2008) calculating multiple lattice spacings, volumes and pion masses as light as 180 MeV provided an excellent demonstration of how ground-state hadron masses with fully understood and controlled systematics are consistent with experiment. Such calculations with multiple pion masses also help to determine the low-energy constants of chiral effective theory. A typical nucleon interpolating field used in the lattice calculation is $\chi_{N}=\sum_{\vec{x},a,b,c}e^{i\vec{p}\cdot\vec{x}}\epsilon^{abc}\left[u_{a}^{T}C\gamma_{5}d_{b}\right]u_{c},$ and the nucleon two- and three-point Green functions are obtained from $\displaystyle\Gamma^{(2)}(t_{\rm src},t)$ $\displaystyle=$ $\displaystyle\langle\chi_{N}(t)\chi_{N}^{\dagger}(t_{\rm src})\rangle$ (1) $\displaystyle\Gamma^{(3)}(t_{\rm src},t,t_{\rm snk})$ $\displaystyle=$ $\displaystyle\langle\chi_{N}(t_{\rm snk},\vec{p}_{\rm snk})\,{\cal O}(t,\vec{q})\,\chi^{\dagger}_{N}(t_{\rm src},\vec{p}_{\rm src})\rangle,$ (2) where ${\cal O}$ is the operator of interest. For the vector (axial) current, the operator is ${\cal O}=\overline{\psi}\gamma_{\mu}(\gamma_{5})\psi$. For the structure functions, the operators are $\langle x^{n}\rangle_{q}$: | ${\cal O}_{\mu_{1}...\mu_{n}}^{q}$ | = | $i^{n-1}\overline{\psi}\gamma_{\\{\mu_{1}}\overleftrightarrow{D}_{\mu_{2}}\cdots\overleftrightarrow{D}_{\mu_{n}\\}}\psi$ ---|---|---|--- $\langle x^{n}\rangle_{\Delta q}$: | ${\cal O}_{\mu_{1}...\mu_{n}}^{5q}$ | = | $i^{n-1}\overline{\psi}\gamma_{\\{\mu_{1}}\gamma_{5}\overleftrightarrow{D}_{\mu_{2}}\cdots\overleftrightarrow{D}_{\mu_{n}\\}}\psi$ $\langle x^{n}\rangle_{\delta q}$: | ${\cal O}_{\mu\mu_{1}...\mu_{n}}^{\sigma q}$ | = | $i^{n-1}\overline{\psi}\gamma_{5}\sigma_{\mu\\{\mu_{1}}\overleftrightarrow{D}_{\mu_{2}}\cdots\overleftrightarrow{D}_{\mu_{n}\\}}\psi$, where $\overleftrightarrow{D}=\frac{1}{2}(\overrightarrow{D}-\overleftarrow{D})$ is the difference between forward and backward covariant derivatives. We calculate only the “connected” diagrams, which means the inserted quark current is contracted with the valence quarks in the baryon interpolating fields, as in the majority of lattice three-point calculations. However, due to isospin symmetry, isovector quantities have a cancellation that removes the unknown disconnected piece. (Disconnected diagrams are notoriously difficult to calculate directly on the lattice. They require that expensive fermion- matrix inversion be applied to numerous source vectors. Much effort has been devoted to solving this difficulty in the near future with new techniques.) For more details, please refer to a selection of plenary talks: Refs. plenary (2008) and references within. ## 2 Lattice QCD Reveals the Structure of the Nucleon The nucleon axial charge is well measured in neutron $\beta$-decay experiments, so it is a natural candidate for demonstrating how well lattice QCD can be extrapolated to the physical pion point. The isovector axial charges $g_{A}$ are defined as the zero-momentum-transfer limits of the isovector axial form factors. Results from various collaborations are shown on the left-hand side of Figure 1. We show a small-scale–expansion fit (gray band) to the 2+1-flavor (DWF sea quarks) RBC dataRBC (2008) (blue filled circles). The results are consistent with the LHPC dataLHPC (2006) (DWF valence with staggered sea); RBC’s 2f and 0f results are consistent with QCDSF’s 2f Clover and 0f overlap fermion numbersQCDSF (2006) respectively. The lowest–pion-mass values among RBC’s 2+1f and 2f results may suffer from sizable finite-volume systematic errors; larger-volume calculations should be carried out to confirm these suspicions. Figure 1: (left) Renormalized axial charge versus pseudoscalar mass squared from various lattice groups. (right) Zeroth moment of transversity from different lattice groups. The bands in both plots are chiral extrapolations fit to the RBC 2+1f data. Results for the zeroth moment of transversity $\langle 1\rangle_{\delta q}$ are given on the right-hand side of Figure 1. We observe rather weak dependence (roughly linear) on the quark mass, which remains consistent for calculations with the same number of sea-quark flavors. The chiral extrapolation formxChPT (2002) is applied to the RBC 2+1f dataRBC (2008), yielding 0.56(4) at the physical pion mass. However, this is close to what has been found by LHPC with mixed actionLHPC (2006): about 0.7. These extrapolated values are significantly smaller than those found at the simulated pion masses, which are near 1. We urgently need data at the lightest pion mass to confirm the rapidly decreasing behavior predicted by the chiral effective theory. Figure 2 shows the latest calculations of the first moments of the quark momentum fraction (left) and helicity (right) distributions. Here again the 0f, 2f and 2+1f results are compared between different collaborations with different choices of fermion actions and are seen to be consistent among calculations with the same number of sea-quark flavors. The chiral extrapolationxChPT (2002) is performed using RBC’s 2+1f data, which gives 0.133(13) and 0.203(23) for the first moments of the quark momentum fraction and helicity distributions respectively, consistent with experiment. We see strong curvature due to the chiral form; more light-pion points should be taken to reduce extrapolation uncertainties. These extrapolation numbers are also consistent with the LHPC’s mixed-action calculationLHPC (2006). Higher moments of the isovector distributions are calculated by LHPC (SCRI, SESAM) with 0f and 2f Wilson and clover fermionsLHPC (2006) and by QCDSF with 0f clover fermions at multiple lattice spacingsQCDSF (2006). Consistent results are seen among different groups: The second and third moments are about 25% and 10% of the first moments respectively. However, for moments with $n\geq 4$, divergences occur involving lower-dimension operators at finite $a$, which limits the number of moments accessible to lattice QCD. Figure 2: Global comparison of the first moments of the quark momentum fraction (left) and helicity (right) distributions in terms of $M_{\pi}^{2}$ and their chiral extrapolations. The bands in both plots are chiral extrapolations fit to the RBC 2+1f data. The twist-3 first moment of the polarized structure function $d_{n}$ is another interesting feature to consider. It is related to the polarized structure functions $g_{1}$ and $g_{2}$ and the Wandzura-Wilczek relationWandzura and Wilczek (1977). The lowest moment $d_{1}$ from RBC’s 2+1f data extrapolated to the physical pion mass is consistent with zero $d_{1}^{\rm bare}=-0.002(2)$. Combined with the small value of $d_{2}$ found by QCDSF’s 2f calculationQCDSF (2006), we conclude that the Wandzura-Wilczek relation between the moments of $g_{1}$ and $g_{2}$, which asserts vanishing $d_{n}$, is at least approximately true. Studying the momentum-transfer ($Q^{2}$) dependence of the elastic electromagnetic form factors is important in understanding the structure of hadrons at different scales. There have been many experimental studies of these form factors on the nucleon. A recent such experiment, the Jefferson Lab double-polarization experiment (with both a polarized target and longitudinally polarized beam) revealed a non-trivial momentum dependence for the ratio $G_{E}^{p}/G_{M}^{p}$. This contradicts results from the Rosenbluth separation method, which suggested $\mu_{p}G_{E}^{p}/G_{M}^{p}\approx 1$. The contradiction has been attributed to systematic errors due to two-photon exchange that contaminate the Rosenbluth separation method more than the double-polarization. (For details and further references, see the recent review articles: Refs. FFs (2008).) Lattice calculations can make valuable contributions to the study of nucleon form factors, since they allow access to both the pion-mass and momentum dependence of such form factors. Recently, the limitations of the largest-available $Q^{2}$ (in terms of the quality of the signal-to-noise ratios) has been overcomeLins (2008). An exploratory study using clover fermions extends the range of momentum transfer to 6 GeV2, as shown in Figure 3. The $Q^{2}$ dependence of the neutron has exceeded the range of the current existing data. Such calculations will provide interesting comparisons for data collected after the future 12-GeV upgrade at Jefferson Lab. Figure 3: Nucleon form factors with pion masses of 480 (triangles), 720 (circles) and 1080 (diamonds) MeV. The dashed lines are plotted using experimental form-factor fit parametersFFs (2008). The generalized parton distributions (GPDs) have been calculated by LHPC (2+1f mixed action, $M_{\pi}\sim 350$–760 MeV)LHPC (2006) and QCDSF (2f clover action, $M_{\pi}\sim 340$–950 MeV)QCDSF (2006). One of the main topics of physics interest derived from GPDs is to study the origins of the nucleon’s spin. The quark spin ($\Delta\Sigma^{q}$) and total quark contribution ($J^{q}$) to the angular momentum can be connected to GPDs viaJi (1997) $\frac{1}{2}\Delta\Sigma^{q}=\frac{1}{2}\tilde{A}^{q}_{10}(0);\;\;J^{q}=\frac{1}{2}[{A}^{q}_{20}(0)+{B}^{q}_{20}(0)],$ (3) where $\tilde{A}^{q}_{n0}$ and $\\{A,B\\}^{q}_{n0}$ are the polarized and unpolarized generalized form factors. The left-hand side of Figure 4 shows the quark spin and orbital angular momentum ($L^{q}$) calculated by LHPC and QCDSF; they are consistent. One found the total $d$ quark angular momentum and the angular momentum from the sum of $u$ and $d$ quarks to be consistent with zero. This is because $L^{d}$ and $L^{u}$ are of the same magnitude but have opposite signs. A similar relation holds for $\Delta\Sigma^{d}$ and $L^{d}$. Note that in both of the calculations only connected diagrams are included. For the transverse structure of the proton, QCDSF calculates the lowest two moments of the transverse spin densities of quarks in the nucleonQCDSF (2006). An exploratory attempt has been made to calculate transverse-momentum distributions (TMDs) using lattice link products to approximate the Wilson line in light-cone frame in spatial coordinates and Fourier transforming into momentum-space to map the density distributionsLHPC (2006); this calculation used 2+1f mixed action (DWF on staggered, $M_{\pi}\sim 500$ MeV). Another new development during the last year is progress on disconnected diagrams. An indirect way of calculating the strangeness form factors via charge symmetry in 2+1f lattices is shown on the right-hand side of Figure 4. The direct approach has also made great progress. For example, the strange- quark distribution $\langle x\rangle_{s}$ has been calculated by the $\chi$QCD collaboration on 2+1f latticeschiQCD (2008). The same group has also calculated the gluon momentum fraction $\langle x\rangle_{g}$ with improved signal. Figure 4: (left) The quark-component contributions to quark spin and orbital angular momentum in the spin of the nucleon from LHPC (squares, diamonds and upward triangles) and QCDSF (tilted squares and rightward triangles). The filled/open symbols represent dynamical/quenched data. The bands are chiral extrapolations based on LPHC’s dynamical data. (right) Experimental results (ellipses) and various theoretical calculations (points) of $G_{M}^{s}$-$G_{E}^{s}$ . This is an exciting era for the use of lattice QCD in nuclear physics: there have been huge leaps due to increasing computational resources worldwide and improved algorithms, allowing continual improvement in lighter pion masses, larger volumes and finer lattice spacings. Various groups have demonstrated universality with the consistent results coming from independent calculations using different lattice actions. By reproducing well measured experimental values, we solidify confidence in lattice predictions of quantities that have not or cannot be measured by experiment. There are many different aspects of hadron structure that one can do with lattice QCD; only a few examples have been presented here. In the near future, pion masses around 200 MeV or lighter with multiple volumes and lattice spacings will become commonplace. There will be less need to depend on chiral perturbation theory for extrapolations, and once the physical pion mass becomes accessible, we can check its correctness. Full- contraction calculations (including disconnected diagrams) in all matrix elements, form factors and GPDs will lead to precision calculations for individual quark components or individual proton and neutron quantities. Further improvements in methodology and expanding computational resources will allow direct calculations of the gluon content of the nucleon. The future is unlimited with lattice QCD. Acknowledgements: Authored by Jefferson Science Associates, LLC under U.S. DOE Contract No. DE-AC05-06OR23177. The U.S. Government retains a non-exclusive, paid-up, irrevocable, world-wide license to publish or reproduce this manuscript for U.S. Government purposes. ## References * DeGrand and Detar (2006) T. DeGrand, and C. E. Detar, new Jersey, USA: World Scientific (2006) 345 p. * Durr et al. (2008) S. Durr, et al., _Science_ 322, 1224–1227 (2008). * plenary (2008) J. M. Zanotti, _PoS_ LAT2008, 007 (2008); P. Hagler, _PoS_ LAT2007, 013 (2007); K. Orginos, _PoS_ LAT2006, 018 (2006); H.-W. Lin (2008), arXiv:0812.0411[hep-lat]. * xChPT (2002) W. Detmold et al., _Phys. Rev. Lett._ 87, 172001 (2001); D. Arndt et al., _Nucl. Phys._ A697, 429–439 (2002); J.-W. Chen et al., _Nucl. Phys._ A707, 452–468 (2002); W. Detmold et al., _Phys. Rev._ D66, 054501 (2002). * RBC (2008) H.-W. Lin (2007), 0707.3844; H.-W. Lin et al., _Phys. Rev._ D78, 014505 (2008); T. Yamazaki et al., _Phys. Rev. Lett._ 100, 171602 (2008); K. Orginos et al., _Phys. Rev._ D73, 094503 (2006). * LHPC (2006) R. G. Edwards et al., (2006), hep-lat/0610007; D. Dolgov et al., _Phys. Rev._ D66, 034506 (2002); P. Hagler, et al., _Phys. Rev._ D77, 094502 (2008); B. U. Musch, et al. (2008), 0811.1536. * QCDSF (2006) M. Ohtani, _PoS_ LAT2007, 158 (2007); M. Gockeler et al., _Phys. Rev._ D71, 114511 (2005); M. Gockeler et al., _Phys. Rev._ D63, 074506 (2001); M. Gockeler et al., _Phys. Rev. Lett._ 98, 222001 (2007). * Wandzura and Wilczek (1977) S. Wandzura, and F. Wilczek, _Phys. Lett._ B72, 195 (1977). * FFs (2008) J. Arrington et al., _Phys. Rev._ C76, 035205 (2007a); C. F. Perdrisat et al., _Prog. Part. Nucl. Phys._ 59, 694–764 (2007); J. Arrington et al., _J. Phys._ G34, S23–S52 (2007b); J. J. Kelly, _Phys. Rev._ C70, 068202 (2004). * Lins (2008) H.-W. Lin et al., _Phys. Rev._ D78, 114508 (2008a); H.-W. Lin et al., (2008b), 0810.5141. * Ji (1997) X.-D. Ji, _Phys. Rev. Lett._ 78, 610–613 (1997), hep-ph/9603249. * chiQCD (2008) M. Deka et al. (2008), 0811.1779; T. Doi et al. (2008), 0810.2482.
arxiv-papers
2009-03-24T13:51:50
2024-09-04T02:49:01.383159
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Huey-Wen Lin", "submitter": "Huey-Wen Lin", "url": "https://arxiv.org/abs/0903.4080" }
0903.4197
# Oxygen Metallicity Determinations from Optical Emission Lines in Early-type Galaxies Alex E. Athey The University of Texas at Austin Applied Research Laboratories 10000 Burnet Rd Austin, TX 78758 athey@arlut.utexas.edu Joel N. Bregman University of Michigan Department of Astronomy 500 Church St. Ann Arbor, MI 48109-1090 jbregman@umich.edu ###### Abstract We measured the oxygen abundances of the warm (T$\sim 10^{4}K$) phase of gas in seven early-type galaxies through long-slit observations. A template spectra was constructed from galaxies void of warm gas and subtracted from the emission-line galaxies, allowing for a clean measurement of the nebular lines. The ratios of the emission lines are consistent with photoionization, which likely originates from the UV flux of post-asymototic giant branch (PAGB) stars. We employ H II region photoionization models to determine a mean oxygen metallicity of $1.01\pm 0.50$ solar for the warm interstellar medium (ISM) in this sample. This warm ISM $0.5$ to $1.5$ solar metallicity is consistent with modern determinations of the metallicity in the hot (T$\sim 10^{6}-10^{7}K$) ISM and the upper range of this warm ISM metallicity is consistent with stellar population metallicity determinations. A solar metallicity of the warm ISM favors an internal origin for the warm ISM such as AGB mass loss within the galaxy. Galaxies:Elliptical and Lenticular, Galaxies:ISM, Galaxies:Abundances ## 1 Introduction ### 1.1 Warm ISM Discovery Early-type galaxies were once thought to contain very little gas in their interstellar medium (ISM) (e.g. Mathews & Baker (1971); Bregman (1978); White & Chevalier (1983)), but are now known to host massive amounts of extremely hot (T$\sim 10^{6}-10^{7}K$) gas that emits in the X-rays (Forman et al., 1979). The reason early-type galaxies were originally thought to be void of gas is that photographic-plate surveys did not reveal the warm (T$\sim 10^{4}K$) ISM that is abundant in spiral galaxies (e.g. Mayall (1936); Sandage (1957); Mayall (1958)). Only with the advent of large telescopes and efficient detectors was the warm ISM detected, although the masses are an order of magnitude lower than that of spirals. Spectroscopic surveys in the mid-1980’s determined warm ISM detection frequencies in the cores of early-type galaxies of 30%-50% (Caldwell, 1984; Phillips et al., 1986; Veron-Cetty & Veron, 1986). Subsequent narrow-band $H\alpha$ imaging studies revealed extended emission in general agreement with the the stellar morphology and detection rates consistent with the 50% rate determined from the early spectroscopic surveys (Demoulin-Ulrich et al., 1984; Kim, 1989). ### 1.2 Key Warm ISM Studies There are three large sample, multi-wavelength studies of early-type galaxies that have provided a foundation for our understanding of the cold and warm ISM. Trinchieri & di Serego Alighieri (1991, hereafter TdSA) conducted one of the first quantitative early-type galaxy emission-line studies with $H\alpha$ imaging and long-slit optical spectroscopy of 13 early-type galaxies known to have hot X-ray halos. (Goudfrooij et al., 1994a, b, c; Goudfrooij & de Jong, 1995, hereafter G94-5) investigated the origin and evolution of the ISM in an extensive study of a complete sample of 56 elliptical galaxies using broad- band imaging, narrow-band $H\alpha$ imaging, long slit spectroscopy, and _Infrared Astronomical Satellite_ (IRAS) far-IR imaging. A study of the warm and cold phases of the ISM in early-type galaxies was carried as part of the ESO Key-Program 1-004-43K (Macchetto et al., 1996; Ferrari et al., 1999; Caon et al., 2000; Ferrari et al., 2002, hereafter MFCF). Similar to G94-5, the MFCF study probed the origin and evolution of the warm and cold ISM phases through a combination of broad-band, narrow-band and far-IR imaging and long- slit spectroscopy of 73 early-type galaxies. The two later studies had the benefit of FIR imaging capabilities and added the cold ISM (i.e. dust) to the discussion of the ISM in early-type galaxies. These studies sought to determine the frequency of detection of warm and cold ISM in early-type galaxies and then measure fundamental properties, such as mass, density, and luminosity. By correlating these properties with stellar and hot ISM properties, inferences are made about the origin and evolution of the ISM and how it relates to the origin and evolution of the galaxy itself. Below we briefly summarize the findings of these key studies and note the areas where the studies agree and where questions remain. The three key studies find similar fractions of their samples that host a warm ISM, ranging from 60%-80%, despite the differences in sample selection criteria and sizes of the samples. TdSA found 75% of the 13 early-type galaxies surveyed had detectable $H\alpha$ emission which was extended over a range of 5-10 $kpc$. The extent and elliptical shape of the emission confirmed the galaxy-wide nature of this phenomena and excluded a nuclear confined process, such as AGN activity. The TdSA survey was conducted on galaxies known to have significant masses of hot ISM, and the authors concede that the high detection rate is likely connected to sample selection. The G94-5 optically complete sample (chosen without regard for X-ray luminosity) offers a less biased measure of the frequency of the warm ISM; 60% of the early-type galaxies surveyed were detected to have a warm ISM, while a cold (T$\sim 10K$) dust component is detected in 40% of these galaxies. Through the FIR imaging, the G94-5 study was able to show that unlike spiral galaxies, early-type galaxies display a smooth dust component distributed throughout the galaxy. The MFCF authors report an ionized gas detection frequency at 78% for the 73 galaxies in the optically complete sample. The cold dust component was detected at a 75% detection rate with smooth, extended morphologies similar to that of the warm ISM. Two key observations link the warm and the cold ISM together; first, the similar spatial extent and morphology of the cold ISM (dust) and warm ISM and second, the fact that the presence of dust is a strong predictor of the presence of emission lines. It is concluded that these ISM phases are closely related and likely of the same origin. The mass of the warm ISM is orders of magnitude below the X-ray emitting hot ISM and the stellar mass. TdSA calculated a warm ISM gas mass by assuming case-B recombination, a filling factor of $10^{-5}-10^{-6}$, and densities corresponding to the pressure implied by the X-ray observations. The resultant masses were calculated to be $\sim 10^{5}-10^{6}M_{\sun}$ for a typical galaxy in their sample. The $H\alpha$ imaging in G94-5 revealed warm ISM masses similar to the FIR determined dust masses of $\sim 10^{4}-10^{5}M_{\sun}$. The MFCF study determined masses for the warm ISM in the range of $10^{3}-10^{5}M_{\sun}$. Masses of dust at $10^{5}M_{\sun}$ have direct implications on the origin of the dust as the dust destruction rate is high in the presence of the hot ISM and is further discussed below. The correlations between the luminosities of $L_{FIR}$, $L_{H\alpha}$, $L_{X}$, $L_{B}$ and $L_{X}/L_{B}$ explore the links between the difference phases of the ISM and the stars. For numerous of reasons, the luminosity correlations have been difficult to accurately measure and there are contradictions between the key studies. TdSA observed that galaxies with more massive X-ray halos had stronger line emission, indicating that the warm gas is somehow linked with the hot gas. No other luminosity correlations were observed. In a related work to G94-5, the authors find a strong anti- correlation between the masses of dust and X-ray gas (Goudfrooij, 1994, 1995). However in a later study with a larger sample (based in part on MFCF data), Goudfrooij (1997) reveals a positive correlation between the warm ISM with both the hot ISM and the stellar blue luminosity. MFCF determined the luminosity of the ionized gas to be correlated with both blue and X-ray luminosity. The scatter in the $L_{H\alpha}$ and $L_{B}$ relation is greatly reduced when the blue luminosity is confined to the same region as the emission lines. The scatter in all the $L_{H\alpha}$ to $L_{X}/L_{B}$ relations is large and plagued by upper limits on non-detections. In general, the three studies agree that the ionization source for the warm ISM is consistent with PAGB stars, but all comment that the data are unable to exclude other excitation sources such as internal shocks, AGN heating or electron conduction from the hot gas. TdSA show that the observed line intensities are a factor of $\sim 10^{2}-10^{3}$ too large to result from cooling flow luminosities (e.g. Fabian (1991)) and conclude that UV flux from post asymptotic giant branch (PAGB) stars are the most likely ionizing mechanism. The MFCF observed correlation between $H\alpha$ and blue luminosity is an indication of photoionization of the warm ISM from PAGB stars. However, the observed correlation with X-ray luminosity is consistent with warm ISM excitation via electron conduction from the hot ISM (Sparks et al., 1989); Neither ionization mechanism is preferred in MFCF’s large sample of 73 galaxies. See Section 4.1.1 for a continued discussion on the warm ISM ionization source. The key studies narrow down the origin of this dust and warm gas to either be mass shed from AGB stars or the result of small galaxy accretion and mergers. G94-5 reasons that cold dust originated in the circumstellar envelopes of AGB stars are quickly sputtered away by the hot ISM with a typical dust grain lifetime ($\sim 10^{7}yrs$) much shorter than the age of the galaxy (Draine & Salpeter, 1979). And further, the balance between the dust injection and destruction rate does not lead to the dust masses inferred by the far-IR imaging (Faber & Gallagher, 1976; Knapp et al., 1992). The surprising result from the confluence of the G94-5 studies is that the majority of the dust in elliptical galaxies is external in origin. Since the distribution of the ionized gas (i.e. the warm ISM) is observed to be similar to the dust morphology, it is presumed that the warm ISM is likewise external to the galaxy, and will only be seen in galaxies that either have recent merger activity or significant inflows. The high detection frequency of the warm ISM, implies mergers and smaller galaxy acquisitions are common in early-type galaxies. Adding to the puzzle, in a subsample of the gas-rich galaxies, the warm ISM was frequently observed to be kinematically distinct from the main stellar population, also strongly suggesting an external origin for this gas (Caon et al., 2000). ### 1.3 Warm ISM Open Issues The warm ISM is important to study in early-type galaxies and despite the ambitious efforts of the studies described above and subsequent works, several fundamental questions remain. It is critical to resolve these open issues since the intertwined relationships between the cold, warm, and hot gas phases and the stellar population ultimately defines galaxy evolution. Even though the warm ISM mass is orders of magnitude less than the stellar mass, discriminating between internal versus external origin of this material provides pivotal data in formation models. Also, even though minute in mass compared to the cold and hot phases of the ISM, the optical line emissions of the warm ISM can locally dominate the energy output for a region. Finally, the optical emission lines of the warm ISM provides information on the heating and cooling in these systems which demands further exploration since the observed hot ISM properties along with the non-detection of cooling flows creates a “cooling crisis.” The metallicity of the warm ISM is unknown. Because the metallicities of the hot ISM and the stellar metallicities (cf. Trager et al. (2000b, a)) are known, determining the metallicity of the warm ISM can create a link between the gas phases and the stellar population. Also, the metallicity of the warm ISM contains important discriminating information concerning the outstanding issues that the key warm ISM studies were not able to resolve. Specifically, the line ratios of the ionization species provides information on the excitation mechanism of the gas; currently, both electron conduction and photoionization remain viable excitation mechanism. Also the metallicity of the warm ISM contains clues to the internal versus external origin debate. The gas injected into the ISM from stellar mass loss will generally be more metal rich than gas accreted from dwarf galaxies (cf. Lequeux et al. (1979) and Aaronson (1986)). Because of the important information contained in the metallicity of the warm ISM and the unresolved issues concerning its nature and origin, we have conducted a program to determine the oxygen metallicity of the $T\sim 10^{4}K$ gas in a small sample of early-type galaxies. Section 2 describes the sample and observations. The data processing techniques and spectral analysis is discussed in Section 3. Results from the emission line analysis is presented in Section 4. In Section 5, we conclude with a discussion of the implications of this work on both the origin of the warm ISM and the relationships between the stellar population and the other phases of the ISM. ## 2 Observations The MDM 2.4 meter Hiltner Telescope coupled with a Boller and Chivens spectrograph was used to observe 21 nearby, early-type galaxies in four observation runs over a two year period from 2000 to 2002. The sample was selected to span a range of hot ISM properties as determined from the Brown & Bregman (1998) X-ray study as well as a range of warm ISM properties determined in the narrow-band $H\alpha$ imaging surveys by TdSA, G94-5 and MFCF. The galaxies with their relevant fundamental properties are listed in Table 1. Our warm ISM isolation and detection method depends on observing galaxies that contain no emission line gas, therefore, several galaxies were chosen to have very weak detections of the hot and warm phases. Table 1: Early-type Galaxy Properties: Warm Phase Sample Galaxy | RAaaValues taken from NED (NASA/IPAC Extragalactic Database). | DecaaValues taken from NED (NASA/IPAC Extragalactic Database). | $B_{T}^{0}$bbRadial velocity distance corrected for local flows from Faber et al. (1989) unless otherwise noted. | DbbRadial velocity distance corrected for local flows from Faber et al. (1989) unless otherwise noted. | $log\,L_{B}/L_{\odot}$bbRadial velocity distance corrected for local flows from Faber et al. (1989) unless otherwise noted. | $log\,L_{x}$ccX-ray luminosity from Brown & Bregman (1998) unless otherwise noted. | $log\,L_{H_{\alpha}}$ddH$\alpha$ narrow-band imaging luminosity. | ${H_{\alpha}}$ Reference eeReference for H$\alpha$ narrow-band imaging luminosity with the following abbreviations: M96 $=$ Macchetto et al. (1996), G94 $=$ Goudfrooij et al. (1994b), and T91 $=$ Trinchieri & di Serego Alighieri (1991). ---|---|---|---|---|---|---|---|--- | (J2000.0) | (J2000.0) | | $(km/s)$ | $log~{}(erg~{}s^{-1})$ | NGC 1407 | 03 40 11.8 | -18 34 48 | 10.57 | $1990\pm 187$ | 11.16 | 41.34 | 39.32 | M96 NGC 1600 | 04 31 39.8 | -05 05 10 | 11.79 | $4019\pm 489$ | 10.67 | 40.8411O’Sullivan et al. (2001). | 40.15 | M96 NGC 2768 | 09 11 37.5 | +60 02 15 | 10.93 | $1532\pm 325$ | 10.79 | 40.41 | $\cdots$ | $\cdots$ NGC 3115 | 10 05 13.9 | -07 43 07 | 9.95 | $1021\pm 215$ | 10.83 | 39.74 | $<37.6$ | M96 NGC 3377 | 10 47 42.3 | +13 59 08 | 11.13 | $857\pm 126$ | 10.21 | 39.42 | 38.95 | G94 NGC 3379 | 10 47 49.6 | +12 34 55 | 10.43 | $857\pm 126$ | 10.49 | 39.78 | 39.04 | M96 NGC 3489 | 11 00 18.3 | +13 54 05 | 11.1222RC3, de Vaucouleurs et al. (1991). | $1039\pm 101$22RC3, de Vaucouleurs et al. (1991). | 10.3522RC3, de Vaucouleurs et al. (1991). | $\cdots$ | 39.34 | M96 NGC 3607 | 11 16 54.3 | +18 03 10 | 10.53 | $1991\pm 242$ | 11.18 | 40.82 | 39.92 | M96 NGC 4125 | 12 08 05.8 | +65 10 27 | 10.58 | $1986\pm 295$ | 11.16 | 41.01 | 40.30 | T91 NGC 4261 | 12 42 02.4 | +11 38 48 | 11.32 | $2783\pm 590$ | 10.35 | 41.1822RC3, de Vaucouleurs et al. (1991). | 39.38 | G94 NGC 4374 | 12 25 03.7 | +12 53 13 | 10.13 | $1333\pm 71$ | 10.99 | 41.09 | 39.56 | G94 NGC 4406 | 12 26 11.7 | +12 56 46 | 9.87 | $1333\pm 71$ | 11.10 | 41.80 | 40.50 | T91 NGC 4472 | 12 29 46.8 | +08 00 02 | 9.32 | $1333\pm 71$ | 11.32 | 41.77 | 39.60 | T91 NGC 4494 | 12 31 24.1 | +25 46 28 | 10.69 | $695\pm 147$ | 10.20 | 39.28 | $\cdots$ | $\cdots$ NGC 4552 | 12 35 39.8 | +12 33 23 | 10.84 | $1333\pm 71$ | 10.71 | 40.92 | 39.26 | M96 NGC 4636 | 12 42 50.0 | +02 41 17 | 10.20 | $1333\pm 71$ | 10.96 | 41.81 | 39.69 | M96 NGC 4649 | 12 43 39.6 | +11 33 09 | 9.77 | $1333\pm 71$ | 10.96 | 41.48 | 39.83 | T91 NGC 4697 | 12 48 35.9 | -05 48 02 | 10.03 | $794\pm 168$ | 10.58 | 40.13 | 39.63 | G94 NGC 5044 | 13 15 23.9 | -16 23 08 | 11.25 | $2982\pm 314$ | 10.34 | 42.39 | 40.73 | M96 NGC 5322 | 13 49 15.2 | +60 11 26 | 11.09 | $1661\pm 352$ | 10.80 | 40.11 | 39.74 | G94 NGC 5846 | 15 06 29.2 | +01 36 21 | 10.67 | $2336\pm 284$ | 11.26 | 42.01 | 40.25 | M96 The configuration of the spectrograph was chosen to maximize galaxy light input with a $2.1\arcsec$ wide by $5\arcmin$ long slit, while retaining the ability to discriminate between the $H\alpha$ and [N II]$\lambda 6583$ emission lines. The available and appropriate grating for these requirements was a 350 lines/mm grating blazed at $4026$Å, resulting in $7.1$Å/pixel and a spectral range of $\sim 1600$Å over the 1200x800 pixel Loral CCD. The CCD was characterized by relatively low read noise at seven electrons with the nominal gain set at 2.1 electrons per ADU. The one drawback to the chosen spectrograph configuration is that it was necessary to obtain separate blue and red spectra for each galaxy in order to obtain all of the important emission lines from [O II]$\lambda 3727$ to [Si II]$\lambda\lambda 6717,6731$. The grating is servo controlled from the control computer and our tests indicated a $5$Å accuracy in repositioning. Therefore, internal HgNe and Ne lamps were observed before and after each grating reposition for wavelength calibration. Additional calibrations included bias frames, evening and morning twilight flats when the skies were clear, internal flats illuminated from an incandescent source, and spectrophotometric standards. The four observation runs were in March 2000, May 2000, February 2001, and February 2002. Galaxy exposure times and program-type (E $=$ emission-line, T $=$ Template, or L $=$ LINER) are listed in Table 2. The meaning of the program types is discussed below. During the first three runs, the nights were cloudy and over half of the full run was lost to weather and instrument problems. Some of these observations are of marginal value and only reported here for completeness. The final run was entirely photometric. Table 2: MDM 2.4 Meter Observations Galaxy | Exp Blue (s) | Exp Red (s) | Emission Type aaEmission Type. Column display how the observations were ultimately used: T= template galaxy, L=LINER galaxy, E=emission galaxy, W=weak emission. ---|---|---|--- NGC 1407 | $8400$ | $6600$ | T NGC 1600 | $8400$ | $5400$ | W NGC 2768 | $12000$ | $11400$ | L NGC 3115 | $6000$ | $4500$ | T NGC 3377 | $7200$ | $6000$ | W NGC 3379 | $6000$ | $6000$ | T NGC 3489 | $6000$ | $4500$ | E NGC 3607 | $9600$ | $7200$ | E NGC 4125 | $12000$ | $10800$ | L NGC 4261 | $6000$ | $4500$ | E NGC 4374 | $6000$ | $4500$ | E NGC 4406 | $9600$ | $6000$ | W NGC 4472 | $9600$ | $6000$ | W NGC 4494 | $1200$ | $0$ | W NGC 4552 | $6000$ | $6600$ | W NGC 4636 | $6000$ | $9900$ | E NGC 4649 | $6000$ | $4500$ | W NGC 4697 | $6000$ | $1800$ | W NGC 5044 | $6000$ | $3600$ | E NGC 5322 | $9600$ | $9900$ | W NGC 5846 | $7200$ | $6600$ | E The observing strategy was chosen to suppress spurious emission line detections and obtain uniform observations of program and template galaxies. For each galaxy, we attempted to obtain five integrations, ensuring that reasonable statistics could be employed to eliminate cosmic rays from the combined data. Because the emission lines are faint and spread over only a few pixels in both spectral and spatial directions, a fortuitous single cosmic ray can result in a spurious warm ISM detection. The total integration time was chosen to result in a S/N of 5-10 in the template subtracted spectra (See Section 3). We did not constrain the angle of the slit due to complications with the instrument rotator during the first two runs; this has little programatic impact because of the choice of a wide slit, and the non- preferential orientation of the warm ISM observed in the narrow-band imaging surveys (TdSA, G94-5, MFCF). ## 3 Reductions and Spectral Analysis The data were reduced in the standard manner using tasks within IRAF (overscan fitting and subtraction, bias frame construction and subtraction). Each of the runs was calibrated separately but in a similar manner. Internal lamps were used to create a response image and divided through the data, eliminating differences in pixel-to-pixel sensitivity on the CCD. Twilight flats were used to construct an illumination image, correcting for large scale structure and slit illumination. For the first two runs, the incandescent internal lamp produced too few photons in the far blue and only added noise to the data. For these runs we used wavelength calibrated twilight flats to produce response images. A HgNe lamp was used for wavelength calibration of blue-tuned observations and a Ne lamp was used for red-tuned observations. Residuals in the linear, spectral solution were much better (typically $<1$Å) than the resolution element ($\sim 8$Å) over the entire chip. The galaxies were summed over the spatial dimension based on the visual inspection of the 2-D spectra, with background regions selected from the outer regions of the chip. Typically the summed regions for the galaxies were about $1.2\arcmin$ of the $5.2\arcmin$ unvignetted slit length. The spectra were flux calibrated from observations of spectrophotometric standards (Massey et al., 1988) and corrected for extinction with the standard correction for Kitt Peak distributed with IRAF 2.11. Figure 1: Composite Blue and Red Spectra of NGC3489. Important emission lines that are visible in the un-subtracted data are marked aobve the continuum level. In addition, calcium H & K lines are marked for reference. Custom code was developed to implement the combining of the individual 1-D spectra, template matching and subtraction, as well as the extraction of line fluxes. The 1-D spectra combination procedure employed an iterative $1.5\sigma$ rejection algorithm which eliminated cosmic rays that were overlooked in the aperture summing rejection methods. The wavelength calibration was tuned to night sky lines and the measured redshift was checked and tuned to strong stellar population lines (e.g. Ca H&K in the blue and [N II]$\lambda 6583$ in galaxies showing emission lines in the red). An example summed spectra is shown in Figure 1. Although we have upper-limits from the $H\alpha$ imaging surveys, it is unknown which galaxies are void of warm ISM emission. Therefore, the determination of template galaxies, or galaxies without any detected warm ISM, is an involved and iterative process. First the $H\alpha$ and [N II]$\lambda 6583$ region of the spectra is examined for obvious emission. Using the local continuum, upper limits on the line fluxes are determined for galaxies with no obvious $H\alpha$ and [N II]$\lambda 6583$ emission. Ten of the original 21 galaxies match this criteria and act as potential template galaxies. We take these ten galaxies and combine them into a master template galaxy. When combined into the template galaxy, the strongest of these weak emitters will not be included in the template creation because of the aggressive clipping algorithm in the combination routine. To determine the the weak emitters the template is subtracted from the individual galaxy observations and examined for emission lines. Three of the ten template galaxies revealed oxygen lines and were removed from the master template. This process was repeated with the emitters removed and reveal four more weak emitters, leaving three galaxies without emission line activity: NGC 1407, NGC 3115, NGC 3379. As an independent check of our template definition methodology, all seven of the potential template galaxies were subtracted from the galaxy with the strongest emission lines (NGC 2768) and we determined that the three template galaxies selected resulted in the high reported fluxes (i.e. lowest background). The three template galaxies, NGC 1407, NGC 3115 and NGC 3379, lack of warm emission is consistent with results from the narrow-band imaging detections for these galaxies. NGC 3379 is reported to have a weak $H\alpha$ in MFCF but an upper limit below this reported detection is determined in G94-5. NGC 3115 is detected only as an upper limit by MFCF and has been previously used as a stellar template galaxy by the Palomar spectral survey of the nuclear regions of 500 nearby galaxies (Ho et al., 1993). NGC 1407 is marginally detected in both the G94-5 and MFCF studies, but the fluxes reported differ by a factor of five. The inconsistencies of weak detections in the narrow-band surveys reveal intrinsic limitations of the narrow-band technique. Broad-band red imaging is used to subtract an underlying stellar population from the narrow-band data; a process which is susceptible to scaling errors. The stellar template constructed from our sample contains $<10^{-16}~{}erg\,s^{-1}\,cm^{-2}$ combined $H\alpha$ and [N II]$\lambda 6583$ flux; this is an order of magnitude more sensitive as a non-detection than the narrow-band imaging surveys. Once the template galaxies are defined, the stellar population was subtracted from each of the other galaxies, revealing emission lines and any differences in stellar populations. An example subtraction for NGC 4374 is shown in Figure 2. In all galaxies, the residuals in the subtractions are flat with large- scale variation at a 8-10% level in the blue and better than 5% in the red. Once the subtractions are made, the relative line fluxes are measured by defining a low order polynomial to describe the local background and using a gaussian profile to extract the line flux. A gaussian decomposition is only necessary in the crowded [N II]$\lambda 6548$, $H\alpha$, [N II]$\lambda 6583$ region and the fitting method gives equivalent results to raw counts above a background for all other lines. Note that because of the coarse spectral sampling and the relatively low velocity dispersions, the width of the gaussian profiles contain no useful kinematic information and is thus not reported. In eight of the non-template galaxies, the signal-to-noise in the data are insufficient for emission line work, or only H$\alpha$ is observed. For the rest of the sample, extracted relative line fluxes normalized to $H\beta$ are reported in Table 3. The reported flux ratios have been dereddened based on an average value for the reddening from Burstein & Heiles (1984) and Schlegel et al. (1998). The observed relative fluxes reported here do not correct for internal galaxy reddening, displaying the Balmer decrements as observed; Below we apply the correction (See Section 4.2). The errors reported are determined by calculating the range of acceptable background levels within the noise of the local continuum for isolated lines and combining this background uncertainty in quadrature with the range of acceptable gaussian widths that reproduce the total observed line flux for the crowded [N II]-$H\alpha$ complex. Table 3: Observed Nebular Emission Line Ratios Relative to H$\beta$ Galaxy | [O II] | [Ne III] | $H\beta$ | [O III] | [O III] | [O I] | [N II] | $H\alpha$ | [N II] | [S II] | ---|---|---|---|---|---|---|---|---|---|---|--- | $\lambda 3727$ | $\lambda 3869$ | $\lambda 4862$ | $\lambda 4959$ | $\lambda 5007$ | $\lambda 6300$ | $\lambda 6548$ | $\lambda 6563$ | $\lambda 6583$ | $\lambda\lambda 6717,6731$ | NGC 2768 | $70\pm 7$ | $14\pm 6$ | $10\pm 3$ | $1\pm 4$ | $24\pm 4$ | $8\pm 2$ | $20\pm 4$ | $29\pm 5$ | $45\pm 7$ | $50\pm 8$ | NGC 3489 | $19\pm 5$ | $2\pm 3$ | $10\pm 2$ | $2\pm 5$ | $13\pm 5$ | $3\pm 2$ | $30\pm 8$ | $34\pm 5$ | $57\pm 8$ | $37\pm 7$ | NGC 3607 | $32\pm 8$ | $6\pm 3$ | $10\pm 3$ | $7\pm 3$ | $20\pm 4$ | $2\pm 4$ | $25\pm 5$ | $48\pm 6$ | $59\pm 8$ | $22\pm 5$ | NGC 4125 | $74\pm 8$ | $14\pm 4$ | $10\pm 2$ | $23\pm 5$ | $71\pm 10$ | $3\pm 3$ | $19\pm 4$ | $34\pm 8$ | $40\pm 5$ | $23\pm 7$ | NGC 4261 | $16\pm 4$ | $6\pm 5$ | $10\pm 3$ | $6\pm 2$ | $12\pm 3$ | $3\pm 2$ | $15\pm 5$ | $22\pm 8$ | $39\pm 5$ | $15\pm 6$ | NGC 4374 | $16\pm 4$ | $<1$ | $10\pm 2$ | $5\pm 2$ | $12\pm 4$ | $2\pm 4$ | $21\pm 9$ | $35\pm 6$ | $49\pm 8$ | $29\pm 5$ | NGC 4636 | $24\pm 5$ | $2\pm 4$ | $10\pm 3$ | $4\pm 4$ | $13\pm 3$ | $2\pm 5$ | $10\pm 3$ | $33\pm 5$ | $49\pm 7$ | $21\pm 5$ | NGC 5044 | $24\pm 3$ | $2\pm 3$ | $10\pm 2$ | $6\pm 2$ | $20\pm 3$ | $3\pm 2$ | $33\pm 8$ | $32\pm 6$ | $53\pm 8$ | $33\pm 5$ | NGC 5846 | $26\pm 5$ | $2\pm 3$ | $10\pm 4$ | $6\pm 3$ | $14\pm 4$ | $<1$ | $8\pm 5$ | $29\pm 4$ | $36\pm 8$ | $13\pm 10$ | Figure 2: Blue (left) and Red (right) spectra of NGC4374 with template galaxies subtracted, removing the stellar continuum. Large residuals at 5500Å and 6800Å are due different night sky lines positions in the rest wavelength of NGC4374 and template galaxies. The large residual at 3900Å is due to the imperfect matching between the Ca H&K lines of the template galaxies and NGC 4374. ## 4 Warm ISM Emission Line Results ### 4.1 Excitation Mechanism #### 4.1.1 Normal Galaxies There are many possible ionization mechanisms for the warm ISM that have been previously explored and ruled out by the key warm ISM studies (Section 1.2) and other works. Photoionization by hot young stars (Kim, 1989; Shields, 1991) is inconsistent with both the optical colors (G94-5; MFCF) and integrated optical spectra (Sadler, 1987; Heckman et al., 1988). Ionization from radiation associated with an AGN (Fosbury et al., 1982) is ruled out by the large radial extent of the warm ISM observed in the narrow-band imaging (TdSA; G94-5; MFCF). Shock excitation (Ford & Butcher, 1979; Heckman et al., 1989) would produce filamentary ionization regions, where smooth emission is observed (TdSA; G94-5; MFCF). Further, the the input energy from shocks is too low by two orders of magnitude for typical densities and velocities as noted by Sparks et al. (1989). Condensation out of the hot phase and into warm phase filaments has been investigated for a number of X-ray clusters (Cowie et al., 1980; Hu et al., 1985) but the large number of recombinations required per hydrogen atom (e.g. Johnstone et al. (1987); TdSA and references therein) is inconsistent with the observed recombination rates for early-type galaxies (Sparks et al., 1989). The three remaining viable excitation mechanisms for the warm ISM are photoionization from PAGB stars, electron conduction from the hot phase (e.g. Sparks et al. (1989)), and photoionization by extreme UV (EUV) photons from the hot phase (Voit & Donahue, 1990; Donahue & Voit, 1991). The data in the key warm ISM studies are equally consistent with all of these ionization mechanisms. However, photoionization by PAGB stars is the preferred mechanism since these old stars are known to populate the galaxies and given the significant correlation of $L_{H\alpha}$ with $L_{B}$ within a given region (MFCF) strongly indicates a stellar ionizing source. Further, the presence of the far ultraviolet (UV) flux has been confirmed in a small sample of 30 early-type galaxies with _International Ultraviolet Explorer_ (IUE) (Burstein et al. (1988); For a review of Far UV flux in early-type galaxies see O’Connell (1999)). However, to adopt PAGB stars as the ionizing source, excludes the observed correlations between $H\alpha$ and X-ray luminosity (TdSA; (Goudfrooij, 1997), MFCF). The correlations between the X-ray and warm ISM morphologies (Singh et al., 1995; Trinchieri et al., 1997; Trinchieri & Goudfrooij, 2002) provide additional support for photoionization of the warm ISM by the EUV flux from the hot ISM, but it is possible to construct physical conditions that reproduce these morphological links (e.g. cooling of the hot ISM). Although there have been detected correlations between the $L_{H\alpha}$ and $L_{X}/L_{B}$, the correlations contain much more scatter and are less significant than the correlation between $L_{H\alpha}$ with $L_{B}$ within a given region. The large amount of scatter in the X-ray relationship and the known high $L_{X}/L_{B}$ galaxies which contain weak or no $H\alpha$ emission and strong $H\alpha$ emitters with low $L_{X}/L_{B}$ provide insight that the hot and warm ISM link is more tenuous than the link between the stars and the warm ISM. Finally, the key studies in in Section 1.2 and subsequent work (Sarzi et al., 2006), indicate a strong connection between the dust (cold ISM) and the emission line regions, but there are not strong correlations between $L_{FIR}$ and $L_{X}/L_{B}$ in any of the key studies or in recent Spitzer Observations (Temi et al., 2007). Emission line ratios of the different ionization species have the ability to discriminate between collisionally excitation and photoionization. Comparing our sample’s line ratios to line ratios predicted for photoionization models of Allen et al. (1998), Allen et al. (1999), and Binette et al. (1996) and shock ionization of Allen et al. (2008), we conclude the data are consistent with photoionization. Unfortunately, these data are not discriminating due to the large errors in the data and the region populated by these galaxies happens to land in an overlap region for collisional and photoionization. Additional support for the photoionization of this gas is seen with the Far Ultraviolet Space Explorer (FUSE) (Bregman et al., 2005). The observed UV radiation field produces sufficient photons shortward of 912Å to ionize the warm ISM and is consistent with the number of predicted extreme horizontal- branch stars, or equivalently PAGB stars. When the data presented here is combined with the literature, it presents a reasonable case for photoionization of the warm ISM. This is the preferred ionization mechanism in the literature and in discriminating between the two sources of photoionization, PAGB stars or the hot ISM, it would seem more probable that PAGB stars provide the necessary ionizing photons. #### 4.1.2 LINER Galaxies Four of the galaxies listed in Table 3 are reported as low ionization nuclear emission-line regions (LINERs) galaxies in the literature: NGC 2768 (Heckman, 1980), NGC 3115 (Ho et al., 1993), and NGC 4125 and NGC 4261 (Ho et al., 1995). The question of identical treatment of these LINER galaxies and the normal galaxies arises. LINERs are strictly defined to be galaxies with line ratios of [O II]$\lambda 3727$ greater than [O III]$\lambda 5007$ and [O I]$\lambda 6100$ greater than one-third [O III]$\lambda 5007$ (Heckman, 1980). While useful for separating classes of objects, the LINER definition as noted by its creator, Heckman, has no physical basis and in reality only provides a crude boundary between photoionization and a low-level AGN activity. For our purposes, the LINER identification acts as a flag for further investigation, and not as an automatic exclusion filter. The line ratios for the four LINER galaxies are consistent within the photoionization, but the excitation mechanism and thus the valid regions in diagnostic diagrams are still uncertain and being debated for LINERs (for a review of the physical mechanisms behind LINERs see Filippenko (1996) and Barth (2002)). Although it is not entirely clear what to expect for LINER galaxies, the presence of strong collisionally excited lines casts a cloud of doubt of pure photoionization. The [Ne III]$\lambda 3869$ line is an indicator of the importance of collisional excitation because the collisional cross-section is over an order of magnitude larger than the photoionization transition probability for this line. NGC 2768 and NGC 4125 have significant [Ne III]$\lambda 3869$ fluxes and thus we conclude that these systems have a more complex physical structure and excitation mechanism than photoionization. These two galaxies are excluded in the subsequent sections where pure photoionization is assumed. Note that NGC 4125 and NGC 4261 show no distinguishing line ratios from the normal galaxies and, the data presented here do not support the LINER classification. These two galaxies were classified as LINERs by (Ho et al., 1995) which had a similar observational aperture as this study, but only had wavelength coverage down to 4200Å, excluding the useful [O II]$\lambda 3727$ information. ### 4.2 Oxygen Metallicity For those galaxies where photoionization is the dominant ionization mechanism, the line ratios can be used to determine the metallicity of the warm phase gas. There are two critical assumptions to be addressed before using these line ratios and photoionization models to determine global metallicities. The first assumption is that UV flux from PAGB stars ionizing a diffuse ISM on a galactic scale is well represented by photoionization models that were developed for Str$\ddot{{o}}$mgren-sphere-type H II regions. First, we note that the models are determining the balance between photoionization by UV photons and recombinations to the ions; this is fundamentally the same equation in a galaxy-wide ISM as an HII region, given a source of ionizing photons internal to a volume of gas. The UV flux and electron densities of the two environments are similar, although, PAGB stars have different spectral shapes than high mass main sequence stars, but McGaugh (1991) shows that the photoionization models are largely insensitive to the spectral shape of the ionizing star. The models assume the gas is ejected from the ionizing star (and thus of the same metallicity), this is a feature used to calibrate the observed line ratios, but a direct link between the ionizing source and the ejecta is not a necessary condition to employ the models. We argue that the photoionization models will be applicable to the warm ISM, but we readily acknowledge that there are differences in these two environments which will lead to will lead to greater uncertainties in its application here. The second key assumption is that the analysis of the linear combination of many individual diffuse ionized regions observed in an integrated galaxy spectra produces a result that is indicative of the mean properties of the observed regions. Kobulnicky et al. (1999) conducted a study addressing these issues in nearby galaxies, observing H II regions individually through small apertures and globally with drift scanning with a long slit. The authors conclude that global metallicity determinations, accurate to $0.2$ dex, are possible with long-slit, integrated spectra. Table 4: R23 parameter and Oxygen Metallicity Galaxy | log R23 | [O/H] | $Z_{Oxygen}/Z_{\sun}$ ---|---|---|--- NGC 3489 | $0.63^{+0.11}_{-0.14}$ | $-3.26\pm 0.2$ | $1.13^{+0.49}_{-0.30}$ NGC 3607 | $0.93^{+0.08}_{-0.11}$ | $-3.66\pm 0.2$ | $0.43^{+0.29}_{-0.18}$ NGC 4261 | $0.51^{+0.06}_{-0.07}$ | $-3.14\pm 0.2$ | $1.44^{+0.47}_{-0.29}$ NGC 4374 | $0.58^{+0.09}_{-0.10}$ | $-3.20\pm 0.2$ | $1.26^{+0.50}_{-0.31}$ NGC 4636 | $0.68^{+0.09}_{-0.11}$ | $-3.31\pm 0.2$ | $0.98^{+0.41}_{-0.26}$ NGC 5044 | $0.75^{+0.05}_{-0.06}$ | $-3.37\pm 0.2$ | $0.86^{+0.36}_{-0.24}$ NGC 5846 | $0.68^{+0.08}_{-0.09}$ | $-3.30\pm 0.2$ | $1.00^{+0.37}_{-0.26}$ Metallicity determinations of ionized gas in individual H II regions are built upon photoionization models, determining ratios of ionized species relative to hydrogen. The most common diagnostic is the $R23$ parameterization, $R23\equiv(([O\,II]\,\lambda 3727+[O\,III]\,\lambda\lambda 4959,\,5007)/H\beta)$, defined by Pagel et al. (1979) and refined by McGaugh (1991). This parameterization is convenient since it employs the readily available optical oxygen lines, however, it requires the [O II]$\lambda 3727$/[N II]$\lambda 6583$ information to resolve a degeneracy present in the $R23$ models. We take the line ratios reported in Table 3 and correct for reddening internal to the galaxy using the interstellar extinction curve of Savage & Mathis (1979) and assuming case B ratio for the $H\alpha$ to $H\beta$ at $T=10^{4}$ (Osterbrock, 1989). For NGC 4261 no reddening correction is applied, as the Balmer decrement indicates a non-physical negative reddening. These dereddened lines are used to generate $R23$ values for the galaxies. Because of the faint nature of the $[O\,III]\,\lambda 4959$ line, we used the conical, equilibrium value of 1/3 the line flux of $[O\,III]\,\lambda 5007$ when this line was buried in the noise of the subtracted spectra. All of the galaxies end up on the upper branch of the $R23$ curve as indicated by the [O II]$\lambda 3727$/[NII]$\lambda 6583$ diagnostic. To determine metallicities, we employ McGaugh (1991) calibration as parameterized by Kobulnicky et al. (1999) and reported the metallicity results in Table 4. For the zero point of the solar metallicity we employ a solar photospheric oxygen abundance of [O/H]$=-3.3$ (Asplund et al., 2005; Scott et al., 2008), but note the uncertainty and current debate about the solar determinations. The errors reported on the oxygen metallicities in these galaxies are at least $0.2$ dex as these are the dominating and intrinsic uncertainties in the models used to create the $R23$ grid and its application to global galaxy spectra (cf. Kobulnicky et al. (1999)). The median metallicity for the seven early-type galaxies is O/O☉=1.01. Within these $0.2$ dex absolute errors, the none of the galaxies are significantly different from one another. ## 5 Implications and Discussion The determined mean oxygen metallicity of solar for the warm phase of the ISM has implications for the origin of this gas and its relationship to other phases of the ISM and the stellar population. The limitations of this study are apparent with a small sample of seven galaxies, large $0.2$ dex errors, and a less than ideal application of H II region models to the warm ISM. However, this work does present new information as it appears that there are no determination of the metallicity of the warm ISM in early-type galaxies in the literature. Sarzi et al. (2006) conducted the most recent large survey of ionized gas in early-type galaxies and conclude at the end of the study that the origin of the ionized gas is still unsolved and state that the metallicity provides an insightful clue. Below we consider the implications of a near solar metallicity for the warm ISM. ### 5.1 Origin of the Warm ISM A warm ISM with a solar metallicity argues against an external origin model for the emission line gas. The accretion galaxies involved in minor mergers are presumably dwarf irregular (dIrr) galaxies, since dwarf spheroidal (dSph) galaxies are most frequently devoid of gas. Gaseous and dusty galaxies with near solar metallicity are luminous ($>10^{10}L_{\sun}$) and massive(Garnett, 2002). Mergers of these types of objects produce profound disturbances, which are simply not observed in these early-type galaxies with $H\alpha$ emission. It is possible that an intense gas enrichment by supernovae type-II occurs once low metallicity gas is accreted, however, the broad-band colors and global galaxy spectra (G94-5, MFCF) show little evidence for major star formation. Further, the observed supernovae rates are too low to account for such a drastic enrichment (Cappellaro et al., 1999). We can compare a solar metallicity for the warm ISM with metallicities of the hot ISM and the stars. The stellar population in early-type galaxies is generally observed to have a solar or super-solar metallicity (Trager et al., 2000b, a). A number of the seven galaxies observed in this work have stellar Fe and $\alpha$ metallicity measurements in the literature, although, there are some inconsistencies between authors (NGC 4261 is measured to have $[Fe/H]$ of -0.03, 0.275, 0.29, and 0.188 by Trager et al. (2000b), Thomas et al. (2005), Howell (2005), and Sánchez-Blázquez et al. (2006), respectively.) Not all the galaxies have measured stellar metallicities but a five galaxy average from all of the determinations in the 2005 and 2006 papers listed above is $[Fe/H]=0.22$, ranging from $[Fe/H]=0.099$ to $[Fe/H]=0.44$ ($[\alpha/H]$ is similar). It is important to remember that Trager et al. (2000a) estimates the _absolute_ error on stellar metallicity determinations close to a factor of two, while the relative errors are much smaller. The _Chandra_ X-ray Observatory has the spatial resolution to resolve and remove the stellar component from the gas which is leading to better data and a revision of our (mis)understanding of the metallicity in the hot ISM. Recently, Humphrey & Buote (2006) analyzed a sample of 28 early-type galaxies observed with _Chandra_ and determine that the hot ISM abundances are consistent and perhaps higher than the stellar abundances. In summary, a $0.50$ to $1.50$ solar metallicity in the warm ISM is consistent with both hot ISM and stellar metallicity determinations. It has been thought that early-type galaxies would have a problem generating and retaining dust and warm gas, due to the hostile conditions provided by the hot ISM and the low injection rate of new material into the ISM from stars. Parriott & Bregman (2008) have shown that is it possible for dust to condense in the circumstellar envelopes of AGB stars and then subsequently be injected into the hot ISM. Although this dust has a short lifetime in the hot ISM, the injection rate has been observed to be greater than the destruction rate and could account for the total observed mass given a simple evolution of this injection rate given that more massive stars evolved off the main sequence in the past (Athey et al., 2002). An internal origin for the dust is supported by the G94-5 and MFCF studies indicating that the majority ($\sim 90\%$) of the dust is distributed smoothly throughout the galaxy. The internal origin for the cold ISM is further confirmed by a 2.29$\mu$m CO absorption feature study that finds a lower velocity dispersion for the dust than that of the stars in a sample of 25 nearby early-type galaxies (Silge & Gebhardt, 2003). Finally from the analysis of _Spitzer_ observations of 46 galaxies in the FIR ($24\mu$m, $70\mu$m, and $160\mu$m), Temi et al. (2007) propose an AGB mass loss, internal origin for the observed dust, which sinks to the core of the galaxy and is periodically driven out by AGN activity. This outward transport of dust may cool the hot gas down to the warm phase. The major stumbling block to a galaxy internal origin for dust and gas is the observations of gas kinematics which are distinct with respect to the stars. Recent observational evidence has suggested that there may be different evolutionary tracks for early-type galaxies. The classification of early-type galaxies into fast and slow rotation categories by Emsellem et al. (2007) and the key ingredient of gas for the formation and evolution of fast rotators provides an important dividing line for future discussions on the origin of the ISM in early-type galaxies. The authors would like to acknowledge useful discussions with P. Goudfrooij and E. D. Miller. We would also like to thank an anonymous referee for suggestions that significantly improved this paper. ## References * Aaronson (1986) Aaronson, M. 1986, in Star Forming Dwarf Galaxies and Related Objects, 125 * Allen et al. (1998) Allen, M. G., Dopita, M. A., & Tsvetanov, Z. I. 1998, ApJ, 493, 571 * Allen et al. (1999) Allen, M. G., Dopita, M. A., Tsvetanov, Z. I., & Sutherland, R. S. 1999, ApJ, 511, 686 * Allen et al. (2008) Allen, M. G., Groves, B. A., Dopita, M. A., Sutherland, R. S., & Kewley, L. J. 2008, ApJS, 178, 20 * Asplund et al. (2005) Asplund, M., Grevesse, N., & Sauval, A. J. 2005, in Astronomical Society of the Pacific Conference Series, Vol. 336, Cosmic Abundances as Records of Stellar Evolution and Nucleosynthesis, ed. T. G. Barnes, III & F. N. Bash, 25–+ * Athey et al. (2002) Athey, A., Bregman, J. N., Bregman, J. D., Temi, P., & Sauvage, M. 2002, ApJ, 571, 272 * Barth (2002) Barth, A. J. 2002, in ASP Conf. Ser. 258: Issues in Unification of Active Galactic Nuclei, 147 * Binette et al. (1996) Binette, L., Wilson, A. S., & Storchi-Bergmann, T. 1996, A&A, 312, 365 * Bregman (1978) Bregman, J. N. 1978, ApJ, 224, 768 * Bregman et al. (2005) Bregman, J. N., Miller, E. D., Athey, A. E., & Irwin, J. A. 2005, ApJ, 635, 1031 * Brown & Bregman (1998) Brown, B. A. & Bregman, J. N. 1998, ApJ, 495, L75 * Burstein et al. (1988) Burstein, D., Bertola, F., Buson, L. M., Faber, S. M., & Lauer, T. R. 1988, ApJ, 328, 440 * Burstein & Heiles (1984) Burstein, D. & Heiles, C. 1984, ApJS, 54, 33 * Caldwell (1984) Caldwell, N. 1984, PASP, 96, 287 * Caon et al. (2000) Caon, N., Macchetto, D., & Pastoriza, M. 2000, ApJS, 127, 39 * Cappellaro et al. (1999) Cappellaro, E., Evans, R., & Turatto, M. 1999, A&A, 351, 459 * Cowie et al. (1980) Cowie, L. L., Fabian, A. C., & Nulsen, P. E. J. 1980, MNRAS, 191, 399 * de Vaucouleurs et al. (1991) de Vaucouleurs, G., de Vaucouleurs, A., Corwin, H. G., Buta, R. J., Paturel, G., & Fouque, P. 1991, Third Reference Catalogue of Bright Galaxies (Volume 1-3, XII, 2069 pp. 7 figs.. Springer-Verlag Berlin Heidelberg New York) * Demoulin-Ulrich et al. (1984) Demoulin-Ulrich, M.-H., Butcher, H. R., & Boksenberg, A. 1984, ApJ, 285, 527 * Donahue & Voit (1991) Donahue, M. & Voit, G. M. 1991, ApJ, 381, 361 * Draine & Salpeter (1979) Draine, B. T. & Salpeter, E. E. 1979, ApJ, 231, 438 * Emsellem et al. (2007) Emsellem, E., Cappellari, M., Krajnović, D., van de Ven, G., Bacon, R., Bureau, M., Davies, R. L., de Zeeuw, P. T., Falcón-Barroso, J., Kuntschner, H., McDermid, R., Peletier, R. F., & Sarzi, M. 2007, MNRAS, 379, 401 * Faber & Gallagher (1976) Faber, S. M. & Gallagher, J. S. 1976, ApJ, 204, 365 * Faber et al. (1989) Faber, S. M., Wegner, G., Burstein, D., Davies, R. L., Dressler, A., Lynden-Bell, D., & Terlevich, R. J. 1989, ApJS, 69, 763 * Fabian (1991) Fabian, A. C. 1991, in IAU Symp. 144: The Interstellar Disk-Halo Connection in Galaxies, 237–244 * Ferrari et al. (1999) Ferrari, F., Pastoriza, M. G., Macchetto, F., & Caon, N. 1999, A&AS, 136, 269 * Ferrari et al. (2002) Ferrari, F., Pastoriza, M. G., Macchetto, F. D., Bonatto, C., Panagia, N., & Sparks, W. B. 2002, A&A, 389, 355 * Filippenko (1996) Filippenko, A. V. 1996, in ASP Conf. Ser. 103: The Physics of Liners in View of Recent Observations, 17 * Ford & Butcher (1979) Ford, H. C. & Butcher, H. 1979, ApJS, 41, 147 * Forman et al. (1979) Forman, W., Schwarz, J., Jones, C., Liller, W., & Fabian, A. C. 1979, ApJ, 234, L27 * Fosbury et al. (1982) Fosbury, R. A. E., Boksenberg, A., Snijders, M. A. J., Danziger, I. J., Disney, M. J., Goss, W. M., Penston, M. V., Wamsteker, W., Wellington, K. J., & Wilson, A. S. 1982, MNRAS, 201, 991 * Garnett (2002) Garnett, D. R. 2002, ApJ, 581, 1019 * Goudfrooij (1994) Goudfrooij, P. 1994, PhD thesis, Ph. D. thesis, University of Amsterdam, The Netherlands, (1994) * Goudfrooij (1995) —. 1995, PASP, 107, 502 * Goudfrooij (1997) Goudfrooij, P. 1997, in Astronomical Society of the Pacific Conference Series, Vol. 116, The Nature of Elliptical Galaxies; 2nd Stromlo Symposium, ed. M. Arnaboldi, G. S. Da Costa, & P. Saha, 338–+ * Goudfrooij & de Jong (1995) Goudfrooij, P. & de Jong, T. 1995, A&A, 298, 784 * Goudfrooij et al. (1994a) Goudfrooij, P., de Jong, T., Hansen, L., & Norgaard-Nielsen, H. U. 1994a, MNRAS, 271, 833 * Goudfrooij et al. (1994b) Goudfrooij, P., Hansen, L., Jorgensen, H. E., & Norgaard-Nielsen, H. U. 1994b, A&AS, 105, 341 * Goudfrooij et al. (1994c) Goudfrooij, P., Hansen, L., Jorgensen, H. E., Norgaard-Nielsen, H. U., de Jong, T., & van den Hoek, L. B. 1994c, A&AS, 104, 179 * Habing (1996) Habing, H. J. 1996, A&A Rev., 7, 97 * Heckman (1980) Heckman, T. M. 1980, A&A, 87, 152 * Heckman et al. (1988) Heckman, T. M., Baum, S. A., van Breugel, W., & McCarthy, P. J. 1988, in NATO ASIC Proc. 229: Cooling Flows in Clusters and Galaxies, 245–250 * Heckman et al. (1989) Heckman, T. M., Baum, S. A., van Breugel, W. J. M., & McCarthy, P. 1989, ApJ, 338, 48 * Ho et al. (1995) Ho, L. C., Filippenko, A. V., & Sargent, W. L. 1995, ApJS, 98, 477 * Ho et al. (1993) Ho, L. C., Filippenko, A. V., & Sargent, W. L. W. 1993, ApJ, 417, 63 * Howell (2005) Howell, J. H. 2005, AJ, 130, 2065 * Hu et al. (1985) Hu, E. M., Cowie, L. L., & Wang, Z. 1985, ApJS, 59, 447 * Humphrey & Buote (2006) Humphrey, P. J. & Buote, D. A. 2006, ApJ, 639, 136 * Johnstone et al. (1987) Johnstone, R. M., Fabian, A. C., & Nulsen, P. E. J. 1987, MNRAS, 224, 75 * Kim (1989) Kim, D. 1989, ApJ, 346, 653 * Knapp et al. (1992) Knapp, G. R., Gunn, J. E., & Wynn-Williams, C. G. 1992, ApJ, 399, 76 * Kobulnicky et al. (1999) Kobulnicky, H. A., Kennicutt, R. C., & Pizagno, J. L. 1999, ApJ, 514, 544 * Lequeux et al. (1979) Lequeux, J., Rayo, J. F., Serrano, A., Peimbert, M., & Torres-Peimbert, S. 1979, A&A, 80, 155 * Macchetto et al. (1996) Macchetto, F., Pastoriza, M., Caon, N., Sparks, W. B., Giavalisco, M., Bender, R., & Capaccioli, M. 1996, A&AS, 120, 463 * Massey et al. (1988) Massey, P., Strobel, K., Barnes, J. V., & Anderson, E. 1988, ApJ, 328, 315 * Mathews & Baker (1971) Mathews, W. G. & Baker, J. C. 1971, ApJ, 170, 241 * Mayall (1936) Mayall, N. U. 1936, PASP, 48, 14 * Mayall (1958) Mayall, N. U. 1958, in IAU Symp. 5: Comparison of the Large-Scale Structure of the Galactic System with that of Other Stellar Systems, 23 * McGaugh (1991) McGaugh, S. S. 1991, ApJ, 380, 140 * O’Connell (1999) O’Connell, R. W. 1999, ARA&A, 37, 603 * Osterbrock (1989) Osterbrock, D. E. 1989, Astrophysics of gaseous nebulae and active galactic nuclei (Research supported by the University of California, John Simon Guggenheim Memorial Foundation, University of Minnesota, et al. Mill Valley, CA, University Science Books, 1989, 422 p.) * O’Sullivan et al. (2001) O’Sullivan, E., Forbes, D. A., & Ponman, T. J. 2001, MNRAS, 328, 461 * Pagel et al. (1979) Pagel, B. E. J., Edmunds, M. G., Blackwell, D. E., Chun, M. S., & Smith, G. 1979, MNRAS, 189, 95 * Parriott & Bregman (2008) Parriott, J. R. & Bregman, J. N. 2008, ApJ, 681, 1215 * Phillips et al. (1986) Phillips, M. M., Jenkins, C. R., Dopita, M. A., Sadler, E. M., & Binette, L. 1986, AJ, 91, 1062 * Sadler (1987) Sadler, E. M. 1987, in IAU Symp. 127: Structure and Dynamics of Elliptical Galaxies, 125–132 * Sánchez-Blázquez et al. (2006) Sánchez-Blázquez, P., Gorgas, J., Cardiel, N., & González, J. J. 2006, A&A, 457, 809 * Sandage (1957) Sandage, A. 1957, ApJ, 125, 422 * Sarzi et al. (2006) Sarzi, M., Falcón-Barroso, J., Davies, R. L., Bacon, R., Bureau, M., Cappellari, M., de Zeeuw, P. T., Emsellem, E., Fathi, K., Krajnović, D., Kuntschner, H., McDermid, R. M., & Peletier, R. F. 2006, MNRAS, 366, 1151 * Savage & Mathis (1979) Savage, B. D. & Mathis, J. S. 1979, ARA&A, 17, 73 * Schlegel et al. (1998) Schlegel, D. J., Finkbeiner, D. P., & Davis, M. 1998, ApJ, 500, 525 * Scott et al. (2008) Scott, P., Asplund, M., Grevesse, N., & Sauval, A. J. 2008, ArXiv e-prints * Shields (1991) Shields, J. C. 1991, AJ, 102, 1314 * Silge & Gebhardt (2003) Silge, J. D. & Gebhardt, K. 2003, AJ, 125, 2809 * Singh et al. (1995) Singh, K. P., Bhat, P. N., Prabhu, T. P., & Kembhavi, A. K. 1995, A&A, 302, 658 * Sparks et al. (1989) Sparks, W. B., Macchetto, F., & Golombek, D. 1989, ApJ, 345, 153 * Temi et al. (2007) Temi, P., Brighenti, F., & Mathews, W. G. 2007, ApJ, 660, 1215 * Thomas et al. (2005) Thomas, D., Maraston, C., Bender, R., & Mendes de Oliveira, C. 2005, ApJ, 621, 673 * Trager et al. (2000a) Trager, S. C., Faber, S. M., Worthey, G., & González, J. J. 2000a, AJ, 120, 165 * Trager et al. (2000b) —. 2000b, AJ, 119, 1645 * Trinchieri & di Serego Alighieri (1991) Trinchieri, G. & di Serego Alighieri, S. 1991, AJ, 101, 1647 * Trinchieri & Goudfrooij (2002) Trinchieri, G. & Goudfrooij, P. 2002, A&A, 386, 472 * Trinchieri et al. (1997) Trinchieri, G., Noris, L., & di Serego Alighieri, S. 1997, A&A, 326, 565 * Veron-Cetty & Veron (1986) Veron-Cetty, M.-P. & Veron, P. 1986, A&AS, 66, 335 * Voit & Donahue (1990) Voit, G. M. & Donahue, M. 1990, ApJ, 360, L15 * White & Chevalier (1983) White, R. E. & Chevalier, R. A. 1983, ApJ, 275, 69
arxiv-papers
2009-03-24T21:29:45
2024-09-04T02:49:01.393550
{ "license": "Public Domain", "authors": "Alex E. Athey, Joel N. Bregman", "submitter": "Alex Athey", "url": "https://arxiv.org/abs/0903.4197" }
0903.4344
# First Determination of the True Mass of Coronal Mass Ejections: A Novel Approach to Using the Two STEREO Viewpoints Robin C. Colaninno George Mason University, Fairfax, VA 22030, USA robin.colaninno@nrl.navy.mil Angelos Vourlidas Code 7663, Naval Research Laboratory, Washington, DC 20375, USA vourlidas@nrl.navy.mil (Received –; Revised –; Accepted –) ###### Abstract The twin Sun Earth Connection Coronal and Heliospheric Investigation (SECCHI) COR2 coronagraphs of the Solar Terrestrial Relations Observatory (STEREO) provide images of the solar corona from two view points in the solar system. Since their launch in late 2006, the STEREO Ahead (A) and Behind (B) spacecrafts have been slowly separating from Earth at a rate of 22.5 degrees per year. By the end of 2007, the two spacecraft were separated by more than 40 degrees from each other. At this time, we began to see large-scale differences in the morphology and total intensity between coronal mass ejections (CMEs) observed with SECCHI-COR2 on STEREO-A and B. Due to the effects of the Thomson scattering geometry, the intensity of an observed CME is dependent on the angle it makes with the observed plane of the sky. From the intensity images, we can calculate the integrated line of sight electron density and mass. We demonstrate that is is possible to simultaneously derive the direction and true total mass of the CME if we make the simple assumption that the same mass should be observed in COR2-A and B. Sun: coronal mass ejections, methods: data analysis, techniques: image processing ††copyright: ©2008: ††slugcomment: To be submitted to ApJ ## 1 INTRODUCTION Coronal mass ejections (CMEs) have been extensively studied and their general properties are well known after a complete solar cycle of observations with the Large Angle and Spectrometric Coronagraphs (LASCO; Brueckner et al, 1995). There exists a large body of literature detailing the speed, width, and position angle of individual events as well as statistics for larger samples (St. Cyr et al., 2000; Yashiro et al., 2004). There are fewer studies on CME mass and consequently on their kinetic energy. Vourlidas et al. (2000, 2002) and Subramanian and Vourlidas (2007) published statistics on the mass and energies of LASCO CMEs and described their analysis methods. Because the CME observations are the projection of the three dimensional erupting structure on the plane of the sky, the measured (width, height, brightness) and derived (speed, mass, energy) quantities are also projected on the plane and represent lower limits of the true, un-projected CME properties. The projection effects on these quantities can be estimated by making assumptions about the CME propagation direction and shape, but the true three dimensional properties of the CME remains difficult to estimate reliably (Vršnak et al., 2007). In the case of CME total mass, Vourlidas et al. (2000) showed that CME masses are underestimated by about a factor of two, for most cases. This estimation was supported by three dimensional magnetohydrodynamics model calculations by Lugaz et al. (2005). But the models are idealized representations of the CME structure and are subject to many assumptions, leaving some doubts about the fidelity of mass and kinetic energy measurements. Multiple viewpoint observations of CMEs offer the best way so far to derive their true properties and quantify the validity of the projected CME measurements. The twin Sun Earth Connection Coronal and Heliospheric Investigation (SECCHI) COR2 coronagraphs (Howard et al., 2008) of the Solar Terrestrial Relations Observatory (STEREO; Kaiser et al., 2008) provide such observations. Since their launch in late 2006, the STEREO Ahead (A) and Behind (B) spacecraft have separated from Earth at a rate of $22.5^{\circ}$ per year. By the end of 2007, the two spacecraft were separated from each other by more than $40^{\circ}$. At that time, we began to see large-scale differences in both the morphology and total intensity between the same CMEs observed with SECCHI-COR2 on STEREO-A and B. The differences in the CME morphology seen by SECCHI are the result of projecting the complex optically thin structure of the CME through the different lines of sight of the COR2-A and B coronagraphs. However, the differences in the total intensity of the CME are mostly due to the different Thomson scattering geometry through the CME plasma. It has long been established that the visible emission of the K-corona originates from the scattering of photospheric light by the coronal electrons (Minnaert, 1930; van de Hulst, 1950; Billings, 1966) via the Thomson scattering mechanism (Jackson, 1997). The scattering strength for a given electron depends on the angle $\chi$, between the vector from the electron to the observer and the radius from the electron to the center of the Sun and the distance from the electron to the Sun. Along any line of sight (LOS), the maximum emission at a fixed radial distance occurs at the point $\chi=90^{\circ}$. Within the field of view of a coronagraph, the maximum emission is approximately along a plane. This plane is referred to as the plane of sky (POS) of the observer. Away from the POS, the scattering efficiency decreases. The angle along the LOS away from the POS is $\theta$. Thus the observed intensity of a CME is dependent on the angle, $\theta$, its electrons make with the POS. From the intensity images, we can calculate the electron density and mass for various values of $\theta$. Historically, mass estimates have been calculated for the $\theta=0$ condition, which is the minimum value of the mass. Corrections for this conditions where $\theta>0$, increases the true mass. A goal of the STEREO mission are to determine true properties of CMEs, including their propagation direction. Ultimately, these goals can be achieved by full three dimensional reconstruction of the CMEs. In this paper, we present a novel way to use the two viewpoints of STEREO to locate the CME in longitude. We simply require that the total mass of a CME be the same when the mass calculation is corrected for the two viewpoints. We further demonstrate that in doing so it is possible to simultaneously derive the direction and true total mass of the CME. In § 2, we begin by calibrating our mass calculations by comparing the total mass measurements from SOHO-LASCO and SECCHI. In § 3, we describe in detail our method for estimating the direction and total mass of the CME using two viewpoints. In this section, we also present the results for eight CMEs observed in COR2. In § 3.2, we give an expression for the dependence of the de-projected CME mass with height. Finally, in § 4, we present a discussion of our method and conclusions of our work in this paper. ## 2 Mass Analysis Procedure for SECCHI-COR2 Images To calculate the total mass of a CME, we first calibrate the images to the customary units of mean solar brightness. We then subtract from the event sequence an image just prior to the appearance of the CME. This subtraction removes the background F-corona, static K-corona and any residual stray light that has not been removed during the calibration. Thus, we are left with the brightness changes caused by the CME. Because we do not know their distribution along the LOS a priori, we must make the usual assumption that all the electrons are located on the POS. We can then estimate the number of electrons by taking the ratio of the observed brightness ($B_{obs}$) to the brightness of a single electron at a given angular distance, $B_{e}(\theta)$. The brightness, $B_{e}(\theta)$, is calculated analytically from the scattering geometry using the equations in Billings (1966). To convert the electron density to mass, we assume that the ejected material comprises a mix of completely ionized hydrogen and $10\%$ helium. The mass at each pixel in the image is then calculated using the equation : $m={{B_{obs}}\over{B_{e}(\theta)}}\times 1.97\times 10^{-24}g.$ (1) We note that there are two significant advantages of these mass (or electron density) images. First, instrumental effects such as vignetting are removed and secondly the effect of Thomson scattering is removed. Consequently, the image brightness is directly related to the number of electrons along the LOS, regardless of where it is located in the field of view. Once the brightness value of each pixel in the image is converted to grams, we calculate the total mass by summing the values in the region of the image containing the CME. We perform this procedure for all the images of a time sequence until the leading edge of the CME leaves the COR2 field of view. As an example, Figure 1 shows the calibrated mass images for the eight CMEs that we studied in COR2-A and B. The dependence of the CME appearance on the viewing angle is evident in most events, especially on the 2008 April 26 event. ### 2.1 Cross-Calibration with LASCO Mass Calculations To verify our mass analysis procedure for SECCHI-COR2 images, we compare COR2 mass measurements to LASCO C2 and C3 measurements. Validation of the COR2 data is a necessary step since this is the first time that mass measurements from the COR2 instruments have been presented. The availability of concurrent LASCO observations is fortunate for the analysis of SECCHI data since the calibration of the LASCO coronagraphs is very well known (Morrill et al., 2006) and CME masses have been studied with LASCO data (Vourlidas et al., 2000, 2002). For the cross-calibration, we chose events that occurred early in 2007 when the STEREO spacecraft were closest to the Sun-Earth line and the SOHO spacecraft. The POS is essentially the same for all instruments since the STEREO spacecraft were $\leq 2^{\circ}$ from Earth. In the next section, we will explore the differences in the observed intensities caused by the separation of STEREO from Earth. We calculated the total mass using the procedure describe in the previous section. The results for the four coronagraphs (LASCO C2 and C3, COR2-A and B) are shown in Figure 2. The LACSO C2 has field of view (FOV) from $\sim 2.5$ to $7R_{\odot}$ and the LASCO C3 has a FOV from $\sim 4.0$ to $30R_{\odot}$. For the cross comparison, we choose to compare the COR2-A data to the LASCO C2 and the COR2-B data to the LASCO C3. We choose to do the comparison in this way because, unfortunately, stray-light in the COR2-B data limits the usable inner FOV and dynamic range early in the mission. Thus, we began the COR2-B measurements at $4.0R_{\odot}$ for easy of comparison with LASCO C3. In the COR2-A data, we can observe the CME at $2.5R_{\odot}$ which is comparable to the LASCO C2. Thus we are observing the same area of the CME in both LASCO C2 and C3 with the COR2-A and B, respectively. For all three events, the data from the LASCO C2 coronagraph matches well with the data from the COR2-A and the LASCO C3 data matches the data from COR2-B. As the CMEs expands, the difference in the inner FOV has less of an effect on the total mass and the data points converge for the LASCO C3 and COR2-A and B coronagraphs. The good agreement with LASCO C2 and C3 data demonstrates that the COR2 images can be used with confidence for analysis of CME masses. The COR2 mass profiles in Figure 2 provide another important result by verifying that the CME mass increases with height reaching a constant value in the middle corona, above $10R_{\odot}$ as was suggested by Vourlidas et al. (2000). We will further analyze and discuss this behavior in § 3.2. ## 3 A Novel Approach Using the Two STEREO Viewpoints When simultaneous observations from different viewpoints are available, we can exploit the resulting differences in the mass estimates to obtain not only the true mass but also the direction of the CME. Figure 4 shows the calculated mass versus time for the CME on 2008 March 25 as observed in COR2-A and B for $\theta=0$. The relationship between the calculated total mass in Figure 4 and the observed total brightness is : $M_{A}={{B_{A}}\over{B_{e}(\theta=0)}}m_{ej}$ (2) $M_{B}={{B_{B}}\over{B_{e}(\theta=0)}}m_{ej}$ (3) where again, $B_{e}(\theta)$ is the brightness of a single electron at a given angular distance from the POS and $m_{ej}$ is the mass of the ejected material. For the 2008 March 25 CME, the calculated total mass in COR2-B remains less than the COR2-A mass as the CME expands into the field of view of the coronagraphs. As we have seen previously in Figure 2, both mass curves converge towards a more or less constant value. Since we are using constant base difference images, we should only be measuring the mass increase caused by the CME. We then conclude that the full extent of the CME is visible in both coronagraphs above $10R_{\odot}$. Thus we can assume that we are observing the same volume of diffuse material from different angles and we should calculate the same total mass from both COR2-A and B. If this assumption is true, the difference in the calculated masses is a result of using an incorrect angle in our Thomson scattering calculation. The masses calculated in equations 2 and 3 can be expressed as fractions of the true total mass of the CME : $M_{T}f_{m}(\theta_{A})=M_{A}$ (4) $M_{T}f_{m}(\theta_{B})=M_{B}$ (5) where $M_{T}$ is the true total mass of the CME and $\theta_{A}$ and $\theta_{B}$ are the angular distances of the CME from the POS of COR2-A and B, respectively. The function, $f_{m}$, is the ratio of the brightness of an electron at angle $\theta$ relative to its brightness on the POS. We will refer to this function as the normalized mass : $f_{m}(\theta)=\frac{B_{e}(\theta)}{B_{e}(\theta=0)}.$ (6) The function, $f_{m}$, is plotted in figure 3. If the CME were in the POS of one of the coronagraphs, we would obtain the true total mass by setting $B_{e}(\theta=0)$. For CMEs away from the instrument POS, the calculated mass is some fraction of the true total mass, expressed by $f_{m}$. It is of interest to note that if the CME were directed towards one of the coronagraphs then, theoretically, we should not observe any mass. The angle between the COR2-A and B POS is equal to the STEREO spacecraft separation. Thus we can define $\theta_{A}$ and $\theta_{B}$, with respect to a common coordinate system. For this coordinate system, the angle, $\theta$, is measured $90^{\circ}$ from the Sun-Earth line in a right hand coordinate system. Thus equations 4 and 5 can be written as : $M_{T}f_{m}(\theta+\frac{1}{2}\Delta_{sc})=M_{A}$ (7) $M_{T}f_{m}(\theta-\frac{1}{2}\Delta_{sc})=M_{B}$ (8) where $\Delta_{sc}$ is the angular separation of the two spacecraft, and $\theta$ is the angle of propagation of the event. Thus the axis of the coordinate system is equal distance from the COR2-A and B POS. We can now equate the difference in the calculated mass in COR2-A and COR2-B to the true total mass. If we combine equations 7 and 8, we have : $Mf_{m}(\theta+\frac{1}{2}\Delta_{sc})-Mf_{m}(\theta-\frac{1}{2}\Delta_{sc})=M_{A}-M_{B}.$ (9) We can calculate the true total mass by inverting this function to find the longitudinal direction that satisfies equation 9. The mass difference, $M_{A}-M_{B}$, is plotted as a function of longitudinal direction in Figure 6 for separation angles of $10^{\circ}$ to $90^{\circ}$. The mass difference is the superposition of two of the functions shown in Figure 3 offset by the spacecraft separation. The inversion of the function can lead to more than one solution for a given mass difference. However, some of the solutions can be eliminated. In Figure 6, the gray part of the curve shows where the CME would appear on opposite limbs of the Sun in the two coronagraphs. The dotted part of the curve is where the CME would appear as a halo in one of the coronagraphs. A simple inspection of the images would immediately reveal which of the solutions should be chosen and which eliminated. As the separation of the spacecraft increases, the range of observable mass differences also increases. The extrema of the mass difference are related to the normalized mass function by : $(M_{A}-M_{B})^{\ast}=f_{m}(90^{\circ}-\Delta_{sc}).$ (10) Thus when the separation is $0^{\circ}$ the extrema is zero and when the separation is $90^{\circ}$ the extrema are equal to the true total mass. If the difference in our calculated total mass is outside the range of solution for equation 9, then we are observing intensity that is not from the CME. An example of this would be instrumental effects or another solar structure, such as a streamer, that was not removed adequately by the base difference. We applied our method to the eight CMEs shown in Figure 1. For the purposes of comparing the total mass across the COR2-A and B instruments, we use the same IFOV at $4.0R_{\odot}$. We selected the largest events observed by COR2 for spacecraft separation greater than $40^{\circ}$. In table 1, we list the total mass of the CME in COR2 A and B using the POS assumption ($\theta=0^{\circ}$). We then list the true total mass calculated using the CME direction. The longitudinal direction derived for each CME with respect to the Sun-Earth line is listed in the next column. For the majority of the CMEs, the true mass is not significantly different from the larger of the two masses using the POS assumption. Figure 3 shows that the CME mass does not vary significantly between $\pm 20^{\circ}$ from the POS. The studied CMEs are mainly within $\pm 20^{\circ}$ of one of the instrument’s POS. The spacecraft separation is given in table 1. ### 3.1 Comparison to Forward Modeling Results As a means of further validating our analysis, we compare our direction estimates with a completely different approach to estimating the three dimensional position of the CMEs, namely forward modeling. A complete description of the forward modeling method can be found in Thernisien, Howard, and Vourlidas (2006). Briefly, a three dimensional geometric representation of a flux-rope is fitted to the two spacecraft views of a CME at a single time. The direction of the CME is taken as the apex of the flux-rope. The directions from forward modeling for the CMEs in our sample are given in table 1 (Thernisien, Vourlidas, and Howard, 2009). Figure 5 provides a visual comparison between the direction results from our mass method and the forward modeling method. We plot the direction of the CME as calculated using the mass difference (solid line) and the direction found from the forward model (dashed line). We have good agreement between all of the studied CMEs with the exception of the 2008 April 26 event. For this event, the CME appears as a partial halo in COR2-B which results in a limitation to the accuracy of our method. A portion of the CME is behind the occulter and our assumption that we are observing the same mass in both views is not valid. ### 3.2 CME Mass Variation with Height and Time As can be seen in Figures 2 and 4, the total CME mass measurements show a very specific variation with height and time. Namely, the mass increases rapidly when the CME front is within $8R_{\odot}$, and reaches a constant value beyond about $10R_{\odot}$. The same behavior was originally seen in LASCO when only a specific, large scale feature of the CME is measured (e.g., the core Vourlidas et al., 2000). The result for LASCO was treated with caution because the sharpest mass increase occurred in the $5-8R_{\odot}$ range which is the overlapping region between C2 and C3. Vourlidas et al. (2000) suggests that the mass increase could have been due to instrumental differences between C2 and C3 such as calibration, dynamic range, and resolution. However, the COR2 measurements are taken over an uninterrupted field of view with the same telescope and clearly show that the CME mass increases with time and height then reaches a constant value above about $10R_{\odot}$. Therefore, this mass variation with height appears to be a fundamental property of the ejection process. To further quantify this behavior, we have fitted the observed mass-height profiles with the analytical function : $M(h)=M_{c}(1-e^{-h/h_{c}}).$ (11) where $M_{c}$ is the final total mass of the event and $h_{c}$ is the height where the mass reaches $~{}63\%$ of its final mass. The choice of the function was dictated by the shape of the mass curves. Also this function has the desired behavior of approaching a constant value as the height increases. We have not explored other functions and we are wary of employing a more complex expression because we do not yet have any theoretical or physical foundation for the variation of CME mass with height. This is an area where CME modelers and theoreticians could provide some useful insight. Before fitting the data, we de-projected both the heights and the CME mass values using the results in Table 1. We obtained good fits to all eight of the events in our paper (Figure 7). For all events, the scale height ($h_{c}$) is relatively low in the corona at approximately $2R_{\odot}$ and $~{}99\%$ of the final CME mass is reached by $10R_{\odot}$. For all of the events in our sample, the final mass is of the order of $10^{15}g$. The variations in the profiles do not seem to correlate with the speed or the width of the events. It is difficult to reach strong conclusions from our small sample of CMEs taken during a very low period of solar activity. In the future, we plan to investigate the behavior of the CME mass with a larger number of events. However, we are confident that the small variation in the parameters of the fit suggests that we can adopt the average profile of the eight events : $M(h)=15.6(1-e^{-h/2.1})$ (12) as representative of the mass variation with height for a typical CME. Of course, the mass increase is due to material coming up from below the occulting disk. ## 4 DISCUSSION & CONCLUSIONS An implicit assumption in all CME mass calculation methods up to now has been that the mass of the CME is concentrated into a single plane on the POS. However, CMEs are three dimensional structures with a considerable depth along the line of sight. While our two viewpoint method is an improvement on the POS assumption, $\theta=0$, and results in an estimate of the CME direction, it still assumes that the CME mass lies in a plane along that direction. The true width along the LOS remains unknown. But we can easily estimate the error from this assumption by calculating the mass ratio between the CME of zero width and CMEs of various widths. Vourlidas et al. (2000) showed that this simplification could cause the total mass to be underestimated by up to $15\%$. To overcome this limitation, we could use observations at larger heights by combining measurements in SECCHI HI-1 A and B instruments, for example. Or instead of measuring the total mass, we could try to measure the mass of the same feature as long as it can be reliably identified in both COR2 instruments. There are other factors that could affect the accuracy of the mass calculation. An obvious one is the noise in the mass images. We estimate the noise from histograms of empty sky regions. As expected, the empty sky values are a Gaussian distribution around zero. We define the error level as one standard deviation of this distribution. The noise levels in the COR2 telescopes are similar and the error is $\sim 9\times 10^{9}$ g/pixel. This error is comparable to the error in the LASCO mass images (Vourlidas, 2005). The average per pixel signal in the measured CMEs is approximately 5 times the noise level and therefore the noise is insignificant. While the calculation of the CME mass has a low noise level, the selection of the CME region for the mass calculation can effect the total mass significantly. In the quiet corona there are large dense streamers that obscure or interact with the CME. Since we are using two viewpoints, it is often the case where the streamer can be isolated from the CME in one view but cannot in another. An example is the 2008 January 02 event where a streamer is below the CME in the COR2-A image but bisects it in the COR2-B image. This event also has the second largest discrepancy with the forward fitting model ($\sim 8^{\circ}$), so the addition of the streamer may be effecting the direction finding to some extent. In general, however, it is difficult to quantify this type of error since it is not always obvious from the images when a streamer is part of the measured mass. That situation can be best addressed by simultaneous observations from viewpoints inside and outside the ecliptic plane. The error in the CME direction arises from the shape of the function of mass with POS angle (Figure 6). Small changes in the difference between the two masses can cause large differences in the direction, for small spacecraft separations. Assuming a typical mass error estimate of $\sim 15\%$, the direction ambiguity becomes reasonably small ($\lesssim 20^{\circ}$) for separations larger than about $50^{\circ}$. Another point of discussion is the implication of SECCHI results on the single viewpoint mass measurements of past missions. As we have mentioned already, all previous work assumed a POS angle of zero for the CME mass. In table 1, we show the total mass in each instrument for $\theta=0$ and the true CME mass. For the majority of the CMEs, the true mass of the CME is not significantly different from the larger of the two masses using the POS assumption. In other words, most of the mass tends to lie near one of the two POS for the events of our sample. Therefore one has a better chance of observing the true mass of the CME with two viewpoints for spacecraft separations of $40^{\circ}-50^{\circ}$. The lower mass is within a factor of 2 of the true mass for most cases with the exception of the April 26 event which is a factor of 3 lower. However, this is a halo event and such discrepancies are expected. Our results validate the assumptions in Vourlidas et al. (2000) and the modeling results of Lugaz et al. (2005) and suggest that past CME mass measurements are within a factor of two of the true CME mass, except for halo events. We thank A. F. Thernisien for providing the data from his geometric CME model. The SECCHI data is produced by an international consortium of the NRL, LMSAL and NASA GSFC (USA), RAL and U. Bham (UK), MPS (Germany), CSL (Belgium), IOTA and IAS (France). ## References * Billings (1966) Billings, D. E. 1966, A Guide to the Solar Corona (New York: Academic Press) * Brueckner et al (1995) Brueckner, G.E. et al. 1995, Sol. Phys., 162, 291 * Howard et al. (1985) Howard, R. A. et al. 1985, J. Geophys. Res., 90, 8173 * Howard et al. (2008) Howard, R. et al. 2008, Space Sci. Rev., 136, 67 * Jackson (1997) Jackson, J. D. 1997, Classical Electrodynamics (3rd ed.; New York: Wiley) * Kaiser et al. (2008) Kaiser, M. L. et al. 2008, Space Sci. Rev., 136, 5 * Lugaz et al. (2005) Lugaz, N. 2005, ApJ, 627, 1019 * Minnaert (1930) Minnaert, M. 1930, Z. Astrophys., 1, 209 * Morrill et al. (2006) Morrill, J. S. et al. 2006, Sol. Phys., 233, 331 * St. Cyr et al. (2000) St. Cyr, O. C. et al. 2000, J. Geophys. Res., 105, 18169 * Subramanian and Vourlidas (2007) Subramanian, P., & Vourlidas, A. 2007, A&A, 467, 685 * Thernisien, Howard, and Vourlidas (2006) Thernisien, A. F., Howard, R., & Vourlidas, A. 2006, ApJ, 652, 763 * Thernisien, Vourlidas, and Howard (2009) Thernisien, A. F., Vourlidas, A., & Howard, R. 2009, Sol. Phys., in press * van de Hulst (1950) van de Hulst, H. C. 1950, Bull. Astron. Inst. Netherlands, 11, 135 * Vourlidas et al. (2000) Vourlidas, A. et al. 2000, ApJ, 543, 456 * Vourlidas et al. (2002) Vourlidas, A. et al 2002, in Proc. of the 10th Europ. Sol. Phys. Meet. ’Solar Variability: From Core to Outer Frontiers’, Prague, Czech Rep., Wilson, A. (ed), ESA SP-506, Dec. 2002, p. 91 * Vourlidas (2005) Vourlidas, A. in Coronal and Stellar Mass Ejections, IAU Symp. Proc. of the IAU 226, K. Dere, J. Wang, and Y. Yan (eds). Cambridge: Cambridge University Press, 2005., pp.76-76 * Vršnak et al. (2007) Vršnak, B. et al. 2007, A&A, 469, 339 * Yashiro et al. (2004) Yashiro, S. et al. 2004, J. Geophys. Res., 109, A07105, 10.1029/2003JA010282 Table 1: CME Direction and Mass CME | Mass $10^{15}$g | Direction | Separation | HEE Lon ---|---|---|---|--- | B | A | true | mass | model | | B | A 2007 Dec 04 | 2.57 | 2.23 | 2.57 | 68 | 71 | 42.16 | -21.43 | 20.73 2007 Dec 31 | 7.68 | 7.10 | 7.70 | -100 | -91 | 43.97 | -22.79 | 21.17 2008 Jan 02 | 3.59 | 5.29 | 5.29 | -64 | -51 | 44.07 | -22.88 | 21.20 2008 Feb 12 | 3.05 | 4.49 | 4.49 | 110 | 93 | 45.56 | -23.67 | 21.89 2008 Feb 15 | 2.12 | 3.18 | 3.18 | -72 | -60 | 45.64 | -23.68 | 21.97 2008 Mar 25 | 1.27 | 2.86 | 2.87 | -78 | -84 | 47.17 | -23.69 | 23.48 2008 Apr 05 | 1.89 | 2.84 | 2.84 | 117 | 126 | 47.83 | -23.72 | 24.11 2008 Apr 26 | 0.94 | 2.78 | 2.80 | -48 | -21 | 49.51 | -23.95 | 25.56 Figure 1: Mass images of studied events calculated with $\theta=0$. The images are shown with the same scaling. The left image of each pair is from COR2-B while the right is from COR2-A. The dependence of the CME morphology and total mass on the viewing angle is evident in most events. Figure 2: Cross- calibration of total mass measurements from LASCO-C2 (plus), LASCO-C3 (star), SECCHI COR2-A (square) and SECCHI COR2-B (diamond) for CMEs observed on 2007 February 9 (top), 2007 March 21 (middle), and 2007 March 31 (bottom). The good agreement with LASCO C2 and C3 data demonstrates that the COR2 images can be used with confidence for analysis of CME masses. Figure 3: The normalized mass function gives the angular dependence of the total brightness of a single scattering electron normalized to the brightness at $\theta=0$. We can use this function to relate the mass calculated using the POS assumption to the true total mass of the CME. Figure 4: March 25, 2008 calculated total mass ($\theta=0$) as a function of time in COR2-A (square) and COR2-B (diamond). The difference in the calculated mass is the result of using an incorrect angle in our Thomson scattering calculation. We will exploit this difference to derive the direction and true total mass of the CME. Figure 5: Graphical representation of the CME estimated direction for the events in our sample. The dashed lines are the results of our mass method, while the solid lines are obtained from forward modeling (Thernisien, Vourlidas, and Howard, 2009). Figure 6: Mass difference as a function of direction for spacecraft separations of $10^{\circ}$ to $90^{\circ}$ in steps of $10^{\circ}$. Directions where CMEs would appear as halos (dotted) or on opposite sides of the Sun (gray) can be eliminated as possible solutions. We can calculate the true total mass by inverting this function to find the longitudinal direction for a given mass difference and spacecraft separation. Figure 7: The dependence of CME mass on the height of the CME front for the eight events in our sample. The fitted final CME mass and the scale height for each event are also shown.
arxiv-papers
2009-03-25T14:13:06
2024-09-04T02:49:01.405862
{ "license": "Public Domain", "authors": "Robin C. Colaninno, Angelos Vourlidas", "submitter": "Robin Colaninno", "url": "https://arxiv.org/abs/0903.4344" }
0903.4375
# Renormalized Polyakov Loop in the Deconfined Phase of SU(N) Gauge Theory and Gauge/String Duality Oleg Andreev Technische Universität München, Excellence Cluster, Boltzmannstrasse 2, 85748 Garching, Germany L.D. Landau Institute for Theoretical Physics, Kosygina 2, 119334 Moscow, Russia ###### Abstract We use gauge/string duality to analytically evaluate the renormalized Polyakov loop in pure Yang-Mills theories. For $SU(3)$, the result is in a quite good agreement with lattice simulations for a broad temperature range. ###### pacs: 12.38.Lg, 12.90.+b ††preprint: SPAG-A1/09 ## I Introduction It is well known that a pure $SU(N)$ gauge theory at high temperature undergoes a phase transition. This phase transition is of special interest because of many its aspects can be characterized precisely pol . In particular, the order parameter is given by the Polyakov loop $L(T)=\frac{1}{N}\text{tr Pexp}\Bigl{[}ig\int_{0}^{1/T}dt\,A_{0}\Bigr{]}\,,$ (1) where the trace is over the fundamental representation, $t$ is a periodic variable of period $1/T$, with $T$ the temperature, $g$ is a gauge coupling constant, and $A_{0}$ is a vector potential in the time direction. The usual interpretation of (1) is as a phase factor associated to the propagation of an infinitely heavy test quark in the fundamental representation of the gauge group. Until recently, the lattice formulation, still struggling with limitations and system errors, and effective field theories were the main computational tools to deal with non-weakly coupled gauge theories. The Polyakov loop was also intensively studied (see, for example, pis-rev and references therein). The situation changed drastically with the invention of the AdS/CFT correspondence malda1 that resumed interest in another tool, string theory. In this note we continue a series of recent studies az1 ; az2 ; a-pis devoted to a search for an effective string description of pure gauge theories. In az1 , the model was presented for computing the heavy quark and multi-quark potentials at zero temperature. Subsequent comparison white with the available lattice data has made it clear that the model should be taken seriously. Later, this model was extended to finite temperature. The results obtained for the spatial string tension az2 and the thermodynamics a-pis are remarkably consistent with the lattice, too. As is known, QCD is a very rich theory supposed to describe the whole spectrum of strong interaction phenomena. The question naturally arises: How well does the model describe other aspects of quenched QCD? Here, we attempt to analytically evaluate the Polyakov loop as an important step toward answering this question az3 . In addition, a good motivation for this test is lattice data revealed recently by gupta . Before proceeding to the detailed analysis, let us set the basic framework. As in az1 ; az2 ; a-pis , we take the following ansatz for the five-dimensional background geometry $ds^{2}=G_{nm}dX^{n}dX^{m}=R^{2}w\left(fdt^{2}+d\vec{x}^{2}+\frac{1}{f}dz^{2}\right)\,,\\\ w(z)=\frac{\text{e}^{\mathfrak{s}z^{2}}}{z^{2}}\,,\quad f(z)=1-\bigl{(}\tfrac{z}{z_{\text{\tiny T}}}\bigr{)}^{4}\,,\phantom{=\frac{\text{e}^{\mathfrak{s}z^{2}}}{z^{2}}}$ (2) where $z_{\text{\tiny T}}=1/\pi T$. $\mathfrak{s}$ is a deformation parameter whose value can be fixed from the critical temperature s . We take a constant dilaton and discard other background fields. In discussing the Wilson and Polyakov loops within the gauge/string duality lit , one first chooses a contour ${\cal C}$ on a four-manifold which is the boundary of a five-dimensional manifold. Next, one has to study fundamental strings on this manifold such that the string world-sheet has ${\cal C}$ as its boundary. In the case of interest, ${\cal C}$ is an interval between $0$ and $1/T$ on the $t$-axis. The expectation value of the Polyakov loop is schematically given by the world-sheet path integral $\langle\,L(T)\,\rangle=\int DX\,\text{e}^{-S_{w}}\,,$ (3) where $X$ denotes a set of world-sheet fields. $S_{w}$ is a world-sheet action. In principle, the integral (3) can be evaluated approximately in terms of minimal surfaces that obey the boundary conditions. The result is written as $\langle\,L(T)\,\rangle=\sum_{n}w_{n}\exp[-S_{n}]$, where $S_{n}$ means a renormalized minimal area whose weight is $w_{n}$. ## II Calculating the Polyakov Loop Given the background metric, we can attempt to calculate the expectation value of the Polyakov loop by using the Nambu-Goto action for $S_{w}$ in (3) $S=\frac{1}{2\pi\alpha^{\prime}}\int d^{2}\xi\,\sqrt{\det\,G_{nm}\partial_{\alpha}X^{n}\partial_{\beta}X^{m}\vphantom{\bigl{(}\bigr{)}}}\,.$ (4) Here $G_{nm}$ is the background metric (2). In the case of interest, this action describes a fundamental string stretched between the test quark on ${\cal C}$ (at $z=0$) and the horizon at $z=z_{\text{\tiny T}}$. Since we are interested in static configurations, we choose $\xi_{1}=t$, $\xi_{2}=z$. This yields $S=\frac{\mathfrak{g}}{\pi T}\int^{z_{\text{\tiny T}}}_{0}dz\,w\sqrt{1+f(\vec{x}\,^{\prime})^{2}}\,,$ (5) where $\mathfrak{g}=\frac{R^{2}}{2\alpha^{\prime}}$. A prime stands for a derivative with respect to $z$. Now it is easy to find the equation of motion for $\vec{x}$ $\biggl{[}wf\vec{x}\,^{\prime}/\sqrt{1+f(\vec{x}\,^{\prime})^{2}}\biggr{]}^{\prime}=0\,.$ (6) It is obvious that Eq.(6) has a special solution $\vec{x}=const$ that represents a straight string stretched between the boundary and the horizon. Since this solution makes the dominant contribution, as seen from the integrand in (5), we won’t dwell on other solutions here. Having found the solution, we can now compute the corresponding minimal area. Since the integral (5) is divergent at $z=0$ due to the factor $z^{-2}$ in the metric, we regularize it by imposing a cutoff $\epsilon$ $S_{\text{\tiny R}}=\frac{\mathfrak{g}}{\pi T}\int^{z_{\text{\tiny T}}}_{\epsilon}dz\,w\,.$ (7) Subtracting the $\frac{1}{\epsilon}$ term (quark mass) and letting $\epsilon=0$, we get a renormalized area $S_{0}=\frac{\mathfrak{g}}{\pi T}\int^{z_{\text{\tiny T}}}_{0}dz\,\Bigl{(}w-\frac{1}{z^{2}}\Bigr{)}+c\,,$ (8) where $c$ is a normalization constant which is scheme-dependent. Next, we can perform the integral over $z$. The result is $S_{0}=\mathfrak{g}\biggl{(}\sqrt{\pi}\frac{T_{c}}{T}\text{Erfi}\Bigl{(}\frac{T_{c}}{T}\Bigr{)}+1-\text{e}^{(T_{c}/T)^{2}}\biggr{)}+c\,.$ (9) In this formula $T_{c}$ is given by $T_{c}=\sqrt{\mathfrak{s}}/\pi$ az2 . Combining the weight factor with the normalization constant as $\mathfrak{c}=\ln w_{0}-c$, we find $L(T)=\exp\biggl{[}\mathfrak{c}-\mathfrak{g}\biggl{(}\sqrt{\pi}\frac{T_{c}}{T}\text{Erfi}\Bigl{(}\frac{T_{c}}{T}\Bigr{)}+1-\text{e}^{(T_{c}/T)^{2}}\biggr{)}\biggr{]}\,,$ (10) with $\text{Erfi}(z)$ the imaginary error function. This is our main result. ## III Numerical Results and Phenomenological Prospects It is of great interest to compare the temperature dependence of (10) with other results for the high temperature phase of $SU(N)$ gauge theory. In doing so, we start with lattice QCD. Clearly, $N=3$ is of primary importance. In Fig.1 a comparison is shown with the recent data of gupta . We see that our model is in a quite good agreement with the lattice for a broad temperature range $1.05\,T_{c}\lesssim T\lesssim 20\,T_{c}$. The maximum discrepancy occurred at $T=1.05\,T_{c}$ is of order 15%. It rapidly decreases with temperature reaching 2% at $T=2.2\,T_{c}$ and becoming almost negligible up to $20\,T_{c}$. Then, it starts to grow back again. For completeness, we can fit the value of $\mathfrak{g}$ to be $0.72$ that significantly improves Figure 1: The renormalized Polyakov loop in $SU(3)$ gauge theory. The solid blue curve corresponds to (10) with $\mathfrak{g}=0.62$ as fixed from the heavy quark potential at zero T in white . The dashed green curve represents the ”best fit” with $\mathfrak{g}=0.72$. In both cases, the value of $\mathfrak{c}$ is set to $0.10$. The dots are from lattice simulations of gupta . The red dots are for $N_{\tau}=4$, while the black dots are for $N_{\tau}=8$. We do not display any error bars because they are quite small, comparable to the size of the symbols. accuracy. For example, at $T=1.05\,T_{c}$ it becomes of order 6%. One possible explanation for the better fit is that we have evaluated (3) classically (in terms of strings). If we take into account semi-classical corrections, then the value of $\mathfrak{g}$ gets renormalized. For practical purposes, the expression (10) looks somewhat awkward. Following a-pis , we expand $S_{0}$ and $L$ in powers of $(T_{c}/T)^{2}$. If we ignore all higher terms, then a final result can be written in two simple forms: $L(T)\approxeq\exp\biggl{[}\mathfrak{c}-\mathfrak{g}\Bigl{(}\frac{T_{c}}{T}\Bigr{)}^{2}\biggr{]}\,,$ (11) or $L(T)\approxeq\text{e}^{\mathfrak{c}}\biggl{(}1-\mathfrak{g}\Bigl{(}\frac{T_{c}}{T}\Bigr{)}^{2}\biggr{)}\,.$ (12) In Fig.2 we have plotted the results. As can be seen, above $2\,T_{c}$ the discrepancy between the expression (10) and approximations Figure 2: A comparison of different $L(T)$ curves for $SU(3)$ gauge theory. As in Fig.1, the solid blue curve corresponds to (10) and the dots are from lattice simulations of gupta . The blue dashed curve corresponds to the exponential law (11). The black dot-dashed curve corresponds to the power law (12). In all the cases, $\mathfrak{g}=0.62$ and $\mathfrak{c}=0.10$. We display error bars only if they are comparable to the size of the symbols. (11)-(12) is negligible. At lower T the approximation (11) (exponential law) is poor. It shows a significant deviation from the lattice. In particular, the discrepancy occurred at $T=1.05\,T_{c}$ is of order 27%. On the other hand, the agreement between the approximation (12) (power law) and the lattice is spectacular. For the temperature range $1.05\,T_{c}\lesssim T\lesssim 20\,T_{c}$ the power law provides a reliable approximation to lattice QCD with accuracy better than 5%! Moreover, one can use it to describe all available lattice data of gupta at lower $T$. Then, the maximum discrepancy occurred at the lowest available value $T=1.012\,T_{c}$ is of order 7%. It is worth noting that the exponential law has been suggested in arriola based on a dimension-two condensate $\langle A^{2}\rangle$ 2con . Such a condensate as well as its possible links to the UV renormalon and $1/Q^{2}$ corrections got intensively discussed in the QCD literature viz . As was first shown in 1/q2 , the deformation parameter $\mathfrak{s}$ of the background geometry (2) is tied into the appearance of the quadratic corrections. It is not, therefore, surprising that we have recovered (11) in our calculations. Interestingly, the power law (12) is very similar to that observed for the pressure in pisa . Indeed, for $T\gtrsim 1.2\,T_{c}$ the pressure is simply $p/T^{4}\approx f_{\text{\tiny pert}}(1-(T_{c}/T)^{2})$. ## IV Conclusions In this note we have evaluated the Polyakov loop using the now standard ideas motivated by gauge/string duality. A key point is the use of the background metric (2) which is singled out by the earlier works az1 ; az2 ; a-pis . (Note that there is no need for any free parameters except a scheme-dependent normalization constant $\mathfrak{c}$.) The overall conclusion is that the same background metric results in a very satisfactory description of the Polyakov loop as well. Of course, we still have a lot more to learn before answering the question posed at the beginning of this note. Acknowledgments We would like to thank R.D. Pisarski and P. Weisz for useful discussions, and S. Hofmann for reading the manuscript. This work is supported in part by DFG ”Excellence Cluster” and the Alexander von Humboldt Foundation under Grant No. PHYS0167. ## References * (1) A.M. Polyakov, Phys.Lett.B 72, 477 (1978); G.’t Hooft, Nucl.Phys.B 138, 1 (1978); L. Susskind, Phys.Rev.D 20, 2610 (1979); B. Svetitsky and L.G. Yaffe, Nucl.Phys.B 210, 423 (1982). * (2) R.D. Pisarski, ”QCD Phase Diagram”, lectures presented at the ”47 Internationale Universitätswochen für Theoretische Physik”, Schladming, Austria, March 2009; see also http://physik.uni-graz.at/itp/iutp/iutp-09/ LectureNotes/Pisarski/pisarski-2.pdf. * (3) J.M. Maldacena, Adv.Theor.Math.Phys. 2, 231 (1998); S.S. Gubser, I.R. Klebanov, and A.M. Polyakov, Phys. Lett. B 428, 105 (1998); E. Witten, Adv.Theor.Math. Phys. 2, 253 (1998). * (4) O. Andreev and V.I. Zakharov, Phys.Rev.D 74, 025023 (2006); O. Andreev, Phys.Rev.D 78, 065007 (2008). * (5) O. Andreev and V.I. Zakharov, Phys.Lett.B 645, 437 (2007); O. Andreev, Phys.Lett.B 659, 416 (2008). * (6) O. Andreev, Phys.Rev.D 76, 087702 (2007). * (7) C.D. White, Phys.Lett.B 652, 79 (2007). * (8) See also the earlier work which deals with numerical estimates, O. Andreev and V.I. Zakharov, JHEP 04, (2007) 100. * (9) S. Gupta, K. Huebner, and O. Kaczmarek, Phys.Rev. D77, 034503 (2008). * (10) Alternatively, it may be fixed from the heavy quark potentials az1 ; white . * (11) While a significant literature on the Wilson loops has grown, there has been relatively little investigation of the Polyakov loop. For some developments, see however E. Witten, Adv.Theor.Math.Phys. 2, 505 (1998); A. Hartnoll and S. Prem Kumar, Phys.Rev.D74, 026001 (2006); M. Headrick, Phys.Rev.D77, 105017 (2008). * (12) E. Megias, E. Ruiz Arriola, and L.L. Salcedo, JHEP 0601, 073 (2006). * (13) L.S. Celenza and C.M. Shakin, Phys.Rev.D 34, 1591 (1986). * (14) For a review, see V.I. Zakharov, Nucl.Phys.Proc.Suppl. 74, 392 (1999) and references therein. * (15) O. Andreev, Phys.Rev.D 73, 107901 (2006). * (16) R.D. Pisarski, Prog.Theor.Phys.Suppl.168, 276 (2007).
arxiv-papers
2009-03-25T15:36:43
2024-09-04T02:49:01.412870
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Oleg Andreev", "submitter": "Oleg Andreev", "url": "https://arxiv.org/abs/0903.4375" }
0903.4440
# To the question of the integration of Plebansky Equation A. N. Leznov111e-mail: andrey@buzon.uaem.mx Universidad Autonoma del Estado de Morelos, CCICAp,Cuernavaca, Mexico ###### Abstract It is shown that corresponding to Plebansky equation of symmetry posses the infinite set of solutions, which we present in explicit form. This fact leads to conclusion about possibility to find series solutions of the Plebansky equation in analytic form. Some classes of explicit solution are presented. ## 1 Introduction The goal of the present paper is to investigate Plebansky equation on the subject of its integrability. The Plebansky equation is non homogeneous complex Monge-Ampher equation $Det_{n}(\phi_{x_{i},\bar{x}_{j}})=1$ (1) in the case $n=2$. $\phi$ is unknown function of $2n$ independent variables $x_{i},\bar{x}_{j}$. Equation of Plebansky arise in self-dual gravity [1] and we will use it in the form $v_{y,\bar{y}}v_{z,\bar{z}}-v_{y,\bar{z}}v_{z,\bar{y}}=1$ (2) which will call as a basic form of this equation. At this place we would like to notice that the general solution of homogeneous Monge-Ampher equation (with zero instead of the unity in the right side of (1)), was recently found in implicit form in [3]. We remind to the reader some known facts from the theory of differential equations [2]. With each system of differential equations it is connected symmetry system of equations, which arise after differentiation of the initial system by some parameter and denotation such obtained derivative $\dot{a}=A$ as a new unknown function. If linear system of such equations have exact solution on the class of solutions of the initial system the last one is exactly integrable. This means that it is possible to present its solution (in explicit or implicit form) depending on necessary number of arbitrary functions sufficient for the statement the problem of Cauchy-Kovalevskai. Such solution is called as the general one. If there exist series solutions of the symmetry equation then initial system poses the same number of exact solutions, but each solution is not the general one. In the present paper we would like to show that in the case of Plebansky equation second possibility take place. It may be found infinite series solutions of its symmetry equation but not the general one. Thus it is not possible to find general solution of this equation in analytic form. But infinite number of its exact solutions exist and the goal of the present paper consists in description the ways for obtaining them. ## 2 Preliminary manipulations Now we would like to rewrite (2) in equivalent form $(v_{\bar{y}}v_{z,\bar{z}}-v_{\bar{z}}v_{z,\bar{y}})_{y}+(v_{y,\bar{y}}v_{\bar{z}}-v_{y,\bar{z}}v_{\bar{y}})_{z}=2$ (3) $(v_{y}v_{z,\bar{z}}-v_{z}v_{\bar{z},y})_{\bar{y}}+(v_{y,\bar{y}}v_{z}-v_{\bar{y},z}v_{y})_{\bar{z}}=2$ (4) The last equations (3) and (4) can be partially resolved as $v_{\bar{y}}v_{z,\bar{z}}-v_{\bar{z}}v_{z,\bar{y}}=\theta_{z}+y,\quad v_{y,\bar{y}}v_{\bar{z}}-v_{y,\bar{z}}v_{\bar{y}}=-\theta_{y}+z$ $v_{y}v_{z,\bar{z}}-v_{z}v_{\bar{z},y}=\theta_{\bar{z}}+\bar{y},,\quad v_{y,\bar{y}}v_{z}-v_{\bar{y},z}v_{y}=-\theta_{\bar{y}}+\bar{z}$ It is important to notice that function $\theta$ satisfy the the symmetry equation corresponding to Plebansky one [2]. Resolving the last equalities with respect to $v_{\bar{y}},v_{\bar{z}}$ (or to $v_{y},v_{z}$), taking into account the Plebansky equation (2) for $v$ we obtain $v_{\bar{y}}=v_{y,\bar{y}}\theta_{z}-v_{z,\bar{y}}\theta_{y}+zv_{z\bar{y}}+yv_{y,\bar{y}},\quad v_{\bar{z}}=v_{y,\bar{z}}\theta_{z}-v_{z,\bar{z}}\theta_{y}+zv_{z\bar{z}}+yv_{y,\bar{z}}$ (5) $v_{y}=v_{y,\bar{y}}\theta_{\bar{z}}-v_{y,\bar{z}}\theta_{\bar{y}}+\bar{z}v_{y,\bar{z}}+\bar{y}v_{y,\bar{y}},\quad v_{z}=v_{z,\bar{y}}\theta_{\bar{z}}-v_{z,\bar{z}}\theta_{\bar{y}}+\bar{z}v_{z\bar{z}}+\bar{y}v_{z,\bar{y}}$ (6) Equating second mixed derivatives of $v$ with respect to bar variables (or not to the bar ones), we conclude that function $\theta$ in both cases is the solution of the symmetry equation corresponding to (2) namely $v_{\bar{y},y}\theta_{z,\bar{z}}+\theta_{\bar{y},y}v_{z,\bar{z}}-v_{y,\bar{z}}\theta_{\bar{y},z}-\theta_{y,\bar{z}}v_{\bar{y},z}=0$ (7) ## 3 Recurrent formula for solution of the symmetry equation Rewriting (7) in two equivalent forms $v_{\bar{y},y}\theta_{z}-v_{\bar{y},z}\theta_{y}=\tilde{\theta}_{\bar{y}},\quad v_{\bar{z},y}\theta_{z}-v_{\bar{z},z}\theta_{y}=\tilde{\theta}_{\bar{z}}$ (8) $v_{\bar{y},y}\theta_{\bar{z}}-v_{\bar{z},y}\theta_{\bar{y}}=\tilde{\theta}_{y},\quad v_{\bar{y},z}\theta_{\bar{z}}-v_{\bar{z},z}\theta_{\bar{y}}=\tilde{\theta}_{z}$ (9) By the same way as it was done in the previous section it is possible to check that $\tilde{\theta}$ functions from (8),(9) satisfy the symmetry equation (7). Obvious solution of symmetry equation is derivatives of $v$ with respect to 4 independent arguments of the problem $y,z,\bar{y},\bar{z}$. Thus with help of (8),(9) it is possible to construct infinite serie solutions of symmetry equation (compare with [LYM]). ### 3.1 Static case In this subsection we would like explain the case when symmetry equation has a exact solution and how this connected with the integrable property of the initial system. Let us consider ”time independent” configurations, when $v=v(z+\bar{z},y,\bar{y})$. In this case the Plebanski equation (2) and main symmetry equation (5) are reduced correspondingly $v_{y,\bar{y}}v_{z,z}-v_{y,z}v_{z,\bar{y}}=1$ $v_{\bar{y},y}\theta_{z}-v_{\bar{y},z}\theta_{y}=\tilde{\theta}_{\bar{y}},\quad v_{z,y}\theta_{z}-v_{z,z}\theta_{y}=\tilde{\theta}_{z}$ Let us sick solution of the symmetry equation in terms of three independent coordinates $(v_{z},y,\bar{y})$. The last symmetry system in these coordinates looks as $\theta_{v_{z}}v_{z,\bar{y}}+\theta_{\bar{y}}=\tilde{\theta}_{v_{z}}-v_{z,\bar{y}}\tilde{\theta},\quad\theta_{v_{z}}v_{z,z}=-v_{z,z}\tilde{\theta}_{y}$ From which follows that functions $\tilde{\theta},\theta$ are connected by the linear system of equations $\tilde{\theta}_{\bar{y}}=\theta_{v_{z}},\quad\tilde{\theta}_{v_{z}}=-\theta_{y}$ which is equivalent to three dimensional Laplace equation. Thus in the static case the symmetry equation possesses the general solution and thus in this case Plebansky equation is exactly integrable. Below we present its general solution in implicit form $v_{\bar{y}}=L_{v_{z}}(v_{z},y,\bar{y})\quad z=L_{y}(v_{z},y,\bar{y})$ (10) where function $L$ satisfy Laplace equation in three dimension $L_{v_{z},v_{z}}+L_{y,\bar{y}}=0$. General solution of Laplace equation in three dimension depend on two arbitrary functions of two arguments. And thus constructed above is a general solution of Plebansky equation in static case. This solution may be obtained directly. Indeed Plebansky equation in this case may be rewritten as $(v_{\bar{y}})_{y}(v_{z})_{z}-(v_{z})_{y}(v_{\bar{y}})_{z}=1$ and functions $(v_{\bar{y}},v_{z})$ may be considered as transformed impulse and coordinate with unity Poisson bracket between them. This system is resolved by canonical transformation with generating function $G(v_{z},y,\bar{y})$ by usual formulae $v_{\bar{y}}=G_{v_{z}}(v_{z},y,\bar{y}),\quad z=G_{y}(v_{z},y,\bar{y})$ From condition of equality of the second mixed derivatives of $v$ function we conclude that $G$ satisfy Laplace equation in three dimension. This is exactly (10) above. ## 4 General strategy and example explaining it General (5) is the system of two equations on two unknown functions $v,\theta$. As a consequence we know that $v$ function satisfy Plebansky equation and $\theta$ function the symmetry one. But all solutions of symmetry equation are enumerated in the previous section. And thus if we change $\theta$ in (5) on one of solution of the previous section we will obtain the self consistent system of two equations only on one unknown function $v$. Solution of this system (if it will be possible to find it) will be solution of Plebansky equation corresponding to such chose solution of symmetry equation. To show that such idea is not mean less we at first consider simple example of (5) under the chose $\theta=v_{\bar{y}}$. But result of solution of Plebansky equation will be absolutely non trivial one. We rewrite (5) $v_{\bar{y}}=(z\frac{\partial}{\partial z}+y\frac{\partial}{\partial y})v_{\bar{y}},\quad v_{\bar{z}}=1+(z\frac{\partial}{\partial z}+y\frac{\partial}{\partial y})v_{\bar{z}}$ Two independent ordinary differential equations have obvious solution $v_{\bar{y}}=(yz)^{1\over 2}X_{\bar{y}}(d,\bar{z},\bar{y}),\quad v_{\bar{z}}=1+(yz)^{1\over 2}X_{\bar{z}}(d,\bar{z},\bar{y}),\quad d\equiv{z\over y}$ Further $v_{\bar{y},y}={1\over 2}d^{1\over 2}X_{\bar{y}}-d^{3\over 2}X_{\bar{y},d},\quad v_{\bar{y},z}={1\over 2}d^{-1\over 2}X_{\bar{y}}+d^{1\over 2}X_{\bar{y},d}$ $v_{\bar{z},y}={1\over 2}d^{1\over 2}X_{\bar{z}}-d^{3\over 2}X_{\bar{z},d},\quad v_{\bar{z},z}={1\over 2}d^{-1\over 2}X_{\bar{z}}+d^{1\over 2}X_{\bar{z},d}$ And equation of Plebansky (2) takes the form $X_{\bar{y}}X_{\bar{z},D}-X_{\bar{z}}X_{\bar{y},D}=1,\quad D\equiv\ln d$ (11) Resolving of the last equation is connected with second order ordinary differential equations of the form $X_{D,D}=F(X,D)$ ($F$ arbitrary functions of its arguments). Indeed solution of this equation depends on two arbitrary parameters $c_{1},c_{2}$ and may be represented as some function depending on 3 arguments $X=X(D,c_{1},c_{2})$. Let us differential equation for $X$ function argumentson parameters $c_{i}$. We have $X_{D,D,c_{i}}=F_{X}(X,D)X_{c_{i}}$. From the last equality we conclude $(X_{D,c_{1}}X_{c_{2}}-X_{D,c_{2}}X_{c_{1}})_{D}=0$. We will assume that this value is equal to unity (this is always possible to do by corresponding canonical transformation). Now we will consider $c_{1},c_{2}$ as arbitrary functions of the arguments $\bar{y},\bar{z}$. Then equation (11) Looks as $(X_{c_{1}}X_{c_{2},D}-X_{c_{2}}X_{c_{1},D})((c_{1})_{\bar{y}}(c_{2})_{\bar{z}}-(c_{1})_{\bar{z}}(c_{2})_{\bar{y}})=((c_{1})_{\bar{y}}(c_{2})_{\bar{z}}-(c_{1})_{\bar{z}}(c_{2})_{\bar{y}})=1$ Thus obtained solution of initial Plebansky equation depend on two arbitrary function $F(X,D)$ defined arbitrary equation of the second order and generating function of canonical transformation resolving the last equation for $c_{1},c_{2}$ functions. We present the second way for solution equation (11). Let us consider $X_{D},X$ as canonical transformed coordinate and impulse variable and $\bar{z},\bar{y}$ as the same initial ones. Then generating function of canonical transformation $W=W(X,\bar{y},D)$ satisfy the equations $X_{D}=W_{X}(X,\bar{y},D),\quad\bar{z}=W_{\bar{y}}(X,\bar{y},D)$ From the second equation we have $X_{D}=-{W_{\bar{y},D}\over W_{\bar{y},X}}$ and after substitution into the first equation we obtain $(W_{D}+{W_{X}^{2}\over 2})_{\bar{y}}=0,\quad W_{D}+{W_{X}^{2}\over 2}=F(X,D)$ The second one is Hamilton-Jacobi equation of the particle motion in potential field $V=F(X,D)$, It leads to second order differential equation considered above. Hamilton-Jacobi equation reduce the number of independent variables in generating function $W$ from 3 up to 2. And thus solution of Plebansky equation is determined by two functions $W,F$ each one of two independent variables. ## 5 Equation of Plebansky in non usual variables Let us introduce notations $R=\ln v_{\bar{y}}+\ln v_{\bar{z}},\Delta=\ln v_{\bar{y}}-\ln v_{\bar{z}}$. Or in other words $v_{\bar{y}}=\exp({R+\Delta\over 2}),v_{\bar{z}}=\exp({R-\Delta\over 2})$. In these notations the pair of equations (LABEL:LS) take the form $R_{y},\theta_{z}-R_{z}\theta_{y}+zR_{z}+yR_{y}=2,\quad\Delta_{y}\theta_{z}-\Delta_{z}\theta_{y}+z\Delta_{z}+y\Delta_{y}=0$ (12) In the last equations let us pass from independent variables $y,z$ to independent variables $\theta,d={z\over y}$. Corresponding necessary formulae are presented below $y=Y(\theta,d,\bar{y},\bar{z}),\quad 1=Y_{\theta}\theta_{y}-Y_{d}{z\over y^{2}},\quad 0=Y_{\theta}\theta_{z}+Y_{d}{1\over y}$ (13) $R_{y}==R_{\theta}\theta_{y}-R_{d}{z\over y^{2}},\quad R_{z}=R_{\theta}\theta_{z}+R_{d}{1\over y}$ and the same formulae for derivatives of the $\Delta$ function. In all relations above its necessary to keep in mind that all function under consideration depend also on bar arguments $\bar{y},\bar{z}$. Such dependence will be taken into account on some forward steps of calculations. In variables $\theta,d$ the system (12) looks as $(Y^{2})_{\theta}-Y^{2}R_{\theta}=-R_{d},\quad(Y^{2}e^{-R})_{\theta}=(e^{-R})_{d},\quad Y^{2}={\Delta_{d}\over\Delta_{\theta}}$ (14) To do the last equality more symmetrical to $y,z$ variables let us multiply the last one on $d={z\over y}$. We have in a consequence $dY^{2}=yz={d\Delta_{d}\over\Delta_{\theta}}={\Delta_{D}\over\Delta_{\theta}},\quad D=\ln d$ (15) Now we would like to satisfy equation of Plebansky $v_{y,\bar{y}}=({R_{y}+\Delta_{y}\over 2})\exp({R+\Delta\over 2}),\quad v_{z,\bar{y}}=({R_{z}+\Delta_{z}\over 2})\exp({R+\Delta\over 2})$ $v_{y,\bar{z}}=({R_{y}-\Delta_{y}\over 2})\exp({R-\Delta\over 2}),\quad v_{z,\bar{z}}=({R_{z}-\Delta_{z}\over 2})\exp({R-\Delta\over 2})$ And thus the equation of Plebansky looks as $e^{R}(R_{z}\Delta_{y}-R_{y}\Delta_{z})=2$ In the last equation let us pass to variables $\theta,d$ with the help of above formulae. We obtain $R_{d}\Delta_{\theta}-R_{\theta}\Delta_{d}=e^{-R}(Y^{2})_{\theta}$ Let us compare the last equation with obtained above (14) ones. As a direct corollary we have $e^{-R}=-\Delta_{\theta}$ (16) The last relations have as a direct consequence two first relations (14). In all calculations above no information about dependence of all functions involved with respect to bar arguments was not used. Now let use condition of equality of the second mixed derivatives of $v$ function with respect to $\bar{y},\bar{z}$ arguments in notations introduced above. $(\exp({R+\Delta\over 2}))_{\bar{z}}=(\exp({R-\Delta\over 2}))_{\bar{y}},\quad\exp\Delta(R_{\bar{z}}+\Delta_{\bar{z}})=(R_{\bar{y}}-\Delta_{\bar{y}})$ But functions $R,\Delta$ are connected by (16) and function $\Delta$ depends in its turn on $\theta$ and thus terms with derivatives on bar arguments look as (we present left hand side term) $-(\ln\Delta_{\theta})_{\bar{z}}+\Delta_{\bar{z}}+(-(\ln\Delta_{\theta})_{\theta}+\Delta_{\theta})\theta_{\bar{z}}$ (17) After some computations using (15) we come to equation,which function $\Delta$ satisfy $e^{5\Delta}((e^{-\Delta})_{\theta,\bar{z}}(e^{-\Delta})_{\theta,d}-(e^{-\Delta})_{\theta,\theta}(e^{-\Delta})_{\bar{z},d})=(e^{\Delta})_{\theta,\bar{y}}(e^{\Delta})_{\theta,d}-(e^{\Delta})_{\theta,\theta}(e^{\Delta})_{\bar{y},d}$ (18) In the case when symmetry function depends only from non bar variables equation (18) looks much more simple (in (17) $\theta_{\bar{z}}=\theta_{\bar{y}}=0$) $e^{3\Delta}(e^{-\Delta})_{\theta,\bar{z}}=(e^{\Delta})_{\theta,\bar{y}}$ This equation is equivalent to equation considered in section 4. It will be explained in one of sections below. After introduction new function $\theta=\Theta(\Delta,d,\bar{y},\bar{z})$ it looks as $e^{\Delta}(\Theta_{\Delta,\Delta}\Theta_{d,\bar{z}}-\Theta_{\Delta,d}\Theta_{\Delta,\bar{z}}+\Theta_{\Delta}\Theta_{d,\bar{z}})=\Theta_{\Delta,\Delta}\Theta_{d,\bar{y}}-\Theta_{\Delta,d}\Theta_{\Delta,\bar{y}})-\Theta_{\Delta}\Theta_{d,\bar{y}}$ (19) or in variables $d=D(\Delta,\theta,\bar{y},\bar{z})$ it looks as $e^{\Delta}Det_{3}\pmatrix{D_{\bar{z}}&D_{\Delta}&D_{\theta}\cr D_{\Delta,\bar{z}}&D_{\Delta,\Delta}+D_{\Delta}&D_{\Delta\theta}\cr D_{\theta,\bar{z}}&D_{\theta,\Delta}&D_{\theta,\theta}\cr}=Det_{3}\pmatrix{D_{\bar{y}}&D_{\Delta}&D_{\theta}\cr D_{\Delta,\bar{y}}&D_{\Delta,\Delta}-D_{\Delta}&D_{\Delta\theta}\cr D_{\theta,\bar{y}}&D_{\theta,\Delta}&D_{\theta,\theta}\cr}$ (20) Each of three equations above are equivalent to the initial Plebansky equation (2). ### 5.1 Equation (19) in the integral motion form Let us introduce the following notation the operators of the differentiations $L^{\pm}=e^{{\Delta\over 2}}{\frac{\partial}{\partial\bar{z}}}\pm e^{-{\Delta\over 2}}{\frac{\partial}{\partial\bar{y}}},\quad L^{0}={\frac{\partial}{\partial\Delta}}$ with the obvious commutation relations $[L^{0},L^{\pm}]={1\over 2}L^{\mp},\quad[L^{+},L^{-}]=0$ (these are commutation relation of algebra of two dimension plane). In these notations equation (19) may be rewritten as $\Theta_{\Delta,\Delta}(L^{-}\Theta)_{d}+2\Theta_{\Delta}(L^{-}\Theta_{d})_{\Delta}-2\Theta_{\Delta}(L^{-}\Theta_{\Delta})_{d}-\Theta_{\Delta,d}(L^{-}\Theta_{\Delta})=0$ Or after dividing on $(\Theta_{\Delta})^{{1\over 2}}$ and trivial regrouping of the terms we obtain $((\Theta_{\Delta})^{{1\over 2}}(L^{-}\Theta_{d}))_{\Delta}=((\Theta_{\Delta})^{{1\over 2}}(L^{-}\Theta_{\Delta}))_{d}$ (21) Or (19) may be rewritten in integral of motion form. We remind the reader that all equations (18),(19), (20) where obtained from the equality of the derivatives on the bar variables. ## 6 Some examples of particular solutions In this section we present some particular solutions of equations (19) or equivalent to it (18), (20). From this consideration it will be clear that these equation leads indeed to solution of initial Plebansky equation. ### 6.1 The case when symmetry function do not depend on bar variables From explicit form of symmetry equation of the second section it is clear that simplest obvious its solution is $\theta=\theta(y,z)$. Equation describing this situation are the following ones $e^{3\Delta}(e^{-\Delta})_{\theta,\bar{z}}=(e^{\Delta})_{\theta,\bar{y}},\quad{\Delta_{d}\over\Delta_{\theta}}=Y^{2}(\theta,D)=yz$ From the second equation that function $e^{\Delta}$ really is the function of only three variables $\bar{y},\bar{z},g(\theta,D)$. Let us seek solution of the first equation in a form $e^{\Delta}=-{X_{\bar{y}}\over X_{\bar{z}}}$ where $X=X(\bar{y},\bar{z},g(\theta,D))$. After such substitution first equation takes the form $({X_{\bar{y}}\over X_{\bar{z}}})^{3}({X_{\bar{y},g}X_{\bar{z}}-X_{\bar{z},g}X_{\bar{y}}\over X^{2}_{\bar{y}}})_{\bar{z}}=({X_{\bar{y},g}X_{\bar{z}}-X_{\bar{z},g}X_{\bar{y}}\over X^{2}_{\bar{z}}})_{\bar{y}}$ From the last equality it follows immediately $X_{\bar{y},g}X_{\bar{z}}-X_{\bar{z},g}X_{\bar{y}}=F(X,g)\to 1$ where $F$ arbitrary function of its two arguments. At last by substitution $X\to Y(X,g)$ it is possible to equate $F$ to unity and we come back to equation considered in 4 section. Solution of Plebansky equation id the following one $v_{\bar{y}}=\exp({R+\Delta\over 2}=({\exp\Delta\over-\Delta_{\theta}})^{{1\over 2}}={g_{\theta}}^{-{1\over 2}}X_{\bar{y}},\quad v_{\bar{z}}={g_{\theta}}^{-{1\over 2}}X_{\bar{z}},\quad v={g_{\theta}}^{-{1\over 2}}X$ ### 6.2 Solution do not depend on one bar coordinate Let us assume that solution of equation (19) does not depend on $\bar{z}$ coordinate. Then equation for $\Theta$ function takes the form $e^{-\Delta}(e^{-\Delta}\Theta_{\Delta})_{\Delta}\Theta_{D,\bar{y}}-e^{-\Delta}\Theta_{\Delta,D}e^{-\Delta}\Theta_{\Delta,\bar{y}})=0$ This is exactly three dimensional subclass of complex Monge-Ampher (four dimensional equation), solution of which in implicit form is known [3]. It may be expressed via (in terms of) $\psi(\Delta,d,\bar{y})$ function which is solution of the equation $e^{\Delta}+F_{\psi}(D,\psi)+\bar{F}_{\psi}(\bar{y},\psi)=0$ (22) In the last equation for $\psi(\Delta,D,\bar{y})$ two arbitrary functions $F(D,\psi),\bar{F}(\bar{y},\psi)$ assumed to be known. Of course solution of this equation (in general case) may be obtained only in implicit form. After this solution of the equation for $\Theta(D,\bar{y},\Delta)$ function is resolves as follows $\Theta_{\Delta}=e^{\Delta}\psi,\quad\Delta_{\Theta}=e^{-\Delta}\psi^{-1},\quad\Theta_{\bar{y}}=-\bar{F}_{\bar{y}},\quad\Theta_{D}=F_{D}$ And this is a general solution of this equation. The solution of the initial equation of Plebansky in coordinates $z,y,\bar{z},\bar{y}$ is given by equations $v_{\bar{y}}=e^{\Delta}(\psi)^{{1\over 2}},\quad v_{\bar{z}}=(\psi)^{{1\over 2}},\quad yz+F_{D}(D,\psi)=0$ (23) We present below direct checking of the formulae above. Equation of Plebansky in its basic form after substitution (23) looks as ${1\over 2}(e^{\Delta}_{y}\psi_{z}-e^{\Delta}_{z}\psi_{y})=-{1\over 2}F_{\psi,D}{y\psi_{y}+z\psi_{z}\over yz}=1$ In the last step of calculation necessary use last formulae of (23) $y+F_{DD}{1\over z}+F_{D,\psi}\psi_{z}=0,\quad z-F_{DD}{1\over y}+F_{D,\psi}\psi_{y}=0,\quad D=\ln z-\ln y$ #### 6.2.1 Solution of the example from a section 4 Let us sick solution of (19), (21) in a form (of course such form is a direct consequence of calculations of the 4 section) $\Theta=(e^{-\Delta}-r(D,\bar{y},\bar{z}))^{-1}$ All necessary derivatives are the following ones $\Theta_{\Delta}=e^{-{1\over 2}\Delta}\Theta^{2},\quad\Theta_{D}=r_{D}\Theta^{2},\quad\Theta_{\bar{y}}=r_{\bar{y}}\Theta^{2},\quad\Theta_{\bar{z}}=r_{\bar{z}}\Theta^{2}$ After calculation of second order derivatives and substitution into (21) we obtain equation for $r$ function $r^{3}({1\over r})_{D,\bar{y}}=r_{D,\bar{z}}$ This equation is exactly integrable (author have not met it in literature before) with solution $r=-{X_{\bar{z}}\over X_{\bar{y}}}$ where $X(D,\bar{y},\bar{z})$ is exactly the function from the section 4. Indeed $r_{D}=-{X_{D,\bar{z}}X_{\bar{y}}-X_{D,\bar{y}}X_{\bar{z}}\over X^{2}_{\bar{y}}}={1\over X^{2}_{\bar{y}}}$. #### 6.2.2 Once more possible particular solution Let us sick solution of (19), (21) in a form $\Theta=P(\bar{y},\bar{z},\Delta)+Q(d,\Delta)$ After substitution into corresponding equations we come to the linear equation for determining of the $P_{\Delta}$ function $(e^{-{\Delta\over 2}}{\frac{\partial}{\partial\bar{y}}}-e^{{\Delta\over 2}}{\frac{\partial}{\partial\bar{z}}})P_{\Delta}=0$ with the obvious solution $P=\int^{\Delta}d\delta p(e^{{-\delta\over 2}}\bar{z}+e^{{\delta\over 2}}\bar{y},\delta)$ But really for solution of Plebansky equation it is necessary only derivative of $P$ function with respect to the $\Delta$ argument. Indeed $v_{\bar{y}}=({e^{\Delta}\over\Delta_{\theta}})^{{1\over 2}},\quad v_{\bar{z}}=({e^{-\Delta}\over\Delta_{\theta}})^{{1\over 2}},\quad\Delta_{\theta}={1\over\Theta_{\Delta}}={1\over P_{\Delta}+Q_{\Delta}}$ and at last connection between $\theta$ and $\Delta$ is given by relation $yz={\Delta_{D}\over\Delta_{\theta}}=-\Theta_{D}=-Q_{D}$. ## 7 Discrete transformation Let us rewrite main equations of preliminary section once more $v_{\bar{y}}=v_{y,\bar{y}}\theta_{z}-v_{z,\bar{y}}\theta_{y}+zv_{z\bar{y}}+yv_{y,\bar{y}},\quad v_{\bar{z}}=v_{y,\bar{z}}\theta_{z}-v_{z,\bar{z}}\theta_{y}+zv_{z\bar{z}}+yv_{y,\bar{z}}$ (24) and pay attention that in connection with (8) these equations may be rewritten as $v_{\bar{y}}=\tilde{\theta}_{\bar{y}}+zv_{z,\bar{y}}+yv_{y,\bar{y}},\quad v_{\bar{z}}=\tilde{\theta}_{\bar{z}}+zv_{z,\bar{z}}+yv_{y,\bar{z}}$ The last equation may resolved with respect $\tilde{\theta}$ function $\tilde{\theta}=v-zv_{z}-yv_{y}$. And thus after substitution this expression for $\tilde{v}$ function we obtain linear system of equations for $\tilde{v}$ in a form $\tilde{v}_{\bar{y}}=(-(Ov_{z})\frac{\partial}{\partial y}+(Ov_{y})\frac{\partial}{\partial z}+O)\tilde{v}_{\bar{y}},\quad\tilde{v}_{\bar{y}}=(-(Ov_{z})\frac{\partial}{\partial y}+(Ov_{y})\frac{\partial}{\partial z}+O)\tilde{v}_{\bar{z}}$ (25) where operator $O\equiv(y\frac{\partial}{\partial y}+z\frac{\partial}{\partial z})$. Equations (25) is linear system of equations for determining $\tilde{v}_{\bar{y}},\tilde{v}_{\bar{z}}$ functions by known $v$ solution of Plebansky equation. At this moment it is unknown to the author the systematic way for resolving (25). ## 8 Outlook The main result of the present paper is a new approach to the problem of Plebansky equation. This approach allows rewrite Plebansky equation in coordinates involving symmetry function and find series solutions of this equation. Solutions obtained in such way depends on two arbitrary functions each of two variables. Thus this is not a general solution of Plebansky equation which must depend on two arbitrary function each of three variables. But investigation of symmetry equation show that general solution of Plebansky equation it is not possible present in analytic form. Situation exactly the same as for instance in the case of famous nonlinear one dimensional Schredinger equation, where it is possible to find infinite series solution of soliton like type but not general one. Constructed in the present paper solutions are connected with ordinary differential equation of the second order $X_{z,z}=F(X,z)$ and it arise very interesting problem to understand what relation has this equation to group of symmetry of Plebansky equation responsible for its integrable properties. ## 9 Appendix In this Appendix we consider simplest example from section $(6.0.1)$ chose arbitrary functions in such simple form that all calculation are possible to do in explicit form. Let us chose $F={(d+\psi)^{2}\over 2},\bar{F}={(\bar{y}+\psi)^{2}\over 2}$. The main equation allow determine $\psi$ and all other necessary variables in explicit form in usual for Plebansky equation variables $\psi=-{e^{\Delta}+\bar{y}+d\over 2},\quad yz={\Delta_{d}\over\Delta_{\theta}}=-\Theta_{d}=-(d+\psi)={e^{\Delta}+\bar{y}-d\over 2},$ $e^{\Delta}=2yz+D-\bar{y},\quad\psi=-(yz+d),\quad D=\ln{z\over y}$ In connection with results of section $(6.0.1)$ solution of basic Plebansky equation looks as $v=[(2yz+\ln{z\over y})\bar{y}-{(\bar{y})^{2}\over 2}+\bar{z}](yz+\ln{z\over y})^{1\over 2}$ ## References * [1] J.F.Plebanski Nucl. Phys. B373 (1992) 214-232.,of J.Math.Phys 16,(1975), 2395. * [2] L.V.Ovsjanikov Group Analysis of differential equations., Acad.Press New-York (1992). * [3] Fairlie D.B. and A. N. Leznov J. Phys. A Volume 33, Number 25, 30 June 2000 (4657-4661
arxiv-papers
2009-03-25T19:31:42
2024-09-04T02:49:01.419188
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "A.N.Leznov", "submitter": "Andrey Leznov", "url": "https://arxiv.org/abs/0903.4440" }
0903.4559
# Effects of Dark Matter Substructures on Gravitational Lensing: Results from the Aquarius Simulations D. D. Xu1, Shude Mao1, Jie Wang2,3, V. Springel2, Liang Gao3,4, S.D.M. White2 E-mail: Dandan.Xu@postgrad.manchester.ac.uk Carlos S. Frenk3, Adrian Jenkins3, Guoliang Li5, Julio F. Navarro6 1 Jodrell Bank Centre for Astrophysics, the University of Manchester, Alan Turing Building, Manchester M13 9PL, United Kingdom 2 Max-Planck Institut Für Astrophysik, Karl-Schwarzshild-Straße 1, 85740 Garching, Germany 3 Institute of Computational Cosmology, Dept. of Physics, University of Durham, South Road, Durham DH1 3LE, United Kingdom 4 National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, China 5 Argelander-Institut für Astronomie, University of Bonn, Auf dem Hügel 71, D-53121 Bonn, Germany 6 Department of Physics and Astronomy, University of Victoria, Victoria, BC, V8P, 5C2, Canada (Accepted …… Received …… ; in original form…… ) ###### Abstract We use the high-resolution Aquarius simulations of the formation of Milky Way- sized haloes in the $\Lambda$CDM cosmology to study the effects of dark matter substructures on gravitational lensing. Each halo is resolved with $\sim 10^{8}$ particles (at a mass resolution $m_{\rm p}\sim 10^{3}$ to $10^{4}h^{-1}M_{\odot}$) within its virial radius. Subhaloes with masses $m_{\rm sub}\ga 10^{5}h^{-1}M_{\odot}$ are well resolved, an improvement of at least two orders of magnitude over previous lensing studies. We incorporate a baryonic component modelled as a Hernquist profile and account for the response of the dark matter via adiabatic contraction. We focus on the “anomalous” flux ratio problem, in particular on the violation of the cusp- caustic relation due to substructures. We find that subhaloes with masses less than $\sim 10^{8}h^{-1}M_{\odot}$ play an important role in causing flux anomalies; such low mass subhaloes have been unresolved in previous studies. There is large scatter in the predicted flux ratios between different haloes and between different projections of the same halo. In some cases, the frequency of predicted anomalous flux ratios is comparable to that observed for the radio lenses, although in most cases it is not. The probability for the simulations to reproduce the observed violations of the cusp lenses is $\approx 10^{-3}$. We therefore conclude that the amount of substructure in the central regions of the Aquarius haloes is insufficient to explain the observed frequency of violations of the cusp-caustic relation. These conclusions are based purely on our dark matter simulations which ignore the effect of baryons on subhalo survivability. ###### keywords: Gravitational lensing - dark matter - galaxies: ellipticals - galaxies: formation ††pagerange: Effects of Dark Matter Substructures on Gravitational Lensing: Results from the Aquarius Simulations–References††pubyear: 2002 ## 1 INTRODUCTION Currently there are $\sim 200$ known galaxy-scale lenses, divided roughly equally in number into lensed active galactic nuclei111http://www.cfa.harvard.edu/castles/ and lensed background galaxies (Bolton et al. 2008). These galaxy-scale lenses allow diverse applications (see the review “Strong Gravitational Lensing” by Kochanek in Schneider et al. 2006) such as a determination of the Hubble constant, a characterisation of galaxy evolution, and measurements of the mass distribution in galaxies. The last application will likely be the most important one in the next decade, since there are few other probes at intermediate redshifts ($z\sim 0.5-1$). It was noticed quite early on that the flux ratios of the multi-lensed images are more difficult to reproduce with simple parametric mass models than the image positions (Kochanek 1991). This has been termed the “anomalous flux ratio” problem. Image positions and magnifications (flux ratios) are determined by the first-order and second-order derivatives of the lensing potential, respectively. Therefore flux ratios, as a high-order derivative, are expected to be more sensitive to small changes in the lensing potential than image positions. In this regard, gravitational lenses with two or three close images deserve special attention because, in these cases, the sources must be close to either a fold or a cusp of the caustic. It is well known for any smooth lensing potential that the close images follow asymptotic flux ratio relations: for a close pair, their flux ratio approaches unity when their separation goes to zero, while for a close triple, the ratio of the flux of the middle image to the sum of the fluxes of the two outer images asymptotically goes to unity (Mao 1992; Schneider & Weiss 1992; Keeton et al. 2003; Congdon et al. 2008). However, the observed lensing systems often violate these asymptotic relations. This was taken to be evidence for substructure in lensing galaxies (Mao & Schneider 1998; Metcalf & Madau 2001; Metcalf & Zhao 2002; Dalal & Kochanek 2002; Chiba 2002; Kochanek & Dalal 2004) on the physical scale of the separation between close images (typically of the order of $\sim$ 1 kpc). Spectroscopic observations go beyond simple broad-band flux ratios and provide a promising way to probe substructure in lenses (Metcalf et al. 2004; Chiba et al. 2005; Sugai et al. 2007). Other suggestive evidence for substructures comes from astrometry (see Chen et al. 2007 for a general discussion), such as bent jets (Metcalf 2002), and detailed image structures for B2016+112 (Schneider et al. 2006; Koopmans et al. 2002; More et al. 2009) and B0128+437 (Biggs et al. 2004; Zhang 2008). Substructures may also have detectable effects on the time delays in gravitational lenses (Keeton & Moustakas 2008). Evans & Witt (2003) argued that some of these lensing “anomalies” may be accommodated by changes in the potentials of the main lensing galaxies in parametric models. However, significant changes are needed in order to explain the anomalies (Kochanek & Dalal 2004; Congdon & Keeton 2005). The angular structures of the lenses whenever the measurements are available suggest ellipsoidal central potentials, where the high amplitude, higher order multipoles that are required to explain the flux ratio anomalies are not seen (Kochanek & Dalal 2004; Yoo et al. 2005, 2006). There are strong hints that substructures may indeed be real in lensing galaxies. First, observationally, saddle (negative-parity) images are often fainter than the predictions of simple smooth models. This is expected from lensing by substructure (such as stars, or subhaloes; Schechter & Wambsganss 2002; Kochanek & Dalal 2004), but impossible to explain by propagation effects, such as galactic scintillation and scatter broadening, as earlier postulated (Koopmans et al. 2003). This arguably constitutes the most convincing evidence for substructure lensing. Second, in many gravitational lenses, the substructure is directly seen as luminous satellites. For example, nearly half of the CLASS lenses (Browne et al. 2003; Myers et al. 2003; Jackson et al. 2009) show luminous satellite galaxies within a few kpc of the primary lensing galaxies222This fraction is a factor of $\sim 2$ higher than that claimed in Bryan et al. (2008) as revealed by a more careful analysis of HST images of the CLASS lenses (Jackson et al. 2009).. Inclusion of satellites in the modelling dramatically improves the fit to the image positions. In the case of B2045+265, the inclusion of a companion galaxy helps to explain the flux ratio anomaly (McKean et al. 2007). The additional dark subhaloes within the main lensing galaxies, as well as the intergalactic perturbers along the line-of-sight (Chen et al. 2003; Wambsganss et al. 2005; Metcalf 2005a,b; Miranda & Macciò 2007) may also help to explain the observed lensing anomalies. Much of the interest in (milli-)lensing flux anomalies arises because they may be caused by the elusive substructure generically predicted by the hierarchical structure formation in the cold dark matter (CDM) cosmology (e.g. Kauffmann et al. 1993; Klypin et al. 1999; Moore et al. 1999; Ghigna et al. 2000; Gao et al. 2004a,b; Diemand et al. 2007). In this model, large structures form via merging and accretion of smaller structures. The cores of these small structures often survive tidal destruction and manifest themselves as subhaloes (substructure). Recent high-resolution simulations predict many thousands of subhaloes (down to $m_{\rm sub}\sim 10^{6}M_{\odot}$, or to circular velocity of $V_{\rm c}\sim 4{\rm\,km\,s^{-1}}$; e.g. Madau et al. 2008; Springel et al. 2008), at least two orders of magnitude more than the number of observed satellite galaxies in the Milky Way, even after accounting for the newly discovered faint satellite galaxies from the Sloan Digital Sky Survey (Belokurov et al. 2007). A possible solution is that star formation may be strongly suppressed in the vast majority of the low-mass subhaloes (e.g. Efstathiou 1992; Kauffmann et al. 1993; Thoul & Weinberg 1996; Bullock et al. 2000; Gnedin 2000; Benson et al. 2002), and thus they remain dark and difficult to detect through light-based methods. If this is the case, then gravitational lensing can potentially probe this population since it depends only on the mass but not on whether the lenses are luminous or dark. Numerical simulations indicate that subhaloes typically account for 5-10 per cent of the total mass in a galaxy-type halo (e.g. Klypin et al. 1999; Moore et al. 1999; Ghigna et al. 2000). The study by Dalal & Kochanek (2002) requires $f_{\rm sub}=$ 0.6% to 7% (with a median of 2%) of the mass to be in substructures (90% confidence limit) in order to explain the observed flux anomaly problem. At first sight, the fraction of substructure from simulations seems to be more than sufficient to explain the flux anomaly. Upon closer examination, however, a problem emerges: lensing probes the central few kpc around the line-of-sight through the galaxy, while most substructures are in the outer regions of its dark matter halo, since those that come close to the centre are tidally destroyed. Thus it remains unclear whether the predicted substructure in the inner regions is sufficient or not to explain the observed flux anomalies (e.g. Bradač et al. 2004; Mao et al. 2004; Macciò & Miranda 2006; Amara et al. 2006). In contrast, on cluster scales, the amount of predicted substructure seems to be consistent with weak and strong lensing data (Natarajan et al. 2007). Previous lensing studies simulated galaxy-sized haloes with $\sim 10^{6}$ particles so that subhaloes were resolved down to $\sim 10^{7}$ to $10^{8}h^{-1}M_{\odot}$. State-of-the-art simulations can now resolve haloes with two or even three orders of magnitude more particles, thus reaching substantially lower mass subhaloes. In this work, we revisit the issue of substructure lensing using the Aquarius simulations of six galaxy-sized haloes. These collisionless $N$-body simulations were performed by the Virgo Consortium in a concordance $\Lambda$CDM universe. The subhaloes in each halo are resolved down to masses of $m_{\rm sub}\sim 10^{5}h^{-1}M_{\odot}$ (Springel et al. 2008), at least two orders of magnitude better than that in previous substructure lensing studies. Our paper is organised as follows. In Section 2, we describe the realisation and the properties of the simulated lensing galaxies. Our methods and techniques for the lensing simulations together with our test results are presented in Section 3. In Section 4, we apply our lensing simulation to the six simulated galaxy haloes from the Aquarius simulation to derive their lensing properties, including the cusp relations, and we compare the numerical results with observations. A summary of the paper and a discussion are given in Section 5. The cosmology we adopt for the lensing simulation is the same as that used for the Aquarius simulations (Springel et al. 2005), with a matter density $\Omega_{\rm m}$ = 0.25, cosmological constant $\Omega_{\Lambda}$ = 0.75, Hubble constant $h=H_{0}/(100{\rm\,km\,s^{-1}}\,{\rm Mpc}^{-1})=0.73$ and linear fluctuation amplitude $\sigma_{8}=0.9$. ## 2 From Dark Matter haloes to Early-Type Lensing Galaxies In this section, we summarise the properties of dark matter haloes from the Aquarius simulations relevant to our study, in particular the subhalo properties. Readers are referred to Springel et al. (2008) for more details. We will show that dark matter alone is, as expected, insufficient to cause multiple image splittings, and therefore we must incorporate a stellar component; we detail such a procedure in §2.2. ### 2.1 The Aquarius simulations The Aquarius project (Springel et al. 2008) is a suite of simulations of six galaxy-sized dark matter haloes with five levels of numerical resolution. The haloes were selected from a 100$h^{-1}$ Mpc simulation box within the concordance cosmology (for parameters see above). The simulations were run with GADGET-3, an improved version of the GADGET-2 code (Springel et al. 2001; Springel 2005). The highest resolution level (level 1) was achieved for only one halo (“Aq-A-1”) with $\sim 1.5$ billion halo particles. Level-2 simulations were performed for a sample of six dark matter haloes, with about 200 million particles per halo. The softening length is $\sim$0.05$h^{-1}$ kpc, and the mass resolution ranges from $10^{3}$ to $10^{4}h^{-1}M_{\odot}$. All haloes are Milky-Way type systems in terms of their mass and rotation curve. We will use the six level-2 haloes (Aq-A-2, Aq-B-2, Aq-C-2, Aq-D-2, Aq-E-2 and Aq-F-2) at redshift zero for our analysis of substructure lensing. As we will show later on, the scatter in lensing properties among different haloes (and for different projections) is large, and so it is important to examine more than one halo for statistical purposes. The basic properties of the six haloes at $z=0$ are listed in Table 1. In particular, all the density profiles are reasonably fit by Navarro, Frenk and White (NFW) profiles (Navarro et al. 1996, 1997)333An even better fit is found using the Einasto (1966) profile (Navarro et al. 2008), but here we adopt the simpler NFW profile which we use later to take into account the adiabatic contraction of dark matter haloes.: $\begin{array}[]{c}\displaystyle\rho(r)=\frac{M_{200}}{4\pi r(r+r_{200}/c)^{2}f(c)},\\\ \displaystyle M(<r)=\frac{M_{200}f(r\,c/r_{200})}{f(c)},\\\ \displaystyle f(c)=\ln(1+c)-c/(1+c),\end{array}$ (1) where $r_{200}$ is the radius within which the mean dark halo mass density is 200 times the critical density, $M_{200}$ is the mass enclosed within $r_{200}$, and $c\equiv r_{200}/r_{\rm s}$ is the concentration parameter with $r_{\rm s}$ being the scale radius. Table 1: Dark matter halo properties in the Aquarius simulations: Halo Name | $r_{200}$ | $M_{tot}$ | $c$ | Mass Resolution | $N_{200}$ | $N_{\rm sub}$ | $f_{\rm sub}$ ---|---|---|---|---|---|---|--- | ($h^{-1}$ kpc) | ($10^{10}h^{-1}M_{\odot}$) | | ($h^{-1}M_{\odot}$) | | | (per cent) Aq-A-2 | 179.5 | 132.8 | 16.2 | $1.0\times 10^{4}$ | $1.3\times 10^{8}$ | $2.1\times 10^{4}$ | 7.14 Aq-B-2 | 137.1 | 59.5 | 9.7 | $4.7\times 10^{3}$ | $1.3\times 10^{8}$ | $2.5\times 10^{4}$ | 6.98 Aq-C-2 | 177.3 | 127.7 | 15.2 | $1.0\times 10^{4}$ | $1.2\times 10^{8}$ | $1.7\times 10^{4}$ | 4.12 Aq-D-2 | 177.3 | 128.5 | 9.4 | $1.0\times 10^{4}$ | $1.3\times 10^{8}$ | $2.2\times 10^{4}$ | 6.56 Aq-E-2 | 155.0 | 85.7 | 8.3 | $7.0\times 10^{3}$ | $1.2\times 10^{8}$ | $2.3\times 10^{4}$ | 7.28 Aq-F-2 | 153.0 | 80.5 | 9.8 | $4.9\times 10^{3}$ | $1.6\times 10^{8}$ | $2.6\times 10^{4}$ | 11.20 Aq-A-2 ($Z$ = 0.6) | 134.4 | 92.2 | 10.4 | $1.0\times 10^{4}$ | $9.3\times 10^{7}$ | $1.7\times 10^{4}$ | 6.50 Note: Col (1): halo name, Cols (2)-(4): $r_{200}$, $c$ and $M_{200}$ are defined in eq. (1) for the main halo. $M_{\rm tot}=M_{200}+M_{\rm sub}$, where $M_{\rm tot}$ and $M_{\rm sub}$ are the total masses of all dark matter and of all the subhaloes within $r_{200}$. Col (5): Mass resolution ($h^{-1}M_{\odot}$). Col (6): $N_{200}$ is the total number of particles within $r_{200}$. Col (7): $N_{\rm sub}$ is the number of subhaloes within $r_{200}$. Col (8): $f_{\rm sub}$ is the mass fraction of subhaloes within $r_{200}$, defined by $M_{\rm sub}/M_{\rm tot}$. We artificially put all these haloes (snapshot $z=0.0$) at redshift $z=0.6$ (corresponding roughly to the most likely lens redshift, e.g. Turner et al. 1984), keeping their physical sizes unchanged. However, we also take a snapshot of the halo Aq-A-2 at redshift $z=0.6$ as a lens, and compare its lensing properties with those artificially shifted to $z=0.6$. As will be shown in §4, the scatter among the six haloes is much larger than the differences between haloes at redshifts $z=0$ and $z=0.6$, and so adopting the $z=0$ haloes will not significantly change the properties of substructure lensing. This is also seen in the evolution of density profiles of these haloes. Fig. 1 shows the density profiles for the halo Aq-D-2 at redshifts 0, 0.50 and 0.99. The changes in the profiles since redshift 1 are relatively small since the Aquarius haloes form earlier than that. Figure 1: Density profiles (solid curves), multiplied by $r^{2}$, for the halo Aq-D-2 at redshifts $z=0$, 0.5 and 0.99. All haloes are reasonably well fitted by the NFW profile (dotted curves, see Eq. 1), which follows $\rho(r)\propto r^{-1}$ on small scales and $\rho(r)\propto r^{-3}$ on large scales. The vertical dashed lines indicate the softening length and $r_{200}$. As we are primarily interested in the substructure lensing, an important step is the identification of the subhaloes. We use the SUBFIND routine (Springel 2005) to identify subhaloes exceeding 20 particles, which corresponds to a minimum subhalo mass of $\sim 10^{5}h^{-1}M_{\odot}$. The number of subhaloes in each halo ranges from about $1.7\times 10^{4}$ to $2.6\times 10^{4}$ within $r_{200}$, with 4.1-11.2 per cent of the total halo mass locked up in bound subhaloes (see Col (8): $f_{\rm sub}$ in Table 1). The subhalo mass function follows a power-law: ${\rm d}N(m_{\rm sub})/{\rm d}m_{\rm sub}\propto m_{\rm sub}^{-1.9}$ (Springel et al. 2008). The average mass of subhaloes (within $r_{200}$) is $\sim 10^{6}$ to $10^{7}h^{-1}M_{\odot}$ and their average half-mass radius is $\leq 0.2h^{-1}$ kpc, with large scatter. The most massive subhalo has a mass of $\sim 10^{9}$ to $10^{10}h^{-1}M_{\odot}$ and a half-mass radius $\sim 5-10h^{-1}$ kpc. Figure 2: The left panel shows a contour map of the subhalo surface mass density fraction, which is the ratio of the surface mass in subhaloes to that in the total halo, for Aq-D-2 projected along the $Y$-axis. The right panel shows the mean distribution of subhalo surface mass fraction as a function of $R/r_{200}$, averaged over the three independent projections of each of the six Aquarius haloes at redshift $z=0$. The error bars indicate the 68% scatter among different projections and haloes. The red lines show the fit from Mao et al. (2004). The blue point indicates the median and 90% confidence level of the required fraction found by Dalal & Kochanek (2002) (assuming the Einstein radius to be 0.02 $r_{200}$). As an example, we again consider halo Aq-D-2 and show in the left panel of Fig. 2 the $Y$-projection of the surface mass fraction in subhaloes within $r_{200}$. The right panel in the same figure shows the surface mass fraction of subhaloes averaged within azimuthal annuli as a function of the normalised radius $R/r_{200}$. It is clear that the scatter in the projected mass fraction of subhaloes among different haloes is large. Within 0.1 $r_{200}$, the mean fraction is $\sim$ 0.005, with a scatter of a factor of 10. The red line in the same panel shows the results from Mao et al. (2004), which were obtained from 12 haloes (of galactic, group and cluster masses) and 30 random projections. Their result lies somewhat higher than found here although still within the scatter. This is probably due to the inclusion of group- and cluster-sized haloes in the averaging, which tend to have a higher substructure fraction due to their later formation times. The blue point indicates the required substructure mass fraction found by Dalal & Kochanek (2002) to be 0.02 (median, ranging from 0.006 to 0.07 at 90% confidence). ### 2.2 Adding “light” to dark matter haloes We put the source redshift $z_{\rm s}$ at 3.0. This is reasonable since many lensed quasars are at similar redshift. The lensing critical surface density is given by $\Sigma_{\rm cr}=\frac{c^{2}}{4\pi G}\frac{D_{\rm s}}{D_{\rm d}D_{\rm ds}},$ (2) where $D_{\rm s}$, $D_{\rm d}$, and $D_{\rm ds}$ are the angular diameter distances between the source and the observer, the lens and the observer, and the source and the lens, respectively. For our adopted source and lens redshifts, $\Sigma_{\rm cr}=1.82\times 10^{9}$ $M_{\odot}$ kpc${}^{-2}=7.95\times 10^{10}$ $M_{\odot}$ arcsec-2. To produce multiple images, the maximum surface density of a halo usually has to be super-critical. The left panel of Fig. 3 shows the surface density distribution for the halo Aq-D-2 projected along the $Y$-axis. Clearly, the central surface density of the (initial) NFW dark matter halo is below the critical value, and thus generally no multiple images can be produced (e.g. Williams et al. 1999; Rusin & Ma 2001) . This is hardly surprising, since for galaxy-scale strong lensing, the images form only a few kpc (projected) from the centre where baryons play a crucial role. Thus, one must incorporate a baryonic component in order to model the lensing galaxies more realistically, a topic we turn to next. Most gravitational lenses are early-type (elliptical) galaxies rather than late-type (disk) galaxies, as the former are more massive and dominate the lensing cross-sections (Turner et al. 1984). There have been many hybrid models used for the lensing galaxies (e.g. Keeton 2001; Kochanek & White 2001; Oguri 2002; Jiang & Kochanek 2007). We use the spherical Hernquist profile to model the light distribution, since it approximates the de Vaucouleur’s profile that has been observed for elliptical galaxies and bulges, and it has many known, convenient analytical properties. The three-dimensional density and mass profiles $\rho_{H}(r)$, $M_{H}(r)$ for the Hernquist distribution are given by (Hernquist 1990): $\begin{array}[]{c}\displaystyle\rho_{H}(r)=\frac{aM_{\star}}{2\pi r}\frac{1}{(r+a)^{3}},\\\ \displaystyle M_{H}(<r)=M_{\star}\frac{r^{2}}{(r+a)^{2}}.\end{array}$ (3) where $M_{\star}$ is the total baryonic mass, and $a$ is a scale length related to the effective spherical radius $r_{\rm e}$ (within which half of the mass is contained) by $a=r_{\rm e}/(\sqrt{2}+1)$. The profile is specified by two parameters $a$ (or $r_{\rm e}$) and $M_{\star}$, which are linked with the dark matter halo parameters $r_{200}$ and $M_{200}$ by $\begin{array}[]{c}\displaystyle f_{\rm re}=\frac{r_{\rm e}}{r_{200}},~{}~{}\displaystyle f_{\star}=\frac{M_{\star}}{M_{200}},~{}~{}\displaystyle M_{200}=M_{\rm DM}+M_{\star}.\end{array}$ (4) Notice that the mass of the main halo dark matter $M_{\rm DM}$ is reduced by a factor of (1-$f_{\star}$) to conserve the total mass and the mass of substructures. The inclusion of the baryonic component affects the distribution of the dark matter halo. Many studies have shown that the adjustment of the dark matter halo can be approximated by an adiabatic contraction (Barnes & White 1984; Blumenthal et al. 1986). Gnedin et al. (2004) have proposed a modification to this simple model in order to take into account the fact that particle orbits in realistic halos are not circular, but it is not clear whether this modification is able to reproduce accurately the results of numerical simulations (see, e.g. Abadi et al. 2009). In view of this, we have decided to follow, for simplicity, the procedure outlined by Mo et al. (1998). Assuming that both the baryon and dark matter components follow an NFW distribution initially, baryons ($f_{\star}$ percent of the total matter) then cool to form the galaxy at the centre, which causes the dark matter halo to contract adiabatically. After the adiabatic contraction, the dark halo follows a new profile and hosts a Hernquist galaxy at its centre. Note that we contract all the particles in different components (i.e., diffuse dark matter and subhaloes) in the same way. The two parameters ($f_{\rm re}$ and $f_{\star}$) are chosen according to two criteria (after adding the baryonic galaxy and accounting for the adiabatic contraction): (1) the projected dark-matter mass fractions inside the Einstein radii of the host galaxy haloes should range from 0.4 – 0.7 (Treu & Koopmans 2004); (2) the projected slopes are close to isothermal at a few kpc from the galactic centre (e.g. Rusin et al. 2003; Rusin & Kochanek 2005; Koopmans et al. 2006; Gavazzi et al. 2007), or equivalently, the final rotation curves are roughly flat from a few kpc out to a few tens of kpc (see Fig. 3). Furthermore, $f_{\star}$ should be smaller than the universal baryonic fraction of $\sim$ 17.5 per cent (from WMAP-3, Spergel et al. 2007). We find that $f_{\rm re}=0.05$ and $f_{\star}=0.1$ satisfy these criteria well. From Fig. 3 (the left panel), it is clearly seen that after inserting the baryonic galaxy and taking the adiabatic contraction into account, the total surface density is now super-critical and the corresponding Einstein radius is of the order of a few kpc, similar to that in many gravitational lenses. Notice however that our procedure is not self-consistent dynamically, since the inclusion of a baryonic component will affect the evolution and survival of subhaloes. We shall return to this point briefly in the discussion. Figure 3: The halo Aq-D-2: the left panel shows the surface density profiles $\Sigma(R)$ projected in the $Y$-direction, and normalised to the critical surface density. Profiles are for cases before and after adding a Hernquist galaxy and the dark matter halo’s adiabatic contraction, assuming the added baryonic component has 10% of the total mass and an effective radius of 5% of the halo virial radius ($f_{\star}=0.1$, $f_{\rm re}=0.05$). Line symbols are labelled inside the figure. The isothermal slope ($\Sigma(R)\propto R^{-1}$) is indicated by the red line at the top right (see §2.2 for details). The middle panel shows the mass distributions $M(\leq r)$. The right panel shows the rotation curves $V_{\rm c}(r)$. The final total rotation curve is flat from $\sim 5h^{-1}\,{\rm kpc}$ out to a few tens of kpc. ## 3 LENSING METHODOLOGY $N$-body simulations provide us with the positions (and velocities) of particles. For lensing calculations, we first project the particles onto a mesh in the lens plane (and tabulate the stellar surface density, and then smooth the surface density field appropriately. Using the smoothed surface density map, we can numerically calculate the lensing potential, deflection angles and magnifications. The details of the numerical procedure are given in §3.1. We test the accuracy of our numerical procedure by comparing with known analytical results, using a singular isothermal sphere realised through Monte Carlo simulations in §3.2. We then relax the spherical assumption, and further test our procedure with an isothermal ellipsoid generated with a similar number of particles as those in the Aquarius simulations; the comparison results are presented in §3.3. ### 3.1 From particles to lensing images #### 3.1.1 Coarse and fine particle meshes We use a Particle-Mesh (PM) code for the lensing potential calculation. The application of Fast Fourier Transforms ($FFT$) in the PM algorithm makes it computationally efficient. However it is limited in resolution by the finite mesh size and so cannot accurately represent regions with rapid density variations on the scale of the grid size. To increase the accuracy in the regions of interest (within a few kpc from the centres of galaxies), we establish two two-dimensional [2D] meshes: a coarse grid used for the potential field generated by the mass projected outside the central ($20h^{-1}$ kpc)2 region, and a fine grid for the mass within. Both grids have $1024\times 1024$ pixels, covering $(4\,r_{200})^{2}$ and ($40h^{-1}$ kpc)2 (see §3.1.3) with resolutions $\sim$ 0.6$h^{-1}$ kpc and 0.04$h^{-1}$ kpc for the coarse and fine grids, respectively (the factor of two increase in the box size is due to the isolated boundary condition, see §3.1.3). This resolution ensures that the tangential critical curves are resolved with sufficient accuracy. In contrast, the inner radial critical curves may not be well reproduced, due to the finite resolution of the mesh. However, this is not a major concern since all the bright images that we are interested in form close to the outer (tangential) critical curves. Furthermore, the resolution of the fine mesh is similar to the softening length of the simulations, and the density distributions in the very central regions are not accurately modelled in the simulations on smaller scales than the gravitational softening in the first place. #### 3.1.2 Particle assignment with smoothed particle hydrodynamics kernel The surface density maps of the Aquarius haloes are obtained by assigning particles to the potential meshes using the Smooth Particle Hydrodynamics (SPH) kernel (Monaghan 1992). Although, in the end, we will approximate the underlying mass distributions of the Aquarius haloes by isothermal ellipsoids in order to circumvent problems caused by discreteness noise (see §3.3), SPH- smoothed density fields are used as an intermediate step to generate basic lensing properties (e.g. critical curves and caustics) to constrain the best- fit isothermal ellipsoids. For more detail, see §4. The advantage of the SPH assignment is that it adjusts the smoothing scale according to the local density environment: particles in a high density region are mildly smoothed while those in a low density region are smoothed more. For each particle, a smoothing length ${\cal{H}}$ is calculated according to the local number density in its 3D neighbourhood. The particle mass is then assigned to all the mesh cells that are within a circle of $2{\cal{H}}$ in radius in its neighbourhood. The 3D density kernel can be integrated along the line of sight analytically to obtain the surface density distribution: $\Sigma(u)=\frac{1}{\pi{\cal{H}}^{2}}\left\\{{\begin{array}[]{*{20}l}\frac{1}{16}[-(8+52u^{2})\sqrt{1-u^{2}}+(16+26u^{2})\sqrt{4-u^{2}}\\\ -9u^{4}\ln u+3u^{2}(16+4u^{2})\ln(1+\sqrt{1-u^{2}})\\\ -3u^{2}(16+u^{2})\ln(2+\sqrt{4-u^{2}})],~{}~{}{\mathrm{if}~{}1>u\geq 0}\\\ \frac{1}{16}[2\sqrt{4-u^{2}}(8+13u^{2})+3u^{2}(16+u^{2})\ln u\\\ -3u^{2}(16+u^{2})\ln(2+\sqrt{4-u^{2}})],~{}~{}{\mathrm{if}~{}2>u\geq 1}\\\ 0,~{}~{}~{}{\mathrm{if}~{}u>2}\end{array}}\right.$ (5) where $u\equiv r/{\cal{H}}$ is the distance from the cell centre to the particle normalised to ${\cal{H}}$, and the total mass within $u\leq 2$ is unity. The smoothing length ${\cal{H}}$ for each particle depends on its local density and is controlled by the parameter $N_{\rm ngb}$, the number of particles that are contained within radius ${\cal{H}}$. A good smoothing procedure should reduce the numerical noise without smoothing excessively out the real density fluctuations (e.g. substructures). The total mass that has been assigned to the neighbouring cells should be equal to the mass of the particle. However this is only approximately true due to the discreteness of cells. In particular, mass conservation is quite poorly observed when the smoothing length ${\cal{H}}$ is only a few mesh cells, which may happen in a dense environment. For particles with $2{\cal{H}}\leq 15$ cell sizes (30 cells in diameter), we therefore renormalise each individual kernel so that the total mass is conserved during the assignment. We find in practice that SPH assignment is superior to Cloud-In-Cell (CIC) assignment in terms of reducing discreteness noise. For a singular isothermal sphere realised with $10^{6}$ particles, the SPH-smoothed ($N_{\rm ngb}=32$) and CIC-smoothed surface density fields show fluctuations of 2% and 30% relative to the analytical results, respectively. For a realisation with $10^{7}$ particles, the fluctuations decrease to 1% for the SPH assignment ($N_{\rm ngb}=320$, with the same smoothing length, ${\cal{H}}\propto N_{\rm p}^{-1/3}N_{\rm ngb}^{1/3}$ (Li et al. 2006)) and to 10% for the CIC assignment. #### 3.1.3 Isolated boundary conditions Periodic boundary conditions are most natural for Fourier Transforms, but are not appropriate for lensing galaxies. We follow Hockney & Eastwood (1981) to eliminate the (aliasing) effects due to “mirror” particles by using a mesh twice as big as the simulated lens system, padding the region outside the simulation volume with zeros. A truncated 2D gravitational force kernel is tabulated onto the same simulation mesh, and then convolved with the assigned surface density field. The gravitational effect is accurately reproduced within the region where the mass has been distributed (See Hockney & Eastwood 1981, for more technical details). We adopt this procedure throughout this work. #### 3.1.4 Lensing potential, deflection angle and magnification After the discretisation of the surface density field through SPH assignment and the tabulation of the truncated 2D gravitational kernels on the meshes, the potentials and their derivatives are easily calculated by convolutions which can be efficiently implemented in Fourier space. In particular, the effective lensing potential $\psi(\vec{\theta})$ is the convolution of the surface density $\Sigma(\vec{\theta})$ and the 2D kernel $\ln|\vec{\theta}|$: $\psi(\vec{\theta})=\frac{1}{\pi}\int\Sigma(\vec{\theta^{\prime}})\ln|\vec{\theta}-\vec{\theta^{\prime}}|\,d^{2}\theta^{\prime}.$ (6) The deflection angle $\vec{\alpha}(\vec{\theta})$ is the first derivative of the lensing potential, $\psi(\vec{\theta})$, and is thus the convolution of the surface density $\Sigma(\vec{\theta})$ and the 2D force kernel $\vec{\theta}/|\vec{\theta}|^{2}$: $\vec{\alpha}(\vec{\theta})\equiv\nabla\psi(\vec{\theta})=\frac{1}{\pi}\int\Sigma(\vec{\theta^{\prime}})\frac{\vec{\theta}-\vec{\theta^{\prime}}}{|\vec{\theta}-\vec{\theta^{\prime}}|^{2}}\,d^{2}\theta^{\prime}.$ (7) The convergence $\kappa(\vec{\theta})$ (the surface density normalised to $\Sigma_{\rm cr}$) and the shear $\gamma(\vec{\theta})$ are second-order derivatives of the lensing potential $\psi(\vec{\theta})$: $\begin{array}[]{c}\displaystyle\kappa=(\psi_{11}+\psi_{22})/2,~{}~{}\displaystyle\gamma_{1}=(\psi_{11}-\psi_{22})/2,\\\ \displaystyle\gamma_{2}=\psi_{12}=\psi_{21},~{}~{}\displaystyle\gamma^{2}=\gamma_{1}^{2}+\gamma_{2}^{2},~{}~{}\displaystyle~{}\psi_{ij}\equiv\frac{\partial^{2}\psi}{\partial\theta_{i}\partial\theta_{j}},\end{array}$ (8) where the derivatives are taken with respective to the index 1 ($x$) and 2 ($y$). Numerically, the convergence and shear can be calculated through 4th- order finite differencing from the deflection angle $\vec{\alpha}(\vec{\theta})$. The magnification $\mu(\vec{\theta})$ is related to the convergence and shear by $\mu=\frac{1}{(1-\kappa)^{2}-\gamma^{2}}.$ (9) #### 3.1.5 Image finding and cusp relation Since all the lensing quantities are now known, it is straightforward to find the images for any given source position. To this end, we construct a separate mesh in the image plane, with a resolution ($0.02h^{-1}$ kpc) higher than the fine potential mesh discussed in §3.1.1; the lensing properties (deflection angle, magnification etc.) on this ultra-fine mesh are found through bi-linear interpolation. We then search image positions (and magnifications) using the Newton-Raphson and triangulation methods (Schneider et al. 1992). Of particular interest to gravitational lensing are the critical curves and caustics. Critical curves in the image plane are a set of points where the magnification is formally infinite for a point source, $\mu(\vec{\theta})\longrightarrow\infty$. In practice, they are identified according to the fact that the magnifications have different signs (i.e., different parities) for images on different sides of a critical curve. Critical curves are mapped into caustics in the source plane, which can be easily obtained through the lens equation. Most strong lenses occur in elliptical galaxies since they have larger lensing cross-sections than spiral galaxies (Turner et al. 1984). They typically form two distinct sets of critical curves and corresponding caustics: the tangential (“outer”) and radial (“inner”) critical curves, which are mapped into tangential (“inner”) and radial (“outer”) caustics (see Fig. 5 for an example). A source inside the central caustic usually produces five images: four close to the tangential critical curve and one central image which is usually too faint to be observable (and is of no interest to us for the present work). We are particularly interested in sources that are close to the cusps of the tangential caustic (“cusp sources”). For cusp sources, three close images form around the tangential critical line, with alternate parities. There are two different kinds of cusp sources and corresponding image configurations. As illustrated in Fig. 5, a “major cusp” source forms three images around the tangential critical curve on the same side of the source (with respect to the centre of the lens) while a “minor cusp” source forms three close images on the opposite side of the source. In any smooth lensing potential, for a source very close to a cusp, the three close images satisfy an asymptotic magnification relation (the “cusp-caustic relation”; Blandford & Narayan 1986; Schneider & Weiss 1992; Keeton et al. 2003): $R_{\rm cusp}\equiv\frac{|\mu_{A}+\mu_{B}+\mu_{C}|}{|\mu_{A}|+|\mu_{B}|+|\mu_{C}|}\rightarrow 0,$ (10) with the total absolute magnification $|\mu_{A}|+|\mu_{B}|+|\mu_{C}|\rightarrow\infty$. For each of the cusp sources, we define an image opening angle $\Delta\theta$, ranging from 0 to $\pi$, which measures the angle (from the lens centre) of the outer images of the close triple. Notice that both $\Delta\theta$ and $R_{\rm cusp}$ are observable. In a smooth lens potential, as a source moves to a cusp caustic, both $\Delta\theta$ and $R_{\rm cusp}$ decrease asymptotically to zero. As can be seen from Fig. 6, there are two leading patterns on the $R_{\rm cusp}-\Delta\theta$ diagram due to “major” and “minor” cusp sources. Generally speaking, the major cusp sources have larger $R_{\rm cusp}$ than the minor cusp sources for the same image opening angle. The cusp-caustic relation predicts that in smooth lens models $R_{\rm cusp}$ would asymptotically approach zero when a source moves towards the caustic. However, the presence of (clumpy) substructures will break down the smooth potential assumption in the asymptotic cusp-caustic relation, resulting in substantial deviations in $R_{\rm cusp}$ values and other quantities (such as image positions and time delays) from simple predictions. Therefore the examination of the cusp-caustic relation is a way to test for the presence of substructures that are projected near the (tangential) critical curves. However, caution must be exercised because, even for smooth lens models, a high $R_{\rm cusp}$ is possible. There are many factors that affect the $R_{\rm cusp}$ distribution apart from the presence of substructures, e.g. the mass distribution of the lens (radial profile and the ellipticity), external shear from the environment, and the selection criteria of the cusp sources (for more discussions see Keeton et al. 2003). ### 3.2 Singular isothermal sphere Figure 4: The numerical accuracy of the deflection angle, the convergence, and the magnification for Monte-Carlo realisations of singular isothermal spheres. The top panels show the ratios of the numerical to the analytical results as a function of radius. The deviation in the numerical magnification (on the right) towards the centre is due to the finite mesh resolution of the Particle-Mesh code, and that seen near the Einstein radius (at about 0.02 $r_{200}$) is due to the divergent behaviour of the magnification close to the critical curve. The corresponding probability distributions for images with a total magnification above 20 (around $r\sim 0.02$ $r_{200}$) are presented in the bottom panels. The cyan and blue curves are for two $10^{6}$-particle realisations (with $N_{\rm ngb}=32$) while the red curve is for a $10^{8}$-particle realisation (with $N_{\rm ngb}=640$). We test our lensing simulation code with Monte-Carlo realisations of singular isothermal spheres (SIS), for which analytical lensing properties are known. Each of our SIS contains a mass of $10^{12}h^{-1}M_{\odot}$ within a virial radius of 100$h^{-1}$ kpc, realised with $10^{6}$ and $10^{8}$ particles; the SPH assignment parameter is chosen to be $N_{\rm ngb}=32$ and $N_{\rm ngb}=640$ for the two cases respectively. Fig. 4 shows the numerical accuracy of the deflection angle, convergence (surface density) and magnification in our numerical procedures. For the $10^{6}$ particle case, two Monte-Carlo realisations (cyan and blue curves) are shown. For the $10^{8}$ particle realisation, the uncertainties around the Einstein radius (at about 0.02 $r_{200}$, defined by a total magnification $\mu(\vec{\theta})\geq 20$) are 0.2% for the deflection angle, 1% for the convergence, and $<$ 10% for the lensing magnification (estimated by the half width half maximum of the probability distributions). The deviation towards the centre is due to the fact that the finite mesh resolution of the Particle-Mesh code fails to represent the singular behaviour at the centre of the SIS. The significant deviation of the magnification seen near the Einstein radius is due to the divergent behaviour of the magnification close to the critical curve, where $\mu=1/((1-\kappa)^{2}-\gamma^{2})\longrightarrow\infty$, when $\kappa=\gamma=0.5$ at the Einstein radius for the singular isothermal sphere. ### 3.3 High-resolution isothermal ellipsoid We simulate an isothermal ellipsoid (IE) with $10^{6}$ and $10^{8}$ particles (as in the Aquarius haloes). Such an isothermal ellipsoidal distribution is modelled as an oblate spheroid with axis ratio $q_{3}$ and with a density distribution: $\rho\propto(S_{0}^{2}+R^{2}+z^{2}/q_{3}^{2})^{-1},$ (11) where $S_{0}$ is a core radius, and $(R,z)$ are the cylindrical coordinates. It is specified by three parameters (see Keeton & Kochanek 1998 for details): the effective critical radius $b_{\rm I}$, the eccentricity of the mass distribution $e=(1-q_{3}^{2})^{1/2}$, and a core radius $S_{0}$. The parameters for the isothermal ellipsoidal halo are adjusted so that its critical curves and caustics match those for the halo Aq-F-2 in the $z$-projection. The parameters are $b_{\rm I}=0.4\arcsec$, $q_{3}=0.8$, $S_{0}=0.1\arcsec$ and the major-axis of the surface density ellipse is rotated by $\sim\pi/8$ with respect to the $X$-axis. Figure 5: Critical curves, caustics, and cusp-caustic relation $R_{\rm cusp}$ maps for a Monte-Carlo realisations of isothermal ellipsoid with $N_{\rm p}=1.6\times 10^{8}$ and $N_{\rm ngb}=640$. The top panels show the critical curves and the caustics. The position and corresponding images are shown for a “major cusp” (solid squares) and a “minor cusp” source (open squares). The bottom panels show the $R_{\rm cusp}$ maps from the analytical solution (left) and from the numerical result (right), with contour levels (0.0, 0.05, 0.1, 0.15, 0.2). The numerical tangential caustic from a $N_{\rm p}=10^{6}$ Monte- Carlo realisation is also presented (blue curve). The swallow-tails due to numerical noise are more apparent in this case. Figure 6: The cusp-caustic relations (of the same Monte-Carlo realised isothermal ellipsoidal (IE) halo as in Fig.5) for caustic sources with image opening angles $\Delta\theta\leq 90^{\circ}$. The left panel shows the source positions with respect to the tangential caustic. The middle panel shows both the numerical ($10^{8}$-particle realisation) and analytical results of $R_{\rm cusp}$ vs. $\Delta\theta$. The right panel shows the probability density distributions of $R_{\rm cusp}$ for the analytical IE (red), and the two Monte-Carlo realised haloes with $10^{6}$ (cyan) and $10^{8}$ particles (blue), respectively. Fig. 5 shows analytical and numerical critical curves, caustics and $R_{\rm cusp}$ maps for sources located inside the diamond caustics. The two critical curves nearly overlap each other, with barely noticeable wiggles in the numerical result. The caustics also agree reasonably well for the $10^{8}$-particle case, but for the $10^{6}$-particle realisation (blue lines), higher-order singularities such as swallowtails are clearly seen close to the cusps and along the fold caustics. These arise due to numerical noise. The numerical $R_{\rm cusp}$ map shows visible distortions compared with the smooth contours in the analytical results, even in the central region. Fig. 6 presents the $R_{\rm cusp}$ distributions for caustic sources (indicated in the left panel) with image opening angle $\Delta\theta\leq 90^{\circ}$. The analytical results show two distinct peaks due to major-cusp and minor-cusp sources with a sharp dropoff around $R_{\rm cusp}\sim 0.12$. In contrast, for the numerical distributions, even the $10^{8}$-particle realisation shows a much broader profile than the analytical one, with an extended tail out to $R_{\rm cusp}\sim 0.4$ due to numerical noise. Notice that the numerical noise behaves in a similar way as real substructures in the $R_{\rm cusp}$ distribution. In the current numerical set-up with $N_{\rm ngb}=640$ for a $10^{8}$-particle simulation, the smoothing length ${\cal{H}}$ in the central region (of the halo) approximately reaches the softening length of the Aquarius simulation, also roughly the cell resolution of the fine mesh. Increasing ${\cal{H}}$ will indeed further suppress the noise, but it may also over-smooth the underlying density field. Below we outline an alternative way to approximate the smooth underlying density fields for the host galaxy haloes. ## 4 Results ### 4.1 Lensing Predictions for Aquarius Haloes In this section, we will apply our lensing methodology to the Aquarius haloes (and a baryonic component modelled as a Hernquist profile), and study the violation of the cusp-caustic relation due to the dark matter substructures therein. In principle, we should compare the lensing properties of the simulated haloes with and without substructures in order to assess the effects of substructure. However, Fig. 6 shows a substantial broadening of the $R_{\rm cusp}$ distribution due to numerical noise, which will significantly confuse signals from real substructures. As mentioned above, the total (dark matter plus baryons) mass profile of each halo is adjusted to resemble an isothermal distribution in the central region. To avoid excessive discreteness noise, we go one step further and adopt a fitted isothermal ellipsoid (with a density distribution given by eq. [11]) rather than the original particle distribution for subsequent lensing calculations. The parameters of the isothermal ellipsoid model are adjusted to match the original critical curves and the caustics of each Aquarius halo (together with the central galaxy) in a particular projection. We add the particle distributions of substructure in the Aquarius simulations (assigned to meshes according to the CIC algorithm) to the isothermal ellipsoid that fitted to the main galaxy halo, and compare its lensing properties with those of the smooth underlying isothermal ellipsoid. In this approach, the analytical solutions of the fitted isothermal ellipsoidal potential and its derivatives are tabulated on the image grid, including the cusp-caustic relation. By doing so, no Poisson noise of the underlying main halo is introduced, and so any confusion to the results from substructures is avoided. We fit an isothermal ellipsoidal model to each of the three independent projections of each galaxy halo. The six fitting parameters are: (1) the effective critical radius $b_{\rm I}$, (2) the axis-ratio of the surface density ellipse $q_{3}$, (3) the core radius $S_{0}$, (4)-(5) the $X$\- and $Y$-offsets of the projected centre $X_{\rm c}$, $Y_{\rm c}$, and (6) the rotation angle of the major axis of the surface density ellipse $RA$. The uncertainties of the fitted parameters are $\Delta b_{\rm I}=0.003\arcsec$, $\Delta q_{3}=0.01$, $\Delta S_{0}=0.001$, $\Delta X_{\rm c}=\Delta Y_{\rm c}=0.002\arcsec$, $\Delta RA=0.004\pi$. The relative errors in the fitted critical curves and caustics are $\lesssim$ 10 % for different projections of all the simulated galaxy haloes. In Table 3, we list the isothermal ellipsoid parameters of the main haloes ($b_{\rm I}$, $q_{3}$ and $S_{0}$). The critical radius $b_{\rm I}$ is of the order of $0.3\arcsec$ to $0.9\arcsec$. The separation between images ($\sim 2b_{\rm I}$) is in the range of the observed gravitational lenses (which peaks around $1\arcsec$, see e.g. Browne et al. 2003). The axial ratios also match the observed lenses quite well. There is one exception, however. The core radius $S_{0}$ is quite large, of the order of ($0.05\arcsec-0.1\arcsec$, corresponding to a few hundreds of pc). Such a core size is larger than those inferred from gravitational lenses which are in general consistent with zero core radius (e.g. Wallington & Narayan 1993; Rusin & Ma 2001; Oguri et al. 2001; Li & Ostriker 2003). This is a direct result of the implementation of the Hernquist profiles, which follow a logarithmic density slope of $-1$ in the central regions (see Fig. 1). However, this artifact should have little effects on the images we are interested in, which are close to the outer critical curve. To examine the violation of the cusp-caustic relation, we generate about 10000 cusp sources in each case, and calculate the resulting $R_{\rm cusp}$ distributions. All these cusp sources are inside the central caustic and close to the cusps, where the corresponding triple images have opening angles $\Delta\theta\leq 90^{\circ}$. The results of all 7 studied Aquarius haloes (in 21 projections) are given in Fig. 7 to Fig. 13. As mentioned above, the probability density distribution of $R_{\rm cusp}$ often shows two peaks for the smooth haloes which are produced by the major and minor cusps, respectively. For the “naked” cusp cases (where the central diamond caustic protrudes the outer elliptical caustic), the distributions of $R_{\rm cusp}$ vs. the opening angle $\Delta\theta$ are somewhat truncated below certain opening angles (see Fig. 9 for the halo Aq-C-2’s $Y$-projection for an example). Empirically, it is rare for massive lensing galaxies to produce naked cusps. There is only one candidate APM08279 (Lewis et al. 2002), and that is likely due to lensing by an edge-on spiral rather than an elliptical. The four naked cusp cases from our simulations are caused by the large cores in the central density profiles of the lensing galaxies. We exclude these four naked cusp cases in the final statistic calculations (their inclusion does not significantly alter our results). Strong violations of the cusp-caustic relation due to substructures are seen in some cases, e.g. for the $Y$-projection of the Aq-B-2 halo (see Fig. 8). However, most of these cases have small cusp-lensing cross-sections (listed in Table 3, Column 8), defined as the areas covered by cusp sources whose images satisfy $\Delta\theta\leq 90^{\circ}$. The mean probability of cusp violations calculated below are weighted by the cross-sections (see eq. 12). As can be seen from Fig. 7 to Fig. 12, the scatter in the cusp violation is large between different projections of different haloes. Also notice that the halo Aq-A-2 at $z=0.6$ (Fig. 13) does not show a significant difference from the redshift-zero haloes in the violation of the cusp-caustic relation. To see which massive substructures cause the cusp-caustic violation, we calculate the $R_{\rm cusp}$ distribution due to subhaloes more massive than $10^{5}h^{-1}M_{\odot}$, $10^{6}h^{-1}M_{\odot}$, $10^{7}h^{-1}M_{\odot}$, and $10^{8}h^{-1}M_{\odot}$, respectively. Fig. 14 shows one typical example, for the halo Aq-D-2 along the $Z$-projection. We find that in most cases substructures with masses $m_{\rm sub}\leq 10^{7}$ to $10^{8}h^{-1}M_{\odot}$ dominate the contribution to the violations of the cusp-caustic relation (see the Col (9): $M_{\rm sub,cr}$ in Table 3). Notice that previous studies on cusp violations typically resolve haloes larger than $\sim 10^{8}h^{-1}M_{\odot}$, and thus would not have been able to evaluate the effects of substructure accurately. However, the addition of subhaloes with $m_{\rm sub}\la 10^{6}h^{-1}M_{\odot}$ does not appear to increase the violation frequency significantly (compare the three right panels). We return to the convergence issue as a function of subhalo mass in §5. Notice that most subhaloes that are projected close to the critical curves are due to chance alignment. Fig. 15 shows the spherical halocentric distance distribution for the subhaloes that are within a projected distance of 0.05 $r_{200}$ ($\sim 2.5$ Einstein radii). The fractions of subhaloes that are physically located within a spherical radius of 0.05 $r_{200}$ are 15%, 18%, 15% and 0% for subhaloes more massive than $10^{5}h^{-1}M_{\odot}$, $10^{6}h^{-1}M_{\odot}$, $10^{7}h^{-1}M_{\odot}$ and $10^{8}h^{-1}M_{\odot}$, respectively. The large median halocentric distances, $\sim 0.2$ $r_{200}$ in all cases, also show that projection effects are substantial. ### 4.2 Comparison with observations Keeton et al. (2003) summarised 19 published quadruply imaged systems. Seven of them are detected at radio wavelengths444B0128+437 (Phillips et al. 2000), B0712+472 (Jackson et al. 1998; Jackson et al. 2000), B1422+231 (Impey et al. 1996; Patnaik & Narasimha 2001), B1555+375 (Marlow et al. 1999), B1608+656 (Koopmans & Fassnacht 1999), B1933+503 (Cohn et al. 2001) and B2045+265 (Fassnacht et al. 1999).. Radio lenses are free from dust extinction. Due to their large emission regions, they are less likely to be affected by microlensing. In contrast, microlensing is likely to affect optical/IR flux ratios and so we treat them differently below. Dalal & Kochanek (2002) studied seven four-image radio-lensing systems: MG0414+0534 (Hewitt et al. 1992), B0712+472 (Jackson et al. 1998), PG1115+080 (Weymann et al. 1980), B1422+231 (Patnaik & Narasimha 2001), B1608+656 (Fassnacht et al. 1996), B1933+503 (Sykes et al. 1998) and B2045+265 (Fassnacht et al. 1999) and found that six show anomalous flux ratios, which might be due to the effects of substructure lensing. Among all the detected radio lenses, three (B0712+472, B1422+231 and B2045+265) show a typical cusp- caustic geometry (with $\Delta\theta\leq 90^{\circ}$) and violations of the cusp-caustic relation. Another two lensing systems observed in the optical/IR band are also cusp-caustic lenses with $\Delta\theta\leq 90^{\circ}$: RXJ1131-1231 (Sluse et al. 2003) and RXJ0911+0551 (Bade et al. 1997; Burud et al. 1998). Both have unexpected large values of $R_{\rm cusp}$, which were shown to have been affected by microlensing (Morgan et al. 2006; Anguita et al. 2008). Table 2 lists the $R_{\rm cusp}$ and $\Delta\theta$ values for the five observed cusp-caustic lenses. Three out of the five cusp lenses are detected at radio wavelengths, thus their large $R_{\rm cusp}$ values are unlikely due to microlensing. We treat these three radio lenses as cusp- caustic violations due to substructure lensing. Below we will calculate the probability for the simulations to reproduce such an observed violation rate. For each galaxy and each projection, we calculate the violation probability that the predicted $R_{\rm cusp}$ is larger than the observed $R_{\rm cusp}$ value 0.187 for B1422+231, which shows the smallest violation (smallest $R_{\rm cusp}$ value) among the five cusp lenses with $\Delta\theta\leq 90^{\circ}$. The cross-section weighted violation probability is given by $p_{\sigma}=\sum_{i}f_{\sigma,i}\,p_{i}(R_{\rm cusp}\geq 0.187|\Delta\theta\leq 90^{\circ}),f_{\sigma,i}=\frac{\sigma_{i}}{\sum_{i}\sigma_{i}},$ (12) where the summation $i=1,\cdot\cdot\cdot,(21-4)$ is for the seven haloes along the three independent projections of each, excluding the four naked cusp cases, and $\sigma_{i}$ is the cross-section in the source plane for producing three close images with opening angle $\Delta\theta\leq 90^{\circ}$. Using the above formula, we find the mean probability $p_{\sigma}\approx 6.4\%$ for $R_{\rm cusp}\geq 0.187$. Notice that this probability estimate is only approximate, since we have not considered the magnification bias (e.g. Turner et al. 1984). Table 2: The image opening angle and $R_{\rm cusp}$ for the observed cusp-caustic lenses, taken from Amara et al. (2006). Lens | $\Delta\theta$ | $R_{\rm cusp}$ | Band ---|---|---|--- B0712+472 | 79.8∘ | 0.26 $\pm$ 0.02 | radio B2045+265 | 35.3∘ | 0.501 $\pm$ 0.035 | radio B1422+231 | 74.9∘ | 0.187 $\pm$ 0.006 | radio RXJ1131 - 1231 | 69.0∘ | 0.355 $\pm$ 0.015 | optical/IR RXJ0911 + 0551 | 69.6∘ | 0.192 $\pm$ 0.011 | optical/IR To have three (radio) lensing cases with $R_{\rm cusp}\geq 0.187$ (due to substructure lensing rather than microlensing) out of the five cusp lenses ($\Delta\theta\leq 90^{\circ}$) observed so far, the probability is $C_{5}^{3}p_{\sigma}^{3}(1-p_{\sigma})^{2}\approx 2.3\times 10^{-3}$. The low probability suggests that the subhalo populations in the inner regions of the Aquarius haloes with Hernquist galaxies are insufficient to explain the observed frequency of flux anomalies in the cusp lenses. ## 5 DISCUSSION AND CONCLUSIONS In this paper, we have used the ultra-high resolution Aquarius simulations to study the effects of substructure lensing. We incorporate the effects of baryons in the main halo by adding a stellar component (modelled as a Hernquist profile), and then take into account its effects on the dark matter halo through adiabatic contraction. The density profiles and lensing properties except the flux ratios are broadly consistent with the observed gravitational lenses. Using Monte Carlo simulations, we find large numerical noise for an isothermal halo populated with $10^{8}$ particles, which shows considerable scatter in the $R_{\rm cusp}$ distribution for cusp lenses. In the end, we therefore study the substructure lensing by modelling the smooth underlying galaxy halo as an isothermal ellipsoid and superimposing the subhalo population from the Aquarius simulations. In this way, we focus on the lensing effects of subhaloes and avoid any confusion from numerical noise in the $N$-body realisation of the simulated main haloes. Our study finds that even with the much better resolved subhalo population of the Aquarius simulations, the observed cusp lenses still violate the cusp- caustic relation more frequently than predicted by $N$-body simulations. The Aquarius haloes are Milky Way type haloes in terms of their masses, while many lenses are ellipticals, which are more massive. Among the five cusp lenses we compare our results with, three of them (B2045+265, RXJ1131-1231, RXJ0911) are more massive than our simulated haloes and have Einstein radii twice as large as those of our haloes. The other two lenses (B0712+472, B1422+231) have Einstein radii and velocities (circular velocity or velocity dispersion) roughly comparable to the relatively massive haloes in the Aquarius simulations. As shown in Fig. 2 (the right panel) the projected subhalo mass fraction increases with the projected radius $R$. If we have under-estimated the Einstein radii $b_{I}$ (e.g. because of uncertainties in the addition of the central galaxies), we could have potentially under- estimated the violation rates due to the lack of enough substructures at smaller radii. We artificially increase the Einstein radii of the simulated haloes by a factor of two to study the violation probabilities due to a higher fraction of substructures at larger radii. The mean subhalo mass fraction within a $0.1\arcsec$-annulus around the new Einstein radius would increase from $f_{\rm sub,annu}$ $\approx$ 0.19% to 0.24%, and the mean violation probability would increase from $p_{\sigma}\approx$ 6.4% to 14.0%. The probability of reproducing the observed violation rate would increase from 0.2% to 2%. Another concern is that due to the finite particle mass in $N$-body simulations, the central cusps of the subhaloes may not be resolved, which may potentially result in an under-estimation of the ability of the subhaloes to induce perturbations to the lensing potential. We consider an extreme case assuming all subhaloes are point-like sources with their masses and locations from the simulations. In this scenario, $f_{\rm sub,annu}$ roughly remains at 0.18%, however, $p_{\sigma}$ increases to 15.1%. The probability to reproduce the observed violation rate increases to 2.5%. These low probabilities suggest that the subhalo populations in the central regions of the Aquarius haloes are not sufficient to explain the observed frequency of violations of the cusp-caustic relations. It is important to ask whether our results will change significantly if even lower-mass subhaloes are resolved. We argue that this is unlikely to be the case. The total subhalo lensing cross-section is an integral of the cross-section of subhaloes of each mass weighted by their abundance. As shown in §4, most of the perturbing subhaloes have relatively low mass ($m_{\rm sub}\leq 10^{7}$ to $10^{8}h^{-1}M_{\odot}$). Their abundance scales as ${\rm d}N(m_{\rm sub})/{\rm d}m_{\rm sub}\propto m_{\rm sub}^{-1.9}$. For a galaxy (subhalo) approximated by a SIS, the lensing cross-section roughly scales as $\sigma^{4}$ (e.g. Turner et al. 1984) where $\sigma$ is the one-dimensional velocity dispersion. For Aquarius subhaloes, $m_{\rm sub}\propto V_{\rm max}^{3}$ (Springel et al. 2008), where $V_{\rm max}$ is the maximum circular velocity. If $\sigma\propto V_{\rm max}$, then the integrated lensing cross- section will be $\propto m_{\rm sub}^{0.43}$. On the other hand, for a point lens or an elliptical galaxy, the lensing cross-section is proportional to the lens mass, and the integrated lensing cross-section would be $\propto m_{\rm sub}^{0.1}$. In all these cases, the subhalo lensing cross-sections are biased towards relatively massive subhaloes in the projected central region, and the incorporation of even lower mass subhaloes should not change our results significantly. We mention in passing that a warm dark matter scenario would suppress the formation of small subhaloes, making it even more difficult to explain the observed cusp violations (see e.g. Miranda & Macciò 2007). Below, we compare our study with previous work, before discussing its limitations and outlining possible future work. ### 5.1 Comparison with previous studies There have been a number of studies of substructure lensing using numerically simulated haloes, including those from hydrodynamical simulations. Below we compare a few of these studies with our own. Dalal & Kochanek (2002) concluded that at the 90% confidence level, a substructure fraction of 0.6% to 7% can explain the observed anomalous flux ratio. For the Aquarius subhalo population, Table 3 Col (5): $f_{\rm sub,annu}$ shows such fraction averaged over a thin annulus around the outer tangential curve, which is always below 1%, sometimes much smaller (not to be confused with $f_{\rm sub}$ in Table 1 and Fig. 2, which refers to the subhalo mass fraction within $r_{200}$). This is the primary reason why our predicted cusp violations are smaller than the observed violation frequencies. Bradač et al. (2004) used hydrodynamical simulations of Steinmetz & Navarro (2002) and concluded that the predicted cusp violations due to substructure are comparable to those observed. Their simulated halo has $\sim 10^{5}$ particles, resolving subhaloes down to $5\times 10^{8}M_{\odot}$. As the authors pointed out, the numerical noise may be as high as 5%. The observed high-order singularities in their simulations are much higher than ours (comparable to the caustic structure shown in Fig. 5 for $10^{6}$ particles). It is possible that their high numerical noise may have produced too many artificial violations, although we note that they used Voroni density estimation to reduce the discreteness noise. Our conclusion that the dark matter subhalo population may be insufficient to explain the observed cusp violations is consistent with Mao et al. (2004), Amara et al. (2006), Macciò et al. (2006) and Macciò & Miranda (2006). The number of particles used in those studies is roughly two orders of magnitude smaller than here. In particular, the study by Mao et al. (2004) found large scatter among different haloes, a conclusion confirmed by our results. ### 5.2 Limitations of the present study and future work The most severe limitation of our study is that the high-resolution simulations used here include only dark matter. Without baryons, these haloes are sub-critical (see §2) and incapable of producing multiple images. We are therefore forced to incorporate a model for the baryonic galaxy at the centre of each halo. The galaxy changes not only the overall dark matter profiles (taken into account by adiabatic contraction), but also the dynamical evolution of subhaloes, an effect which is not considered here. On the one hand, the increased baryonic density at the centre of the halo will make the subhaloes feel stronger tidal forces, particularly those that come close to the centre. On the other hand, the baryons within subhaloes will make them more resilient to tidal disruption. It is not clear which effect will dominate. We comment, however, that the subhaloes that come very close to the centre may have already been tidally stripped or disrupted, and thus most of the surviving subhaloes that can be identified by SUBFIND may have quite large peri-centre passages. As a result, the effects of baryons in the host halo may not change the results very significantly. However, we caution that, SUBFIND, like most substructure finders, has difficulties in identifying subhaloes in the densest regions of the halo and assigning them correct masses. Empirically the Milky Way does not seem to host many luminous satellites close to the centre. Hydrodynamical simulations can in principle address this issue directly (subject to the uncertainties in the treatment of gas processes). Macciò et al. (2006) found a factor of two increase in the number of surviving satellite galaxies (with masses above $10^{7}M_{\odot}$) in the centres of galaxies when including baryons in the CDM simulations, but concluded that even this was not sufficient to explain the flux anomaly problem. Observationally, it is interesting that more than one half of the CLASS lenses appear to show luminous companion galaxies in projection (Bryan et al. 2008; Jackson et al. 2009), and their inclusion in the models appears to alleviate the anomalous flux ratio problem (see below). This may be just a statistical fluke due to the small sample size (22 lenses in total) or some of these may be due to chance alignment along the line-of-sight (Chen et al. 2003; Wambsganss et al. 2005; Metcalf 2005a,b; Miranda & Macciò 2007). Nevertheless, for the three radio lenses that show apparent cusp violations (see Table 2), the most serious case is B2045+265 with $R_{\rm cusp}\approx 0.5$. Recently, McKean et al. (2007) found a galaxy, G2, which is about 0.66 $\arcsec$ away from the main lensing galaxy G1 (at redshift 0.867), and about 3.6 to 4.5 magnitudes fainter than G1 depending on the wavelength. The photometric redshift of G2 is consistent with that of G1 (although also consistent with a redshift $\sim 4-5$). The inclusion of this faint satellite galaxy in the model can explain the flux anomaly reasonably well, although the satellite is required to be very flattened with an axis ratio of 8:1, which may not be realistic. This case highlights the potential roles that the luminous satellites may play in the anomalous flux ratio problem. We note, however, that numerical simulations by Dolag et al. (2008) showed that star-dominated galaxies (not traced by dark matter only simulations) appear to contribute only $\sim 10\%$ of the subhalo population in clusters of galaxies. It is unclear however whether this cluster-based result can be extrapolated to galaxy scales where cooling is more efficient. We plan to use semi-analytical galaxy catalogues in the Aquarius simulations to address this issue more quantitatively in subsequent work. Substructures not only perturb the flux ratios, but also affect the image positions. In Table 3, we show the maximum perturbation of the deflection angle, $\alpha_{\rm sub,max}$, within the central $2\arcsec\times 2\arcsec$ region, produced by all the subhaloes within $r_{200}$. The maximum deviations range from a few milli-arcseconds to $<0.1$ arcseconds. They may leave observable signatures on close pair images such as that observed in MG2016+112 (Koopmans et al. 2002; More et al. 2009). We find that most of these astrometric deviations are dominated by one large, nearby subhalo. This clearly warrants further work in the near future. ## Acknowledgements We thank Ian Browne, Neal Jackson, and Peter Schneider for useful discussions. We also acknowledge an anonymous referee for constructive comments that improved the paper. DDX has been supported by a Dorothy Hodgkin fellowship for her postgraduate studies. LG acknowledges support from a STFC advanced fellowship, one-hundred-talents program of the Chinese Academy of Sciences (CAS) and the National basic research program of China (973 program under grant No. 2009CB24901). SM acknowledges travel support from the Humboldt Foundation and European Community’s Sixth Framework Marie Curie Research Training Network Programme, contract number MRTN-CT-2004-505183 “ANGLES”. GL is supported by the Humboldt Foundation. The simulations for the Aquarius Project were carried out at the Leibniz Computing Centre, Garching, Germany, at the Computing Centre of the Max-Planck-Society in Garching, at the Institute for Computational Cosmology in Durham, and on the ‘STELLA’ supercomputer of the LOFAR experiment at the University of Groningen. Figure 7: Lensing properties for the halo Aq-A-2, in three independent projections. The top panels show the critical curves (red) and caustics (blue) superimposed on top of the subhalo population. The middle panels show $R_{\rm cusp}$ vs. the image opening angle $\Delta\theta$. Large $R_{\rm cusp}$ values (red) are due to substructure. The triangle pattern (green) gives predictions for the smooth counterparts. The bottom panels show the corresponding probability distribution functions (PDFs) of $R_{\rm cusp}$ for cusp sources with $\Delta\theta\leq 90^{\circ}$. The violation of the cusp-caustic relation can be seen from the excess of $R_{\rm cusp}$ at large values (red) over the smooth counterpart curve (green). The $R_{\rm cusp}$ values for the three radio and two optical/IR cusp lenses are indicated by vertical solid and dashed bars (see Table 2). Figure 8: For the halo Aq-B-2, the symbols are the same as in Fig. 7. The truncated triangle pattern in the $Z$-projection is due to naked cusps of the central caustic. The strong violation of the cusp-caustic relation seen in the $Y$-projection is caused by subhaloes with $m_{\rm sub}\leq 10^{8}h^{-1}M_{\odot}$ with a violation rate $P(R_{\rm cusp}\geq 0.187)=64\%$. Figure 9: For the halo Aq-C-2, the symbols are the same as in Fig. 7. The truncated triangle pattern in the $Y$-projection is due to naked cusps of the central caustic. The halo in this projection has large ellipticity, which results in large $R_{\rm cusp}$ values. The strong violation in the $X$-projection is caused by subhaloes with $m_{\rm sub}\leq 10^{8}h^{-1}M_{\odot}$ with a violation rate $P(R_{\rm cusp}\geq 0.187)=19\%$. Figure 10: For the halo Aq-D-2, the symbols are the same as in Fig. 7. The strong violations in the $Y$\- and $Z$-projection are caused by subhaloes with $m_{\rm sub}\leq 10^{7}h^{-1}M_{\odot}$ and $m_{\rm sub}\leq 10^{8}h^{-1}M_{\odot}$, respectively, with violation rates $P(R_{\rm cusp}\geq 0.187)=9.7\%$ ($Y$-projection) and $31\%$ ($Z$-projection). Figure 11: For the halo Aq-E-2, the symbols are the same as in Fig. 7. Figure 12: For the halo Aq-F-2, the symbols are the same as in Fig. 7. The truncated triangle pattern in the $Y$-projection is due to naked cusps of the central caustic. The strong violation in the $Z$-projection is mainly caused by subhaloes with $m_{\rm sub}\leq 10^{7}h^{-1}M_{\odot}$ with a violation rate $P(R_{\rm cusp}\geq 0.187)=6.7\%$. Figure 13: For the halo Aq-A-2 at $z$=0.6, the symbols are the same as in Fig. 7. The strong violation in the $Y$-projection is caused by subhaloes with $m_{\rm sub}\leq 10^{8}h^{-1}M_{\odot}$; a cusp violation rate is $P(R_{\rm cusp}\geq 0.187)=56\%$. Figure 14: Effects of substructure lensing as a function of the lower cutoff subhalo mass for the halo Aq-D-2 along the $Z$-projection. The upper panels show the projected substructures with masses above a threshold. The projected centres of the subhaloes and the corresponding critical curves are plotted at the top. From the left to the right, the lower cutoff subhalo mass changes from $10^{8}h^{-1}M_{\odot}$, $10^{7}h^{-1}M_{\odot}$, $10^{6}h^{-1}M_{\odot}$ to $10^{5}h^{-1}M_{\odot}$. The bottom panels show the corresponding probability distribution functions of $R_{\rm cusp}$. Most substructures that survive and are projected within the central few kpc are low-mass subhaloes ($\leq 10^{8}$ $h^{-1}M_{\odot}$), which dominate the violation of the cusp- caustic relation. Figure 15: Distribution of halocentric distances of the subhaloes projected within 0.05 $r_{200}$ ($\sim$ 2.5 times the Einstein radius, indicated by the dotted line in each panel). The solid lines give the median spherical halocentric distances of the subhaloes; all are around 0.2 $r_{200}$. The average number of subhaloes $\bar{N}$ is indicated inside each panel. Table 3: Substructure-lensing parameters of Aquarius haloes: Halo Name | $b_{\rm I}$ | $q_{3}$ | $S_{0}$ | $f_{\rm sub,annu}$ | $\alpha_{\rm sub,max}$ | $P(R_{\rm cusp}\geq 0.187)$ | $f_{\sigma}(\Delta\theta\leq 90^{\circ})$ | $M_{\rm sub,cr}$ ---|---|---|---|---|---|---|---|--- Projection | ($\arcsec$) | | ($\arcsec$) | (per cent) | ($\arcsec$) | (per cent) | (per cent) | ($h^{-1}M_{\odot}$) Aq-A-2 | | | | | | | | X-projection | 0.602 | 0.77 | 0.103 | 0.11 | 0.065 | 5.90 | 4.85 | $10^{7}\Downarrow$ Y-projection | 0.657 | 0.78 | 0.092 | 0.69 | 0.059 | 1.26 | 5.76 | $10^{8}\Uparrow$ Z-projection | 0.647 | 0.76 | 0.091 | 0.01 | 0.055 | 0.08 | 6.59 | $10^{7}\Downarrow$ Aq-B-2 | | | | | | | | X-projection | 0.306 | 0.73 | 0.076 | 0.42 | 0.008 | 5.91 | 2.16 | — Y-projection | 0.408 | 0.91 | 0.071 | 0.48 | 0.007 | 64.13 | 0.41 | $10^{8}\Downarrow$ Z-projection | 0.286 | 0.64 | 0.080 | 0.09 | 0.012 | 0.09 | 0.77 | — Aq-C-2 | | | | | | | | X-projection | 0.846 | 0.91 | 0.085 | 0.13 | 0.015 | 19.09 | 1.07 | $10^{8}\Downarrow$ Y-projection | 0.571 | 0.60 | 0.107 | 0.06 | 0.002 | 13.98 | 21.41 | — Z-projection | 0.589 | 0.70 | 0.104 | 0.03 | 0.007 | 3.71 | 10.58 | $10^{7}\Downarrow$ Aq-D-2 | | | | | | | | X-projection | 0.576 | 0.83 | 0.101 | 0.13 | 0.006 | 3.79 | 2.13 | $10^{7}\Downarrow$ Y-projection | 0.655 | 0.91 | 0.088 | 0.06 | 0.005 | 9.72 | 0.57 | $10^{7}\Downarrow$ Z-projection | 0.583 | 0.79 | 0.101 | 0.40 | 0.011 | 30.58 | 4.48 | $10^{8}\Downarrow$ Aq-E-2 | | | | | | | | X-projection | 0.473 | 0.69 | 0.076 | 0.18 | 0.020 | 3.04 | 7.62 | $10^{8}\Downarrow$ Y-projection | 0.548 | 0.79 | 0.056 | 0.13 | 0.007 | 5.40 | 3.29 | $10^{7}\Downarrow$ Z-projection | 0.474 | 0.82 | 0.069 | 0.05 | 0.006 | 0.65 | 1.59 | $10^{7}\Downarrow$ Aq-F-2 | | | | | | | | X-projection | 0.416 | 0.86 | 0.080 | 0.19 | 0.021 | 5.83 | 0.67 | $10^{8}\Downarrow$ Y-projection | 0.370 | 0.67 | 0.091 | 0.09 | 0.009 | 1.38 | 3.78 | — Z-projection | 0.435 | 0.85 | 0.088 | 0.22 | 0.012 | 6.74 | 0.78 | $10^{8}\Downarrow$ Aq-A-2 ($Z$ = 0.6) | | | | | | | | X-projection | 0.568 | 0.71 | 0.079 | 0.11 | 0.008 | 0.60 | 7.75 | $10^{8}\Downarrow$ Y-projection | 0.731 | 0.89 | 0.054 | 0.70 | 0.022 | 55.81 | 1.74 | $10^{8}\Downarrow$ Z-projection | 0.592 | 0.69 | 0.082 | 0.33 | 0.083 | 7.56 | 12.00 | $10^{8}\Downarrow$ Note: Cols (2-4): $b_{\rm I}$, $q_{3}$ and $S_{0}$, the Einstein radius, axis ratio and core radius of the fitted isothermal ellipsoid (see eq. [11]); Col (5): $f_{\rm sub,annu}$ is the subhalo mass fraction within a $0.1\arcsec$-annulus around the outer critical curve; Col (6): $\alpha_{\rm sub,max}$ is the maximum magnitude in the projected central $2\arcsec\times 2\arcsec$ region of the deflection angle due to all substructures within $r_{200}$, usually found close to an individual subhalo; Col (7): $P(R_{\rm cusp}\geq 0.187)$ is the probability (in per cent) for sources with $\Delta\theta\leq 90^{\circ}$ (defined as “cusp sources”) to have $R_{\rm cusp}\geq 0.187$, referred to as the “cusp-caustic violation probability”; Col (8): $f_{\sigma}(\Delta\theta\leq 90^{\circ})$ is the cross-section fraction (as defined in eq. [12]) in the source plane for producing three close images with opening angle $\Delta\theta\leq 90^{\circ}$; Col (9): $M_{\rm sub,cr}$ is the critical subhalo mass that causes the strong violation of the cusp-caustic relation. Arrows indicate “above” or “below”. Lenses with naked cusps of the caustic always have low cusp-caustic violation probability and are labelled as “—”. ## References * Abadi et al. (2009) Abadi M. G., Navarro J. F., Fardal M., Babul A., Steinmetz M., 2009, ArXiv e-prints * Amara et al. (2006) Amara A., Metcalf R. B., Cox T. J., Ostriker J. P., 2006, MNRAS, 367, 1367 * Anguita et al. (2008) Anguita T., Faure C., Yonehara A., Wambsganss J., Kneib J.-P., Covone G., Alloin D., 2008, A&A, 481, 615 * Bade et al. (1997) Bade N., Siebert J., Lopez S., Voges W., Reimers D., 1997, A&A, 317, L13 * Barnes & White (1984) Barnes J., White S. D. M., 1984, MNRAS, 211, 753 * Belokurov et al. (2007) Belokurov V., Zucker D. B., Evans N. W., Kleyna J. T., Koposov S., Hodgkin S. T., Irwin M. J., Gilmore G., Wilkinson M. I., Fellhauer M., Bramich D. M., Hewett P. C., Vidrih S., De Jong J. T. A., Smith J. A., Rix H.-W., Bell E. F., Wyse R. F. G., Newberg H. J., 2007, ApJ, 654, 897 * Benson et al. (2002) Benson A. J., Frenk C. S., Lacey C. G., Baugh C. M., Cole S., 2002, MNRAS, 333, 177 * Biggs et al. (2004) Biggs A. D., Browne I. W. A., Jackson N. J., York T., Norbury M. A., McKean J. P., Phillips P. M., 2004, MNRAS, 350, 949 * Blandford & Narayan (1986) Blandford R., Narayan R., 1986, ApJ, 310, 568 * Blumenthal et al. (1986) Blumenthal G. R., Faber S. M., Flores R., Primack J. R., 1986, ApJ, 301, 27 * Bolton et al. (2008) Bolton A. S., Treu T., Koopmans L. V. E., Gavazzi R., Moustakas L. A., Burles S., Schlegel D. J., Wayth R., 2008, ApJ, 684, 248 * Bradač et al. (2004) Bradač M., Schneider P., Lombardi M., Steinmetz M., Koopmans L. V. E., Navarro J. F., 2004, A&A, 423, 797 * Browne et al. (2003) Browne I. W. A., Wilkinson P. N., Jackson N. J. F., Myers S. T., Fassnacht C. D., Koopmans L. V. E., Marlow D. R., Norbury M., Rusin D., Sykes C. M., Biggs A. D., Blandford R. D., de Bruyn A. G., Chae K.-H., Helbig P., King L. J., McKean J. P., Pearson T. J., Phillips P. M., Readhead A. C. S., Xanthopoulos E., York T., 2003, MNRAS, 341, 13 * Bryan et al. (2008) Bryan S. E., Mao S., Kay S. T., 2008, MNRAS, 391, 959 * Bullock et al. (2000) Bullock J. S., Kravtsov A. V., Weinberg D. H., 2000, ApJ, 539, 517 * Burud et al. (1998) Burud I., Courbin F., Lidman C., Jaunsen A. O., Hjorth J., Ostensen R., Andersen M. I., Clasen J. W., Wucknitz O., Meylan G., Magain P., Stabell R., Refsdal S., 1998, ApJ Letters, 501, L5+ * Chen et al. (2003) Chen J., Kravtsov A. V., Keeton C. R., 2003, ApJ, 592, 24 * Chen et al. (2007) Chen J., Rozo E., Dalal N., Taylor J. E., 2007, ApJ, 659, 52 * Chiba (2002) Chiba M., 2002, ApJ, 565, 17 * Chiba et al. (2005) Chiba M., Minezaki T., Kashikawa N., Kataza H., Inoue K. T., 2005, ApJ, 627, 53 * Cohn et al. (2001) Cohn J. D., Kochanek C. S., McLeod B. A., Keeton C. R., 2001, ApJ, 554, 1216 * Congdon & Keeton (2005) Congdon A. B., Keeton C. R., 2005, MNRAS, 364, 1459 * Congdon et al. (2008) Congdon A. B., Keeton C. R., Nordgren C. E., 2008, MNRAS, 389, 398 * Dalal & Kochanek (2002) Dalal N., Kochanek C. S., 2002, ApJ, 572, 25 * Diemand et al. (2007) Diemand J., Kuhlen M., Madau P., 2007, ApJ, 657, 262 * Dolag et al. (2008) Dolag K., Borgani S., Murante G., Springel V., 2008, ArXiv e-prints 0808.3401 * Efstathiou (1992) Efstathiou G., 1992, MNRAS, 256, 43P * Einasto (1966) Einasto J., 1966, Transactions of the International Astronomical Union, Series B, 12, 436 * Evans & Witt (2003) Evans N. W., Witt H. J., 2003, MNRAS, 345, 1351 * Fassnacht et al. (1999) Fassnacht C. D., Blandford R. D., Cohen J. G., Matthews K., Pearson T. J., Readhead A. C. S., Womble D. S., Myers S. T., Browne I. W. A., Jackson N. J., Marlow D. R., Wilkinson P. N., Koopmans L. V. E., de Bruyn A. G., Schilizzi R. T., Bremer M., Miley G., 1999, AJ, 117, 658 * Fassnacht et al. (1996) Fassnacht C. D., Womble D. S., Neugebauer G., Browne I. W. A., Readhead A. C. S., Matthews K., Pearson T. J., 1996, ApJ Letters, 460, L103+ * Gao et al. (2004) Gao L., De Lucia G., White S. D. M., Jenkins A., 2004, MNRAS, 352, L1 * Gavazzi et al. (2007) Gavazzi R., Treu T., Rhodes J. D., Koopmans L. V. E., Bolton A. S., Burles S., Massey R. J., Moustakas L. A., 2007, ApJ, 667, 176 * Ghigna et al. (2000) Ghigna S., Moore B., Governato F., Lake G., Quinn T., Stadel J., 2000, ApJ, 544, 616 * Gnedin (2000) Gnedin N. Y., 2000, ApJ, 542, 535 * Gnedin et al. (2004) Gnedin O. Y., Kravtsov A. V., Klypin A. A., Nagai D., 2004, ApJ, 616, 16 * Hernquist (1990) Hernquist L., 1990, ApJ, 356, 359 * Hewitt et al. (1992) Hewitt J. N., Turner E. L., Lawrence C. R., Schneider D. P., Brody J. P., 1992, AJ, 104, 968 * Hockney & Eastwood (1981) Hockney R. W., Eastwood J. W., 1981, Computer Simulation Using Particles. Computer Simulation Using Particles, New York: McGraw-Hill, 1981 * Impey et al. (1996) Impey C. D., Foltz C. B., Petry C. E., Browne I. W. A., Patnaik A. R., 1996, ApJ Letters, 462, L53+ * Jackson et al. (1998) Jackson N., Nair S., Browne I. W. A., Wilkinson P. N., Muxlow T. W. B., de Bruyn A. G., Koopmans L., Bremer M., Snellen I., Miley G. K., Schilizzi R. T., Myers S., Fassnacht C. D., Womble D. S., Readhead A. C. S., Blandford R. D., Pearson T. J., 1998, MNRAS, 296, 483 * Jackson et al. (2000) Jackson N., Xanthopoulos E., Browne I. W. A., 2000, MNRAS, 311, 389 * Jackson et al. (2009) Jackson et al. N., 2009, in preparation * Jiang & Kochanek (2007) Jiang G., Kochanek C. S., 2007, ApJ, 671, 1568 * Kauffmann et al. (1993) Kauffmann G., White S. D. M., Guiderdoni B., 1993, MNRAS, 264, 201 * Keeton (2001) Keeton C. R., 2001, ApJ, 561, 46 * Keeton et al. (2003) Keeton C. R., Gaudi B. S., Petters A. O., 2003, ApJ, 598, 138 * Keeton & Kochanek (1998) Keeton C. R., Kochanek C. S., 1998, ApJ, 495, 157 * Keeton & Moustakas (2008) Keeton C. R., Moustakas L. A., 2008, ArXiv e-prints 0805.0309 * Klypin et al. (1999) Klypin A., Kravtsov A. V., Valenzuela O., Prada F., 1999, ApJ, 522, 82 * Kochanek (1991) Kochanek C. S., 1991, ApJ, 373, 354 * Kochanek & Dalal (2004) Kochanek C. S., Dalal N., 2004, ApJ, 610, 69 * Kochanek & White (2001) Kochanek C. S., White M., 2001, ApJ, 559, 531 * Koopmans et al. (2003) Koopmans L. V. E., Biggs A., Blandford R. D., Browne I. W. A., Jackson N. J., Mao S., Wilkinson P. N., de Bruyn A. G., Wambsganss J., 2003, ApJ, 595, 712 * Koopmans & Fassnacht (1999) Koopmans L. V. E., Fassnacht C. D., 1999, ApJ, 527, 513 * Koopmans et al. (2002) Koopmans L. V. E., Garrett M. A., Blandford R. D., Lawrence C. R., Patnaik A. R., Porcas R. W., 2002, MNRAS, 334, 39 * Koopmans et al. (2006) Koopmans L. V. E., Treu T., Bolton A. S., Burles S., Moustakas L. A., 2006, ApJ, 649, 599 * Lewis et al. (2002) Lewis G. F., Carilli C., Papadopoulos P., Ivison R. J., 2002, MNRAS, 330, L15 * Li et al. (2006) Li G.-L., Mao S., Jing Y. P., Kang X., Bartelmann M., 2006, ApJ, 652, 43 * Li & Ostriker (2003) Li L.-X., Ostriker J. P., 2003, ApJ, 595, 603 * Macciò & Miranda (2006) Macciò A. V., Miranda M., 2006, MNRAS, 368, 599 * Macciò et al. (2006) Macciò A. V., Moore B., Stadel J., Diemand J., 2006, MNRAS, 366, 1529 * Madau et al. (2008) Madau P., Diemand J., Kuhlen M., 2008, ApJ, 679, 1260 * Mao (1992) Mao S., 1992, ApJ, 389, 63 * Mao et al. (2004) Mao S., Jing Y., Ostriker J. P., Weller J., 2004, ApJ Letters, 604, L5 * Mao & Schneider (1998) Mao S., Schneider P., 1998, MNRAS, 295, 587 * Marlow et al. (1999) Marlow D. R., Myers S. T., Rusin D., Jackson N., Browne I. W. A., Wilkinson P. N., Muxlow T., Fassnacht C. D., Lubin L., Kundić T., Blandford R. D., Pearson T. J., Readhead A. C. S., Koopmans L., de Bruyn A. G., 1999, AJ, 118, 654 * McKean et al. (2007) McKean J. P., Koopmans L. V. E., Flack C. E., Fassnacht C. D., Thompson D., Matthews K., Blandford R. D., Readhead A. C. S., Soifer B. T., 2007, MNRAS, 378, 109 * Metcalf (2002) Metcalf R. B., 2002, ApJ, 580, 696 * Metcalf (2005) Metcalf R. B., 2005, ApJ, 622, 72 * Metcalf & Madau (2001) Metcalf R. B., Madau P., 2001, ApJ, 563, 9 * Metcalf et al. (2004) Metcalf R. B., Moustakas L. A., Bunker A. J., Parry I. R., 2004, ApJ, 607, 43 * Metcalf & Zhao (2002) Metcalf R. B., Zhao H., 2002, ApJ Letters, 567, L5 * Miranda & Macciò (2007) Miranda M., Macciò A. V., 2007, MNRAS, 382, 1225 * Mo et al. (1998) Mo H. J., Mao S., White S. D. M., 1998, MNRAS, 295, 319 * Monaghan (1992) Monaghan J. J., 1992, Annual Review of Astronomy and Astrophysics, 30, 543 * Moore et al. (1999) Moore B., Ghigna S., Governato F., Lake G., Quinn T., Stadel J., Tozzi P., 1999, ApJ Letters, 524, L19 * More et al. (2009) More A., McKean J. P., More S., Porcas R. W., Koopmans L. V. E., Garrett M. A., 2009, MNRAS, 394, 174 * Morgan et al. (2006) Morgan N. D., Kochanek C. S., Falco E. E., Dai X., 2006, in Bulletin of the American Astronomical Society Vol. 38 of Bulletin of the American Astronomical Society, Time-Delays and Mass Models for the Quadruple Lens RXJ1131-1231. pp 927–+ * Myers et al. (2003) Myers S. T., Jackson N. J., Browne I. W. A., de Bruyn A. G., Pearson T. J., Readhead A. C. S., Wilkinson P. N., Biggs A. D., Blandford R. D., Fassnacht C. D., Koopmans L. V. E., Marlow D. R., McKean J. P., Norbury M. A., Phillips P. M., Rusin D., Shepherd M. C., Sykes C. M., 2003, MNRAS, 341, 1 * Natarajan et al. (2007) Natarajan P., De Lucia G., Springel V., 2007, MNRAS, 376, 180 * Navarro et al. (1996) Navarro J. F., Frenk C. S., White S. D. M., 1996, ApJ, 462, 563 * Navarro et al. (1997) Navarro J. F., Frenk C. S., White S. D. M., 1997, ApJ, 490, 493 * Navarro et al. (2008) Navarro J. F., Ludlow A., Springel V., Wang J., Vogelsberger M., White S. D. M., Jenkins A., Frenk C. S., Helmi A., 2008, ArXiv e-prints 0810.1522 * Oguri (2002) Oguri M., 2002, ApJ, 580, 2 * Oguri et al. (2001) Oguri M., Taruya A., Suto Y., 2001, ApJ, 559, 572 * Patnaik & Narasimha (2001) Patnaik A. R., Narasimha D., 2001, MNRAS, 326, 1403 * Phillips et al. (2000) Phillips P. M., Norbury M. A., Koopmans L. V. E., Browne I. W. A., Jackson N. J., Wilkinson P. N., Biggs A. D., Blandford R. D., de Bruyn A. G., Fassnacht C. D., Helbig P., Mao S., Marlow D. R., Myers S. T., Pearson T. J., Readhead A. C. S., Rusin D., Xanthopoulos E., 2000, MNRAS, 319, L7 * Rusin & Kochanek (2005) Rusin D., Kochanek C. S., 2005, ApJ, 623, 666 * Rusin et al. (2003) Rusin D., Kochanek C. S., Keeton C. R., 2003, ApJ, 595, 29 * Rusin & Ma (2001) Rusin D., Ma C.-P., 2001, ApJ Letters, 549, L33 * Schechter & Wambsganss (2002) Schechter P. L., Wambsganss J., 2002, ApJ, 580, 685 * Schneider et al. (1992) Schneider P., Ehlers J., Falco E. E., 1992, Gravitational Lenses. Gravitational Lenses, XIV, 560 pp. 112 figs.. Springer-Verlag Berlin Heidelberg New York. Also Astronomy and Astrophysics Library * Schneider et al. (2006) Schneider P., Kochanek C. S., Wambsganss J., 2006, Gravitational Lensing: Strong, Weak and Micro * Schneider & Weiss (1992) Schneider P., Weiss A., 1992, A&A, 260, 1 * Sluse et al. (2003) Sluse D., Surdej J., Claeskens J.-F., Hutsemékers D., Jean C., Courbin F., Nakos T., Billeres M., Khmil S. V., 2003, A&A, 406, L43 * Spergel et al. (2007) Spergel D. N., Bean R., Dore O., Nolta M. R., Bennett C. L., Dunkley J., Hinshaw G., Jarosik N., Komatsu E., Page L., Peiris H. V., Verde L., Halpern M., Hill R. S., Kogut A., Limon M., 2007, ApJ Suppl., 170, 377 * Springel (2005) Springel V., 2005, MNRAS, 364, 1105 * Springel et al. (2008) Springel V., Wang J., Vogelsberger M., Ludlow A., Jenkins A., Helmi A., Navarro J. F., Frenk C. S., White S. D. M., 2008, ArXiv e-prints 0809.0898 * Springel et al. (2005) Springel V., White S. D. M., Jenkins A., Frenk C. S., Yoshida N., Gao L., Navarro J., Thacker R., Croton D., Helly J., Peacock J. A., Cole S., Thomas P., Couchman H., Evrard A., Colberg J., Pearce F., 2005, Nature, 435, 629 * Springel et al. (2001) Springel V., Yoshida N., White S. D. M., 2001, New Astronomy, 6, 79 * Steinmetz & Navarro (2002) Steinmetz M., Navarro J. F., 2002, New Astronomy, 7, 155 * Sugai et al. (2007) Sugai H., Kawai A., Shimono A., Hattori T., Kosugi G., Kashikawa N., Inoue K. T., Chiba M., 2007, ApJ, 660, 1016 * Sykes et al. (1998) Sykes C. M., Browne I. W. A., Jackson N. J., Marlow D. R., Nair S., Wilkinson P. N., Blandford R. D., Cohen J., Fassnacht C. D., Hogg D., Pearson T. J., Readhead A. C. S., Womble D. S., Myers S. T., de Bruyn A. G., Bremer M., Miley G. K., Schilizzi R. T., 1998, MNRAS, 301, 310 * Thoul & Weinberg (1996) Thoul A. A., Weinberg D. H., 1996, ApJ, 465, 608 * Treu & Koopmans (2004) Treu T., Koopmans L. V. E., 2004, ApJ, 611, 739 * Turner et al. (1984) Turner E. L., Ostriker J. P., Gott III J. R., 1984, ApJ, 284, 1 * Wallington & Narayan (1993) Wallington S., Narayan R., 1993, ApJ, 403, 517 * Wambsganss et al. (2005) Wambsganss J., Bode P., Ostriker J. P., 2005, ApJ Letters, 635, L1 * Weymann et al. (1980) Weymann R. J., Latham D., Roger J., Angel P., Green R. F., Liebert J. W., Turnshek D. A., Turnshek D. E., Tyson J. A., 1980, Nature, 285, 641 * Williams et al. (1999) Williams L. L. R., Navarro J. F., Bartelmann M., 1999, ApJ, 527, 535 * Yoo et al. (2005) Yoo J., Kochanek C. S., Falco E. E., McLeod B. A., 2005, ApJ, 626, 51 * Yoo et al. (2006) Yoo J., Kochanek C. S., Falco E. E., McLeod B. A., 2006, ApJ, 642, 22 * Zhang (2008) Zhang M., 2008, PhD thesis, University of Manchester
arxiv-papers
2009-03-26T12:19:00
2024-09-04T02:49:01.428853
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "D. D. Xu (1), S. Mao (1), J. Wang (2,3), V. Springel (2), L. Gao (3),\n S. D. M. White (2), C. S. Frenk (3), A. Jenkins (3), G. Li (4) and J. F.\n Navarro (5) ((1) Jodrell Bank Centre for Astrophysics, (2) Max-Planck\n Institute for Astrophysics, (3) University of Durham, (4) University of Bonn,\n (5) University of Victoria)", "submitter": "Dandan Xu", "url": "https://arxiv.org/abs/0903.4559" }
0903.4619
11institutetext: Theoretical Physics, University of Oxford, 1 Keble Road, Oxford, OX1 3NP, United Kingdom Institut de Physique Théorique, CEA, IPhT, F-91191 Gif-sur-Yvette, France and CNRS, URA 2306 Science and Finance, Capital Fund Management, 6 Bd Haussmann, 75009 Paris, France Theory and modeling of the glass transition Dynamic critical phenomena Equilibrium properties near critical points, critical exponents # Mode-coupling as a Landau theory of the glass transition A. Andreanov 11 G. Biroli and J.-P. Bouchaud 2233112233 ###### Abstract We derive the Mode Coupling Theory (MCT) of the glass transition as a Landau theory, formulated as an expansion of the exact dynamical equations in the difference between the correlation function and its plateau value. This sheds light on the universality of MCT predictions. While our expansion generates higher order non-local corrections that modify the standard MCT equations, we find that the square root singularity of the order parameter, the scaling function in the $\beta$ regime and the functional relation between the exponents defining the $\alpha$ and $\beta$ timescales are universal and left intact by these corrections. ###### pacs: 64.70.Q- ###### pacs: 64.60.Ht ###### pacs: 64.60.F- The Mode-Coupling Theory of glasses (MCT), developed since the mid-eighties following the seminal work of Götze [1] and Leutheusser [2], has significantly contributed to our understanding of the slowing down of supercooled liquids. One of its cardinal predictions is the appearance of a non trivial $\beta$-relaxation regime where dynamical correlation functions pause around a plateau value before finally relaxing to zero. In the vicinity of this plateau value, the theory predicts two power-law regimes in time (or in frequency), and the divergence of two distinct relaxation times, $\tau_{\alpha}$ and $\tau_{\beta}$, at the MCT critical temperature $T_{d}$. Although this divergence is smeared out by activated events in real liquids, the two-step relaxation picture suggested by MCT seems to account quite well for experimental and numerical observations [3], at least in weakly supercooled liquids and for hard sphere colloidal systems. Originally, MCT was obtained as an uncontrolled self-consistent approximation within the Mori-Zwanzig projection operator formalism for Newtonian particles. This scheme yields an integro-differential equation for the dynamic structure factor $C({\bf k},t)$ that captures mathematically the slowing down of the dynamics and the appearance of a two-step relaxation at equilibrium. It provides very detailed predictions for the scaling properties of $C({\bf k},t)$ in the vicinity of the plateau value $f_{{\bf k}}S_{{\bf k}}$, where $S_{{\bf k}}$ is the static structure factor and $f_{{\bf k}}$ is called the non-ergodicity parameter (akin to the Edwards-Anderson parameter in spin glasses). Alternative derivations of MCT based on field theory have been sought for [4] and research on this topic has continued until now [5, 6, 7, 8]. It was also realized that the same integro-differential equations describe the exact evolution of the correlation function of mean-field p-spin glasses [9]. This is important for at least two reasons: * • Technically, it shows that the MCT approximation is realizable: there is a well defined system for which it is exact; hence MCT does not violate basic physical constraints. * • Physically, it brings in a very useful interpretation of the MCT freezing transition in the “energy landscape” parlance. Above the transition $T_{d}$, the dynamics is dominated by unstable saddles that become progressively less and less unstable as one approaches the transition; below the transition, there are only local minima that are separated by infinite barriers in mean- field, so that the system is forever trapped in one of them [9]. For non mean- field systems, these barriers are finite and the transition is smoothed. MCT can be naturally embedded within the broader Random First Order Theory [10] of the glass transition. In this context it describes the high temperature region where metastable states are still in embryo. However, this analogy shows that MCT is (at best) an incomplete theory of real supercooled liquids, and needs to be corrected and enhanced. An important question is to know to what extent the quantitative predictions of MCT are stable with respect to the ignored contributions. In fact, it is genrally accepted that the quantitative value of the critical temperature (or the critical density) obtained solving MCT equations is incorrect, as is the interaction parameter $\lambda$, which is a functional of the static structure factor and fixes the value of critical exponents. However, when MCT is used to fit empirical data, it is assumed (without much justification) that the predictions about the critical behavior remain correct if $T_{d}$ and $\lambda$ are treated as adjustable parameters. This implicitly assumes that some MCT predictions are universal, e.g. the square root singularity of $f_{{\bf k}}$ and the relation between the exponents describing the divergence of $\tau_{\alpha}$ and $\tau_{\beta}$, and others which are not, e.g. $T_{d}$ and the actual value of the exponents! Clearly, the present theoretical understanding of MCT needs to be improved. Assessing the degree of structural stability of the theory and its universality properties is a crucial issue to resolve both for theoretical and practical purposes. One step in this direction has been performed by Szamel [11] and then later generalized by Mayer et al., where a schematic version of MCT including higher order correlations was proposed and analyzed [12]. The result is that whenever the theory is truncated at any finite order in the n-boby correlations, the phenomenology of MCT is exactly recovered with a finite $T_{d}$, whereas $T_{d}=0$ when the theory is treated exactly to all orders. Another approach was followed in [6], based on a field-theoretical formulation of MCT consistent with the Fluctuation-Dissipation Theorem, which suggests closure schemes different from standard MCT. The aim of this work is to argue that MCT can be rephrased as a Landau theory of the glass transition, based on general assumptions about the nature of the dynamical arrest but without relying on any particular model. Therefore, some predictions of MCT are indeed generic and should be useful in a certain regime of time and temperature. Note that a Landau theory for the glass transition has been developed also in [13], but it has a very different starting point and it does not focus on MCT. The Landau theory is a general phenomenological approach to equilibrium phase transitions [14, 15]. It relies on a number of natural hypotheses, such as symmetry, genericity and regularity. In the classic example of the Ising model for ferromagnets, the expansion of the free energy as a function of the magnetisation $m$ reads, in the homogeneous case and subject to external field $h$: $F[m]=F_{0}-mh+\frac{b}{2}(T-T_{c})m^{2}+\frac{g}{4!}m^{4}+...$, from which a certain number of well known mean-field properties can be derived. Including the first gradient corrections in the inhomogeneous case also allows one to show that close to $T_{c}$, the divergence of the uniform susceptibility $\chi({\bf q}=0)$ is accompanied by the divergence of the correlation length $\xi$, over which magnetisation fluctuations are correlated. The Landau construction can falter in three distinct ways: 1. 1. Higher order terms, neglected in the expansion of $F[m]$ as a series of $m$, could qualitatively change the above predictions (structural instability). This happens, for example, close to a multicritical point where $g(T_{c})=0$. But if the transition remains second order, higher order terms are truly negligible when $\epsilon=|T-T_{c}|\to 0$ and the predictions are universal. 2. 2. The non-linear feedback of spatial fluctuations on the divergence of the susceptibility can change all the critical exponents when the dimension of space is smaller than $d_{u}=4$ in the case of the Ising model. For $d>d_{u}$, on the other hand, one can prove that the low-$q$ behaviour of $\chi({\bf q})$ is (close to the critical point) identical to that predicted by Landau’s theory. 3. 3. Non-perturbative effects can wipe out the transition. This is the case for example of the spinodal transition: the system is not able to reach the critical point because of nucleation, which is an activated process. Even the analogue of point (1) is difficult in the case of MCT; the basic reason being that the order parameter is a not a scalar, but it is a time dependent function $C({\bf k},t)$. The proof that MCT is structurally stable with respect to the addition of higher order terms is already quite complex and this will be the scope of the present paper. Once this is achieved, one should still worry about points (2) and (3) above. As already mentioned, it was recently realized that diverging fluctuations and an upper critical dimension $d_{u}$ also exist for MCT [16, 17, 18] (see also [19, 20] for earlier insights). In order to complete our proof that MCT is stable, one should prove that spatial fluctuations can be safely neglected in $d>d_{u}$ and understand how close one can get to the critical point before non- perturbative (activated) effects impair the transition. We will completely disregard these issues in the present paper, and focus only on point (1). The case of the glass transition is quite different from standard critical phenomena. Several physical and formal problems prevent a direct analogy. The glass transition seems to be a purely dynamical phenomenon: simple static, thermodynamical properties do not present any peculiarities as the liquid freezes into a glass 111It has however been argued that highly non-trivial static correlations, called point to set correlations, increase approaching the glass transition [21].. The above Landau construction simply does not make sense in the absence of the clear analogy of the free energy. This means that the order parameter in glasses cannot be a one point function (such as the magnetisation) but, instead, it is likely to be a two point dynamic correlation. The slowing down of the dynamics in glasses is found to be accompanied by the appearance of a plateau value $f_{\bf k}$ in the relaxation pattern of the dynamical structure factor $C({\bf k},\tau)$. Since the appearance of a plateau coincides with increasing time scales, one expects that within a very long time interval (to be specified), the correlation function can be approximately written as: $C({\bf k},\tau)\approx f_{\bf k}S_{\bf k}+\delta C({\bf k},\tau),\qquad\delta C({\bf k},\tau)\ll 1.$ (1) The idea underlying our construction of a Landau theory for glasses is to consider $\delta C({\bf k},\tau)$ as the analogue of the order parameter $m$ and construct a general, structurally stable, dynamical equation for $\delta C({\bf k},\tau)$. A way to construct such an equation is to start from the exact dynamical evolution for $C$ and the response function $R$ that can be derived in the framework of various dynamical field theories, for example based on Dean’s equation [22] for Brownian dynamics, on Fluctuating Hydrodynamics for Newtonian dynamics [4] (see also [5, 6, 7, 8]), or on Langevin equations for $p$-spin models [9]. Although these theories give very different sets of equations, they can all be reduced to the following single equation in the ergodic region: $\partial_{\tau}C({\bf k},\tau)+TC({\bf k},\tau)+\int\limits_{0}^{\tau}du\Sigma({\bf k},\tau-u)\partial_{u}C({\bf k},u)=0$ (2) with initial condition $C({\bf k},0)=S_{\bf k}$. The self-energy $\Sigma({\bf k},\tau)$ (or memory kernel in MCT terminology) is given by the sum of $2$-particle irreducible ($2$-PI) diagrams built with $C$ and $R$ lines, see e.g. [6]. We do not specify the details of the field theory underlying this equation, nor the Feynman rules for the diagrams contributing to $\Sigma$: we just need that such a theory exists. We also stay in the high-$T$ region, so that the system is at equilibrium: both $C$ and $R$ are then time translation invariant and the Fluctuation-Dissipation theorem holds at a diagrammatic level: $T\,R({\bf k},\tau)=-\partial_{\tau}C({\bf k},\tau)$. In this case the self-energy is a functional of the correlation function only. Eq. (2) has exactly the structure of the standard MCT equation for liquids, although there is no well defined prescription to build a consistent approximation for $\Sigma$; in this sense MCT is rather arbitrary and difficult to improve upon in a systematic way. The standard MCT results correponds to a self-consistent $1$-loop approximation for $\Sigma$, $\Sigma({\bf k},t-s)={\int\frac{d^{3}{\bf k}}{(2\pi)^{3}}}V({\bf k},{\bf p})C({\bf k}-{\bf p},t-s)C({\bf p},t-s)$, where $V({\bf k},{\bf p})$ is an effective vertex. 222Note however that there are complications related to fluctuation dissipation relations [5, 6, 7, 8]. When generalized to higher order diagrams, an important difficulty emerges: the non-locality in time of the corrections. Our goal is to prove that the main results of the standard MCT (or $1$-loop) approximation still hold. The proof is done as for usual theories. We start from some conjectures about the critical properties, such as the nature of the order parameter and its critical properties, that are motivated by experimental and numerical findings. Then we show that they result from a Landau-like expansion, which allows one to assess their universal character and to fix the value of the critical exponents. We therefore assume that the order parameter is the dynamical correlation function and that displays the following features: * • There is structural arrest: below some temperature $T_{d}$, $\lim\limits_{\tau\to\infty}C({\bf k},\tau)=f_{\bf k}S_{\bf k}$ with $f_{\bf k}>0$. * • When $\epsilon=(T-T_{d})/T_{d}\ll 1$, the correlation function exhibits a two- step pattern with three well separated characteristic time scales, see Fig 1. We assume that there exists a diverging time scale $\tau_{\beta}(\epsilon)$ where the difference $\delta C({\bf k},\tau)$ between $C$ and the plateau value is small, of order $r(\epsilon)\ll 1$. More precisely, the correlation function decay is decomposed into: (i) a short time regime, $\tau\sim\tau_{0}$, where $C({\bf k},\tau)=C_{0}({\bf k},\tau)$, with $C_{0}({\bf k},\tau\gg 1)\to f_{\bf k}S_{\bf k}$: (ii) a $\beta$-regime, $\tau=s\tau_{\beta}(\epsilon)$ with $s=O(1)$: $\delta C({\bf k},s\tau_{\beta})=r(\epsilon)S_{\bf k}(1-f_{\bf k})^{2}G({\bf k},s)$; (iii) an $\alpha$-regime, $\tau=s^{\prime}\tau_{\alpha}(\epsilon)$ with $s^{\prime}=O(1)$: $C({\bf k},s^{\prime}\tau_{\alpha})=C_{\alpha}({\bf k},s^{\prime})$ describes the final fall off of the relaxation. Figure 1: A set of relaxation curves $C(\tau)$ close to the MCT transition for the so called schematic model of MCT [3] and several values of $\lambda$, which quantifies the deviation from the transition. As $\lambda\to 1$ a shoulder develops in the relaxation pattern corresponding to the emerging $\beta$-relaxation regime. We assume further (and justify later) that the function $G({\bf k},s)$ can itself be expanded in powers of $r(\epsilon)$: $G({\bf k},s)=\sum_{n=1}^{\infty}r^{n-1}G_{n}({\bf k},s)$. 333One could have also some regular (in $\epsilon$) contributions. However, as we shall show the only two possible values of $r(\epsilon)$ are $\sqrt{\epsilon}$ or $\epsilon$. As a a consequence, regular contributions will be automatically contained in the expansion. All functions $G_{n}$ are a priori singular at $s=0$ and $s=\infty$, reflecting the fact that the behaviour of $C$ must match the short time regime and $\alpha$ regime, where the deviation from the plateau ceases to be small. A crucial remark for the following is that any function $G_{n}$ will appear with a prefactor $r^{n}(\epsilon)$. These hypotheses turn out to be sufficient to generalize the MCT results in the $\beta$-regime. First, it is clear that the above expansion of $G({\bf k},s)$ generates a similar expansion of the self-energy $\Sigma[C]$ in the $\beta$-regime: $\Sigma({\bf k},s)=\sum_{n=1}^{\infty}r^{n-1}\Sigma_{n}({\bf k},s)$, where the $\Sigma_{n}$ do not depend on $\epsilon$, but are some functionals of $C({\bf p},\tau)$. The most generic functional form for $\Sigma$ a priori includes contributions from all three regimes: $\Sigma({\bf k},s)=\Sigma[\\{C_{0}({\bf p},s^{\prime}\tau_{\beta}),r(\epsilon)G({\bf p},s^{\prime}),C_{\alpha}({\bf p},s^{\prime}\tau_{\beta}/\tau_{\alpha})\\}],$ (3) but since the $\Sigma_{n}$ should not depend on $\epsilon$, general arguments can be used to restrict the actual functional form of $\Sigma_{n}$. Note that we have used the notation $s^{\prime}$ to stress that this equation is a functional relation which is non-local in time. Also, even if we had assumed that $\delta C({\bf k},s\tau_{\beta})$ only contains a single term of the order of $r(\epsilon)$ then we would have generated corrections of all orders in $r(\epsilon)$ anyway. The reason is that the self-energy will contain all orders in $r(\epsilon)$ as it can be found by expanding the above equation to all order in $r(\epsilon)G({\bf p},s)$; this will feed back, via the Schwinger-Dyson equations, on $G({\bf p},s)$ itself. We now illustrate how this works for the lowest order terms $\Sigma_{0}$, $\Sigma_{1}$ and $\Sigma_{2}$. As we shall see higher orders are in fact irrelevant for our purpose. Clearly, the zeroth order term $\Sigma_{0}({\bf k},s)$ can only be a function of the wavevector ${\bf k}$ since in the limit $\epsilon\to 0$ time scales separate: $\tau_{\beta}\to\infty$ and $\tau_{\beta}/\tau_{\alpha}\to 0$ and therefore the previous equation implies that in $\Sigma_{0}({\bf k},s)$ all dependence on $s$ drops out. The first order contribution $\Sigma_{1}({\bf k},s)$ must read: $\Sigma_{1}({\bf k},s)=\int\limits_{0}^{\infty}du\int_{{\bf p}}K_{1}({\bf k},{\bf p};s,u)G_{1}({\bf p},u)\quad$ (4) where, henceforth, we shall use the notation $\int_{{\bf p}}={\int\frac{d^{3}{\bf p}}{(2\pi)^{3}}}$. Any other combination containing some $G_{n}$ gives an extra factor $r^{n}(\epsilon)$ and thus it corresponds to a higher order contribution. In the original time variables, the kernel $K_{1}$ must have some regular shape with a span fixed by the microscopic time scale. Therefore, in the rescaled variables $u,s$, $K_{1}$ must be local in $u-s$ and, to lowest order, is a $\delta$ function; higher derivatives of the $\delta$ function correspond to corrections smaller by at least a factor $\tau_{0}/\tau_{\beta}$ which, as we shall see, turn out to be negligible even at order $r^{2}$. Therefore, $\Sigma_{1}({\bf k},s)={\int\frac{d^{3}{\bf p}}{(2\pi)^{3}}}K_{1}({\bf k},{\bf p})G_{1}({\bf p},s)$. The second order term has a richer structure. First, there is a term similar to the first order one with $G_{2}$ instead of $G_{1}$: ${\int\frac{d^{3}{\bf p}}{(2\pi)^{3}}}K_{2}({\bf k},{\bf p})G_{2}({\bf p},s)$. But since the kernel $K_{2}$ is obtained, as $K_{1}$, from the first derivative of the self energy with respect to $r(\epsilon)G({\bf p},s)$, one finds $K_{2}=K_{1}$. Second, there are terms quadratic in $G_{1}$: $\int_{{\bf k}_{1},{\bf k}_{2}}\int\limits_{0}^{\infty}du\int\limits_{0}^{\infty}dvK_{11}({\bf q},{\bf k}_{1},{\bf k}_{2};s,u,v)G_{1}({\bf k}_{1},u)G_{1}({\bf k}_{2},v)$ For the same reasons outlined above, time dependence of $K_{11}({\bf q},{\bf k}_{1},{\bf k}_{2};s,u,v)$ is composed of $\delta$-functions and their derivatives. Some thinking about the underlying diagrammatic structure of the theory allows one to be convinced that the general structure of $K_{11}$ is, to leading order: $\displaystyle K_{11}(s,u,v)=K_{11,\ell}\delta(s-u)\delta(s-v)+\hskip 82.51282pt$ $\displaystyle K_{11,n\ell}\delta(u+v-s)(\partial_{u}+\partial_{v})+\tilde{K}_{11,n\ell}(\partial_{u}+\partial_{v})\delta(u+v-s)$ where to simplify the notation we have dropped all wave-vector dependence in the above equation. The fact that only the combination $u+v-s$ enters comes from causality and the separation of time scales. The full justification of the above form and other technical details444In particular one could think that the separation of timescales not only leads to delta function terms but also to constants. The latter are absent. This can be shown using the general field theoretical expression of the self energy, see [23]. are presented in [23]. The first local term (in $s$), $K_{11,\ell}$, is like the usual MCT contribution, but the other two terms do not appear within standard MCT. The third term actually reduces to the second one plus local terms via integration by parts. This expansion is the main result in the construction of the Landau theory. The zeroth order equation in $r(\epsilon)$ fixes the non-ergodic parameter such that $\frac{T_{d}f_{\bf k}}{1-f_{\bf k}}=\Sigma_{0}({\bf k})$, as in standard MCT. Substituting the expansion of $\Sigma$ up to second order in $r$ into (2) and using the expansion of $C$ in the $\beta$ timescale, one finally obtains, for $T=T_{d}(1+\epsilon)$ and in Laplace space within the $\beta$-regime (we have dropped zeroth order, as discussed above): $\displaystyle r\left[T_{d}(1+\epsilon)\hat{G}_{1}({\bf k},z)-\int_{\bf p}K_{1}({\bf k},{\bf p})\hat{G}_{1}({\bf p},z)\right]+$ $\displaystyle r^{2}\left[T_{d}(1+\epsilon)\hat{G}_{2}({\bf k},z)-\int_{\bf p}K_{1}({\bf k},{\bf p})\hat{G}_{2}({\bf p},z)\right]+$ $\displaystyle\frac{T_{d}f_{\bf k}\epsilon}{z(1-f_{\bf k})}+r^{2}T_{d}(1+\epsilon)(1-f_{\bf k})z\hat{G}_{1}^{2}({\bf k},z)=$ $\displaystyle r^{2}\int_{\bf p}K_{2}({\bf k},{\bf p})\hat{G}_{2}({\bf p},z)+$ $\displaystyle+$ $\displaystyle r^{2}\int_{{\bf k}_{1}}\int_{{\bf k}_{2}}K_{11,\ell}({\bf k},{\bf k}_{1},{\bf k}_{2}){\cal L}[G_{1}({\bf k}_{1},\tau)G_{1}({\bf k}_{2},\tau)](z)$ $\displaystyle+$ $\displaystyle r^{2}\int_{{\bf k}_{1}}\int_{{\bf k}_{2}}K_{11,n\ell}({\bf k},{\bf k}_{1},{\bf k}_{2})z\hat{G}_{1}({\bf k}_{1},z)\hat{G}_{1}({\bf k}_{2},z),$ Identifying the coefficients order by order produces a series of equations. The first order fixes the yet unknown function $r(\epsilon)$: the expansion (Mode-coupling as a Landau theory of the glass transition) only contains terms with integer powers of $\epsilon$. They should be matched with powers of $r(\epsilon)$. Inspection of (Mode-coupling as a Landau theory of the glass transition) shows that there are two possibilities555Actually, there are other possibilities that correspond to higher order MCT singularities, which have been called $A_{n}$ [27]. In a usual Landau theory these correspond to tricritical, or even higher order, critical points. We will neglect them here since they require some fine tuning of the coupling constants.: either $r=\epsilon$, or $r=\sqrt{\epsilon}$. The first choice yields a time independent solution for $G_{1}$ which is in contradiction with our hypothesis of a two-step relaxation with diverging time scales. Hence $r(\epsilon)=\sqrt{\epsilon}$, precisely as for usual MCT, or at $1$-loop order. This follows from the presence of a regular in $T$ term in (2). The equation to order $r=\sqrt{\epsilon}$ now reads: $T_{d}\hat{G}_{1}({\bf k},z)={\int\frac{d^{3}{\bf p}}{(2\pi)^{3}}}K_{1}({\bf k},{\bf p})\hat{G}_{1}({\bf p},z)$ (6) This is the standard eigenvalue problem found within MCT that fixes the value of the critical temperature $T_{d}$. It constrains $G_{1}$ to be a product of wave-vector dependent and time dependent amplitudes, thus reproducing the well-know MCT “factorization property”: $\hat{G}_{1}({\bf k},z)=\hat{g}(z)H_{1}({\bf k})$, where $H_{1}$ is the right eigenvector of $K_{1}$ with largest eigenvalue $\Lambda=T_{d}$. At this order however the scaling function $\hat{g}(z)$ remains unfixed. The second order equation is trickier: $\displaystyle T_{d}\hat{G}_{2}({\bf k},z)-\int_{\bf k}K_{1}({\bf k},{\bf p})\hat{G}_{2}({\bf p},z)=$ $\displaystyle-\frac{T_{d}f_{\bf k}}{z(1-f_{\bf k})}-T_{d}(1-f_{\bf k})z\hat{g}^{2}(z)H_{1}^{2}({\bf k})+$ (7) $\displaystyle+\int_{{\bf k}_{1}}\int_{{\bf k}_{2}}K_{11,\ell}({\bf k},{\bf k}_{1},{\bf k}_{2}){\cal L}[g^{2}](z)H_{1}({\bf k}_{1})H_{1}({\bf k}_{2})+$ $\displaystyle+z\hat{g}^{2}(z)\int_{{\bf k}_{1}}\int_{{\bf k}_{2}}\hat{K}_{11,n\ell}({\bf k},{\bf k}_{1},{\bf k}_{2})H_{1}({\bf k}_{1})H_{1}({\bf k}_{2})$ Following [24], we now multiply (Mode-coupling as a Landau theory of the glass transition) by $H_{1}({\bf k})$ and integrate over ${\bf k}$. The $G_{2}$ part of the equation vanishes and the remainder yields an equation on $\hat{g}(z)$. After some algebra and a proper rescaling of $z$ and $\hat{g}$ one finds: $\frac{1}{z}+\frac{z}{\lambda}\hat{g}^{2}(z)={\cal L}[g^{2}](z)$ (8) where $\lambda$ is a constant that includes a non-local contribution as compared to MCT. But the structure of the equation on the scaling function $g$ is exactly the same as in standard MCT. The properties of solution are well known: $g$ has a singular power law asymptotics at $z\to\infty$: $\hat{g}(z)\sim z^{a-1}$ and $z\to 0$: $\hat{g}(z)\sim z^{-1-b}$. The small time exponent $a$ and long time exponent $b$ characterize the decay of $\delta C({\bf k},\tau)$ to and away from the plateau $f_{\bf k}$. The exponents $a$ and $b$ are related by the famous equation: $\frac{\Gamma^{2}(1-a)}{\Gamma(1-2a)}=\frac{\Gamma^{2}(1+b)}{\Gamma(1+2b)}=\lambda,$ (9) which is a genuinely non-trivial and clear-cut prediction of MCT that constrains the range of values of $a$ and $b$ to: $0\leq a<1/2$ and $0\leq b\leq 1$, in good agreement with experimental and numerical results. We have thus found that this relation has a much broader degree of validity and survives the introduction of an arbitrary number of loop corrections. The values of $a$ and $b$ are however different from the standard MCT (or $1$-loop) result, but as alluded to above, the parameter $\lambda$ is usually taken as an adjustable parameter anyway. The fact that the form of the scaling function $g$ is the same as at $1$-loop (MCT) has two consequences. First, it fixes the functional dependence of the time scales exactly as for MCT: $\tau_{\beta}=\epsilon^{-1/2a};\qquad\tau_{\alpha}=\epsilon^{-\gamma},$ (10) $\gamma=1/2a+1/2b$. This is clear from the matching of $C({\bf k},s\tau_{\beta})$ at both ends of the $\beta$ regime. Second, it can be used to show that some superficial divergencies encountered in the calculation are in fact innocuous (see [23] for more details). Note that the only extra contribution that appear in the generic case to second order in $g(s)$, namely the non-local term proportional to $\int dug^{\prime}(u)g(s-u)$, does not modify the basic MCT equation, Eq. (8). The conclusion, which is the main result of this work, is that although $T_{d}$ and $\lambda$ are modified by taking into account corrections to MCT, the relation between the exponent $a$ and $b$, the square root singularity as well as the scaling function $g$ are truly universal properties. This universality with respect to higher order local (in time) corrections was of course already shown by Götze long ago; here we have proven that this result is robust with respect to general non-local corrections as well, and suggesting that MCT has the status of a Landau theory of the glass transition 666As a consequence, it has a very different status compared to Mode-Coupling theories developed to compute critical exponents beyond mean field theory for standard critical phenomena.. The above schematic arguments can be made precise within the context of specialized model. We have in particular studied in full details the finite $N$ corrections to mean-field 3-spin glass model, where the structure of the perturbation theory can be used to check that the above conclusions hold in that case, see [23] for details. It was recently understood how MCT equations should be generalized in the presence of spatial inhomogeneities, where the correlation function $C$ can be space dependent: $C({\bf k},\vec{r};\tau)$, where $\vec{r}$ is the average of the two points $\vec{r}_{1},\vec{r}_{2}$ between which the correlation is computed, and ${\bf k}$ is the Fourier vector corresponding to $\vec{r}_{1}-\vec{r}_{2}$. When wavelength of inhomogeneities is large, one can establish a gradient expansion of the MCT equations. In the schematic limit where all dependence on ${\bf k}$ is discarded, the self-energy reads, to the lowest order: $\Sigma[C](s)=C(\vec{r},s)^{2}+w_{1}C(\vec{r},s)\nabla^{2}C(\vec{r},s)+w_{2}\vec{\nabla}C(\vec{r},s)\cdot\vec{\nabla}C(\vec{r},s),$ where $w_{1}$ and $w_{2}$ are some coefficients [17]. As mentioned in the introduction, these gradient terms are very important because they show how the MCT transition is in fact associated with a diverging correlation length, which corresponds to the scale over which a localized perturbation affects the surrounding dynamics [17]. The long-ranged critical fluctuations renormalize the value of the MCT exponents in $d<d_{u}=8$ [18]. The above analysis, which was done in the homogeneous limit $\nabla\to 0$, should be repeated in the inhomogeneous case to complete our proof. We expect that the same conclusion will hold, namely that the results about dynamical correlation obtained within inhomogeneous MCT [17] are stable against the addition of higher order corrections. In conclusion, we have shown that MCT, which describes a specific slowing down mechanism through the progressive disappearance of unstable directions, has the status of a Landau theory and is therefore expected to make generic predictions, albeit polluted by activated events and critical fluctuations in finite dimensions. The interplay between critical fluctuations and activated events when $d<d_{u}$, and the crossover to low temperature dynamics is still largely an exciting open problem [28]. Note also that even for the exact MCT equations, the critical region where the asymptotic scaling predictions are valid is unusually narrow [25, 26]. It would be interesting to generalize our Landau approach to the aging regime and show what are the truly universal properties of the mean-field and MCT-like description of the aging dynamics [9]. In constructing the Landau theory, we have assumed that the freezing transition is discontinuous, with a finite value $f_{\bf k}$ of the plateau at the transition. A viable alternative is of course that of a continuous transition of the spin-glass type, which leads to a completely different phenomenology. This raises the question of the possible realization of this second scenario in the context of supercooled liquids. All short-range interacting glasses seem to be characterized by rather small Lindemann parameters at the transition, meaning that it is hard to maintain any kind of amorphous long range order when individual molecules move substantially, and that the glass transition is therefore discontinuous [29]. This argument suggests that continuous glasses can only exist for long-ranged interacting particles or quantum systems. In the quantum case, it is imaginable that amorphous density waves can indeed form with a vanishing modulation amplitude (see [30]). It would be very interesting to find experimental realizations of such a scenario. ###### Acknowledgements. We thank A. Lefèvre for useful discussions. GB and JPB are supported by ANR Grant DYNHET; AA was supported in part by EPSRC Grant No. EP/D050952/1. ## References * [1] U. Bengtzelius, W. Götze, A. Sjöilander, J. Phys. C 17, 5915 (1984). * [2] E. Leuthesser, Phys. Rev. A 29, 2765 (1984). * [3] S. P. Das, Rev. Mod. Phys. 76, 785 (2004). * [4] S. P. Das, G. F. Mazenko, S. Ramaswamy, and J. J. Toner, Phys. Rev. Lett. 54, 118 (1985). * [5] K. Miyazaki, D. R. Reichman, J. Phys. A: Math. Gen. 38, 20 (2005). * [6] A. Andreanov, G. Biroli, A. Lefèvre, J. Stat. Mech., P07008 (2006). * [7] B. Kim and K. Kawasaki, J. Stat. Mech. (2008) P02004. * [8] T. H. Nishino and H. Hayakawa, Phys. Rev. E 78, 061502 (2008). * [9] JP. Bouchaud, L. Cugliandolo, J. Kurchan, M. Mézard, in Spin glasses and Random Fields, A.P. Young Editor (World Scientific) 1998. * [10] V. Lubchenko, P. G. Wolynes, Ann. Rev. Phys. Chem. 58 235 (2007). * [11] G. Szamel, Phys. Rev. Lett. 90, 228301 (2003). * [12] P. Mayer, K. Miyazaki, D. R. Reichman, Phys. Rev. Lett. 97, 095702 (2006). * [13] S. N. Majumdar, D. Das, J. Kondev, B. Chakraborty, Phys. Rev. E 70, 060501(R) (2004). * [14] L.D. Landau, Zh. Eksper. Teor. Fis. 7, 627 (1937). * [15] J.-C. Tolédano, P. Tolédano, The Landau theory of phase transitions, (World Scientific Publishing Co. Pte Ltd) 1987. * [16] G. Biroli, J.-P. Bouchaud, Europhys. Lett. 67, 21 (2004). * [17] G. Biroli, J.-P. Bouchaud, K. Miyazaki, D.R. Reichman, Phys. Rev. Lett. 97, 195701 (2006) . * [18] G. Biroli, J.-P. Bouchaud, J. Phys.: Condens. Matter 19 205101 (2007). * [19] T. R. Kirkpatrick and D. Thirumalai, Phys. Rev. A 37, 4439 (1988). * [20] S. Franz and G. Parisi, J. Phys.: Condens. Matter 12, 6335 (2000). * [21] J.-P. Bouchaud, G. Biroli, J. Chem. Phys. 121, 7347 (2004); G. Biroli, J.-P. Bouchaud, A. Cavagna, T. S. Grigera, P. Verrocchio, Nature Phys. 4 771 (2008); M. Mézard, A. Montanari, J. Stat. Phys. 124 (2006) 1317. * [22] D. S. Dean, J. Phys. A: Math. Gen. 29, L613 (1996). * [23] A. Andreanov, Ph.D. thesis; http://www.imprimerie.polytechnique.fr/Theses/Files/Andreanov.pdf. * [24] W. Götze, Z. Phys. B - Condensed Matter 59, 195 (1985). * [25] V. Krakoviack and C. Alba-Simionesco, J. Chem. Phys. 117, 2161 (2002). * [26] T. Sarlat, A. Billoire, G. Biroli, J.-P. Bouchaud, in preparation. * [27] W. Götze, Sjörgen, Rep. Prog. Phys. 55, 241 (1992). * [28] S. M. Bhattacharya, B. Bagchi and P. G. Wolynes, Phys. Rev. E 72, 031509 (2005). * [29] For a related argument, see M. P. Eastwood and P. G. Wolynes, Europhys. Lett. 60, 587-593 (2002). * [30] M. Tarzia, G. Biroli, Europhys. Lett. 82, 67008 (2008).
arxiv-papers
2009-03-26T15:54:39
2024-09-04T02:49:01.444104
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "A. Andreanov, G. Biroli and J.-P. Bouchaud", "submitter": "Alexei Andreanov", "url": "https://arxiv.org/abs/0903.4619" }
0903.4657
# Pure quantum interpretations are not viable I. Schmelzer mailto:ilja.schmelzer@gmail.comilja.schmelzer@gmail.com http://ilja-schmelzer.deilja-schmelzer.de ###### Abstract. Pure interpretations of quantum theory, which throw away the classical part of the Copenhagen interpretation without adding new structure to its quantum part, are not viable. This is a consequence of a non-uniqueness result for the canonical operators. Berlin, Germany ## 1\. Introduction: The non-uniqueness of the canonical structure In [1] we have proven two non-uniqueness theorems: For some fixed Hamilton operator $\hat{h}$, we have constructed for some continuous parameter $s$ different pairs $\hat{q}(s)$, $\hat{p}(s)$ of canonical operators so that (1) $\mbox{$\hat{h}$}=\frac{1}{2m}\mbox{$\hat{p}(s)$}^{2}+V(\mbox{$\hat{q}(s)$},s)$ with physically different, but equally nice (smooth, bounded, descreasing in infinity) potentials $V(q,s)$. In addition, we have constructed different tensor product structures (or “decompositions into systems”) so that $\hat{h}$ has an equally nice, but physically different representation of type (2) $\mbox{$\hat{h}$}=\sum\frac{1}{2m_{i}}\mbox{$\hat{p}$}_{i}(s)^{2}+V(\mbox{$\hat{q}(s)$},s)$ in all or them. From point of view of canonical quantization, there seems nothing problematic with this result. It nicely corresponds to the standard way to define canonical quantum theories: One has to define an irreducible representation of the canonical operators $\hat{p}$, $\hat{q}$ (with $[\mbox{$\hat{p}$},\mbox{$\hat{q}$}]=-i\hbar$) and then to define the Hamilton operator $\hat{h}$ as a function of these operators (3) $\mbox{$\hat{h}$}=\frac{1}{2m}\mbox{$\hat{p}$}^{2}+V(\mbox{$\hat{q}$}).$ Once the theory is defined in such a way, no non-uniqueness problem appears – the canonical operators $\hat{p}$, $\hat{q}$ are those used in the definition of the canonical theory. The situation is different if we consider interpretations of quantum theory. The point is that the interpretation has to define the physical meaning not only for the Hamilton operator $\hat{h}$, but for all physically relevant parts of the theory. Once different choices of $s$, thus, identifications of $\hat{p}$, $\hat{q}$ with different $\hat{p}(s)$, $\hat{q}(s)$ would lead to physically different theories (with different potentials $V(q)$), the operators $\hat{p}$, $\hat{q}$ are physically important, thus, the interpretation has to describe their physical meaning too. In [1] we have already considered the consequences of these non-uniqueness results for applications of decoherence in fundamental physics: The widely held belief that decoherence allows to define the classical limit without additional structure has to be given up. We have also evaluated and rejected the idea to postulate some fundamental decomposition into systems to derive a preferred basis. An emergent configuration space $Q$ would lead to a lot of losses (uncertainty, dependence on dynamics) which are in no way compensated by gains in explanatory power. The aim of this paper is to continue the consideration of the consequences of these non-uniqueness theorems, in particular for various interpretations of quantum theory. First, we discuss and reject the proposal to embrace the different $\hat{q}(s)$, $\hat{p}(s)$ as many different but equally real worlds – an idea close to but not identical with “many worlds”. Once this proposal is rejected, an interpretation has to identify the “correct” canonical operators $\hat{q}$, $\hat{p}$ among the $\hat{q}(s)$, $\hat{p}(s)$. We argue that this requires more than assigning pure labels. The canonical operators $\hat{p}$, $\hat{q}$ are in some sense different from the alternatives $\hat{p}(s)$, $\hat{q}(s)$, a difference which is not part of the mathematical formalism of pure quantum theory and has to be defined by the interpretation. This requires some additional physical structure which the interpretation has to define. Some interpretations have adequate structures – pilot wave theories [4, 5], Nelsonian stochastics [16] and physical collapse theories [11], [10] have a preferred configuration space $Q$, and the Copenhagen interpretation associates the $\hat{q}$, $\hat{p}$ with classical measurement procedures. But there is a whole class of interpretations which does not have such a structure – a class we name “pure interpretations”. Such interpretations are the result of a very natural approach: One the one hand, one wants to get rid of the uncertain, problematic “classical part” of the Copenhagen interpretation. One the other hand, one does not want to introduce additional structure into the theory. A reasonable minimalistic approach, and it would be nice if it would work. But, as a consequence, the Copenhagen solution of our non-uniqueness problem no longer works, and without any new structure no new solution is available. Thus, this minimal, pure program fails. We discuss shortly some important examples of such interpretations: Mermin’s Ithaca interpretation [15], consistent histories [12], and the Everett interpretation [9]. The aim is not to give a complete list of interpretations endangered by our non-uniqueness result. While I think that the problem is sufficiently general, so that every interpretation deserves a consideration if and how it solves this non-uniqueness problem, this paper can be only a starting point. Our examples merely illustrate that the problem appears in quite different approaches to the interpretation of quantum theory. If interpretations which have a non-uniqueness problem will be given up or saved by introducing some additional structure is a decision we of course have to leave to the proponents of these interpretations. Only they can be expected to find the optimal solution for their preferred interpretations. The point of this paper is to clarify some general, common points – that, if one removes the classical part of the Copenhagen interpretation, one has to introduce something else, a replacement. This replacement has to be a non-trivial physical structure, which contains sufficient additional information to identify the canonical operators. The identification of the canonical operators with momentum and position measurements, which is postulated in the Copenhagen interpretation, has to be derived now based on the new physical structure. This fact alone already removes one of the main advantages of the Everett program and similar programs. What can be obtained in this way is no longer a pure, minimal interpretation, but only an interpretation with some additional structure. The question is no longer if an interpretation has some additional structure (with automatic rejection of interpretations which have such “hidden variables”) but what is the additional structure connected with a given interpretation, what are their particular advantages and disadvantages (now with automatic rejection of interpretations without such a structure). The loss of purity is not the only possible consequence of the additional structure. Other questions may be influenced too. We consider two examples: First the popular many world argument “[P]ilot-wave theories are parallel- universe theories in a state of chronic denial” [8] becomes invalid if (as one would expect) the additional structure introduced into many worlds is not part of pilot wave theory. On the other hand, if we introduce one “preferred” consistent family of histories as the additional structure into the consistent histories interpretation, this interpretation becomes more compatible with classical logic and realism, which would remove some arguments against it. But there are lots of other problems to be considered in future research. In particular, the symmetry properties of the theory may be heavily influenced by an additional structure. ## 2\. What is wrong with “many laws” Anticipating a possible non-uniqueness of the construction of a preferred basis, Saunders [17] has proposed a solution which avoids the introduction of new physical structure: One could accept the non-uniqueness and consider all the different classical limits defined by different $\hat{p}(s)$, $\hat{q}(s)$ as equally real different worlds. Brown and Wallace [7] describe this idea in the following words: > Suppose that there were several such decompositions, each supporting > information-processing systems. Then the fact that we observe one rather > than another is a fact of purely local significance: we happen to be > information-processing systems in one set of decoherent histories rather > than another. [7] This looks like a many-worlds-like solution of the problem. But it should be noted that there is an essential difference between usual many worlds and this proposal. The important point is that, as we have shown in [1], the different $\hat{p}(s)$, $\hat{q}(s)$ define different physics. They have even different classical limits $H(p,q,s)=\frac{1}{2m}p^{2}+V(q,s)$. This situation is very different from the standard “many worlds”, where all worlds follow the same physical laws, only with different initial values. We have not only “many worlds”, but these many worlds follow different physical laws, a situation which is better named “many laws”. This difference allows some counterargumentation. ### 2.1. Loss of predictive power The first one is based on Popper’s criterion of empirical content. Its absolute version is that scientific, empirical theories should be falsifiable, they should allow the derivation of testable predictions. But we need the relative version, which allows to compare the empirical content of different theories. If theory $\mathcal{T}_{1}$ makes at least one prediction which cannot be made by theory $\mathcal{T}_{2}$, but all predictions of theory $\mathcal{T}_{2}$ are also predictions of theory $\mathcal{T}_{1}$, then theory $\mathcal{T}_{1}$ has more predictive power, or higher empirical content in comparison with $\mathcal{T}_{1}2$. Popper’s criterion tells us that the theories with higher empirical content should be preferred. Let’s apply this to our situation, and let’s compare the empirical content of a single law theory (which has somehow fixed one value of $s$ and chosen the corresponding set of canonical operators $\hat{p}$, $\hat{q}$) with a many laws variant which embraces all the $\hat{p}(s)$, $\hat{q}(s)$ as different really existing worlds. We have shown in [1] that the physical predictions for at least some experiments depend on $s$. The single law theory where $s$ is fixed allows to make the usual predictions of canonical quantum theory. The situation for the many laws version is different. This version cannot exclude that the value of $s$ in our universe is the same as that chosen by the single law theory, simply because that single law is one of the possible many laws. Therefore it is in principle impossible to falsify the many laws version without falsifying the single law version. In the other direction this is possible: The single law theory may be falsified simply because the value of $s$ is wrong. Because different $s$ lead to different physical predictions, it may happen in principle that we observe an effect as predicted for a value $s^{\prime}$ which is different from the $s$ used in the single world theory. This would falsify the single world theory. But if the correct value $s^{\prime}$ of our universe is among the allowed values in the many laws theory, many laws is not falsified by this observation. So many laws theory remains unfalsified – the other, correct value $s^{\prime}$ is allowed, it is simply the actual value of some other world. Thus, the consideration of the predictive power gives a clear answer. A single world theory has more predictive power, higher empirical content, is able to make more specific predictions, and, therefore, has to be preferred following Popper’s criterion. This is a natural consequence of the fact that the canonical operators $\hat{p}$, $\hat{q}$ of the theory are fixed and well- defined. ### 2.2. A symmetry argument Let’s add a completely different argument, which is based on symmetry. Once in the many laws version all worlds are equally real, have the same ontological status, the physical properties of our particular world cannot be further restricted by Ockham’s razor or further symmetry principles. These principles allow to restrict only theories about what really exists. All the really existing worlds are already on equal footing. In this case, one would expect that the law of our actual universe should be a typical, generic element of the set of laws. Indeed, if our observed law would be a very special element, say, for the sake of the argument, the one having a special value $s=0$, then there would be no point of considering all the other laws. One could simply use Ockham’s razor to cut all the laws with $s\neq 0$ out of the theory. Is the law of our actual universe a typical, general element of the set of all possible laws? This is something we cannot decide, given that we have considered in [1] essentially only the one-dimensional case (a two-dimensional construction was based on a product of the one-dimensional case), thus, don’t know nor the real law of our universe, nor the possible modifications of it if we allow for other choices of the canonical operators. But let’s nonetheless use the one-dimensional case considered in [1], with Hamiltonians of type (1), as a toy model of the possible laws for the universe, so that another choice of the canonical operators corresponds to another choice of $s$ in (1). What would be, in this toy-many-laws theory, the analogon of the law of our universe? Given the important role of the potential $V(q)=1/\lvert q\rvert$, this potential seems to be the only reasonable candidate. Can the potential $V(q)=1/\lvert q\rvert$ be considered as a typical, generic element of some class of potentials $V(q,s)$ connected with each other by different choices of the canonical operators? The answer is a clear no. The potential $V(q)=1/\lvert q\rvert$ can be characterized among them by an extreme symmetry property. To see this symmetry property we have to ask what changes if we change $s$ in terms of the eigenstates and eigenvalues of the Hamilton operator. The answer is that the eigenvalues remain unchanged (the operator $\hat{h}$ remains the same by construction, as an abstract operator in the Hilbert space, and the eigenvalues $E_{k}$ are completely defined by the operator alone). The eigenstates $|\psi_{k}\rangle$ themself, as abstract elements of the Hilbert space, remain unchanged too. But their positions $q_{k}=\langle\psi_{k}|\mbox{$\hat{q}(s)$}|\psi_{k}\rangle$ change, because they depend on the operator $\hat{q}(s)$ which changes. This change is not a simple common shift – this would be the result of a simple shift in the potential $V(q)\to V(q-q_{0})$. Different eigenstates obtain different shifts, and explicit formulas for these shifts can be found from the theory of the KdV equation [2]. Now, the positions of the energy eigenstates for $V(q)=1/\lvert q\rvert$ can we described in a very simple way: they are simply all zero. Thus, in our toy model our universe is distinguished by the very special symmetry property that $\forall k\;q_{k}=0$. This is certainly not a generic element. It would need high conspiracy. Thus, we have (at least for our toy model) a fine tuning problem: The “many laws” approach would lead to the expectation that the $q_{k}$ are a quite arbitrary sequence of real numbers. Instead, our choice of the potential leads to the very special case $q_{k}=0$ for all $k$. For a theory with a single law this would be the most natural choice, clearly preferred by Ockham’s razor. Instead, for a theory of may laws this is an extremal property of our own universe which requires explanation. #### 2.2.1. But what about our real world? A natural objection is that our one-dimensional toy consideration is much too trivial and our choice of the potential $V(q)=1/\lvert q\rvert$ much too artificial to be relevant for our universe. So let’s try to find out which part of the toy argument can be expected to generalize to a more general, high-dimensional, realistic situation. First, of course, it remains unchanged that the eigenstates $E_{k}$ of $\hat{h}$ remain unchanged. But once the eigenstates of $\hat{h}$ are unable to fix the position operator $\hat{q}$ and the potential $V(\mbox{$\hat{q}$})$ already in the simplest one-dimensional case, one would not expect that this changes in higher dimensions (even if the nice exact mathematics of the Korteweg-de Vries equation works only in the one-dimensional case). A modification of $\hat{q}$ will also change the positions of the eigenstates $q_{k}=\langle\psi_{k}|\mbox{$\hat{q}$}|\psi_{k}\rangle$ of $\hat{h}$, since they obviously depend on $\hat{q}$. The question is how reasonable it is to assume some symmetries like $\forall k\;q_{k}=0$. But this is quite common already in the one-dimensional case. All we need in this case is the discrete symmetry $V(q)=V(-q)$. In this case, for an assumed asymmetric eigenstate $\psi_{k}(q)$ with $q_{k}\neq 0$ $\psi_{k}(-q)$ would be an eigenstate of the same energy $E_{k}$, and then their symmetric and antisymmetric combinations $\psi_{\pm}(q)=\psi_{k}(q)\pm\psi_{k}(-q)$ would define other eigenstates already with $q_{k}=0$, so that every eigenstate can be represented as a linear combination of the same eigenvalue with $q_{k}=0$. (In the one- dimensional case this would be even easier, because in this case there are no degenerate eigenstates.) One can imagine that almost every symmetry which acts nontrivially on $\hat{q}$ (generalizing the $\mbox{$\hat{q}$}\to-\mbox{$\hat{q}$}$ of our example) may have similar nontrivial consequences for the positions of the eigenstates. Given the large role of symmetry in modern physics it seems quite reasonable to expect that there will be some symmetries in the final theory of everything too. Therefore the key elements of our toy example seem to have at least a chance to carry over to the situation of our real world. #### 2.2.2. Maybe the symmetry helps? But maybe the symmetry we have mentioned here allows to solve the very problem? We prefer, of course, symmetric theories. And, of course, if we have to choose between a symmetric theory and one without symmetry we prefer the symmetric theory. But the very point of a “many laws” theory is that the theory itself does not make such a choice. The “symmetric theory” is, in this concept, not a separate symmetric theory, but only a particular universe, with a particular law which has a particular symmetry. We do not have to make a choice between theories – there is only one theory, which contains different worlds with different laws. So, Ockham’s razor or human preferences for symmetric theories are of no use here. A special symmetry of the laws of our particular universe is something which requires explanation. The situation becomes different if we reject the many laws proposal and want to use this symmetry to find a preferred set of canonical operators. For this purpose, symmetry properties of some choices of $\hat{p}$, $\hat{q}$ may be useful, and we will clearly prefer a more symmetric choice. #### 2.2.3. Maybe anthropic argumentation helps? The laws of our world may be not a typical element in the set of all possible laws. Last but not least, our laws allow the existence of human beings. Maybe anthropic considerations allow to fix the parameters $s$ so that no conspiracy is needed? Now, anthropic arguments seem quite weak in their ability to restrict parameters. The general picture, as defended, for example, by Weinberg [25], is that some parameters may be restricted in some regions of the parameter space by anthropic considerations, other parameters not. For some parameters may exist wide ranges where anthropic considerations are irrelevant, because these parameters do not seem to influence anything relevant for human existence. For example, the cosmological constant $\Lambda$ should be small enough to allow human existence. But if it is below a certain limit $\Lambda_{0}$, anthropic considerations are unable to tell anything. And if $\lvert\Lambda\rvert\ll\Lambda_{0}$ the fine tuning problem is not solvable by anthropic considerations. For other parameters, anthropic considerations may not exclude anything interesting. For example, the mass of the top quark seems quite irrelevant for everything related with humans. It could influence something only if it would be many orders lower than it is. But nobody would observe any important difference if it would be many orders greater than it is. Thus, the predictive properties of anthropic considerations seem to be quite restricted. Let’s see what would be required. The construction as given in [1] contains only one parameter $s$, but can be easily extended to an infinite set of parameters $\\{s_{2k+1}\\}$ where $s=s_{3}$ is related with the KdV equation itself, $s_{1}$ defines a simple shift, and the other $s_{2k+1}$ are related with other differential equations of order $2k+1$, so-called higher KdV equations (see, for example, [2]). And for each of these parameters we have a similar situation: Different $s_{2k+1}$ define different physics, with a different potential $V(q,s_{2k+1})$, changing the operators $\hat{p}$, $\hat{q}$, but leaving $\hat{h}$ unchanged. Thus, the non-uniqueness problem is a multi-dimensional one, all the parameters $s_{2k+1}$ would have to be restricted. Similarly, if we consider, instead, the positions of the eigenstates $q_{k}$ as the parameters to be restricted to $q_{k}\approx 0$, we also have an infinite set of parameters. So, even if one can reasonably hope that anthropic considerations may restrict a few of the $s_{2k+1}$, or some of the $q_{k}$, what would be the base for the hope that it allows to restrict all of them? ### 2.3. Summary We have here even two independent arguments against a “many laws” proposal, of quite different character. A simple methodological one using Popper’s criterion of empirical content and fine tuning argument based on the thesis that our laws are more symmetric than the average laws in this construction. If these two arguments are sufficient to convince proponents of this idea is another question. Given that the proposal has been made by Saunders [17] in a situation where the non-uniqueness construction of [1] was yet unknown, and that Tegmark has proposed an even more radical version of Platonism where every imaginable mathematical universe really exists [19], the idea to extend many worlds ruled by a common law into many laws seems to be attractive to many worlders on its own right, even without the necessity to solve the non- uniqueness problem. But in the remaining part of this paper we will ignore the “many laws” possibility. So in the following we assume that there is only a single law of physics, which makes certain predictions. Thus, it follows from the experiment considered in [1] (which proves that the different choices lead to different physical predictions) that the complete description of physics consists not of $\hat{h}$ alone but also of the canonical operators $\hat{p}$, $\hat{q}$. The alternative choices $\hat{p}(s)$, $\hat{q}(s)$ are unphysical. ## 3\. Pure interpretations: The minimal program for replacement of Copenhagen So, assume that we don’t want to embrace all $\hat{p}(s)$, $\hat{q}(s)$ as describing different real worlds. There is only one $\hat{p}$, $\hat{q}$, which describes the true momentum and position measurements, while all the other $\hat{p}(s)$, $\hat{q}(s)$ are only mathematical constructions without any physical meaning. They may describe some other measurements, but nobody knows which, and nobody cares. But the $\hat{p}$, $\hat{q}$ are not distinguished among the $\hat{p}(s)$, $\hat{q}(s)$ by their mathematical properties. Each defines an irreducible representation of the canonical commutation relations: $[\mbox{$\hat{p}(s)$},\mbox{$\hat{q}(s)$}]=-i\hbar$. Each of them is connected with the Hamilton operator $\hat{h}$ in a quite similar way – the Hamilton operator has the same form (1), and the potential $V(q,s)$ has similar nice qualitative properties. But something in the interpretation should tell us why we nonetheless have to use the operators $\hat{p}$, $\hat{q}$ (instead of one of the $\hat{p}(s)$, $\hat{q}(s)$) if we want to measure the momentum or the position. In the Copenhagen interpretation this is done. We have the canonical operators $\hat{p}$, $\hat{q}$. And these canonical operators are defined as describing the momentum and position measurements. What do these phrases “momentum measurement” and “position measurement” mean? The answer is contained in the classical part of the Copenhagen interpretation. Or at least supposed to be. In fact, this classical part is not formalized, and there seems to be no hope that such a notion as “momentum measurement”, which covers lots of very different macroscopic measurement devices, can be really made precise and certain. That’s why this “classial part” of the Copenhagen interpretation has been widely considered as unsatisfactory, and has motivated attempts to get rid of it. The ideal solution would be a derivation of the classical part from the quantum part taken alone. The program to find an interpretation of this ideal type, which reject the classical part of Copenhagen and start with the pure quantum part, without introduction of additional structure, we call _pure program_ , and the resulting interpretations (even if they are in fact not completely realized) _pure interpretations_. The most popular example is the Everett interpretation (better named “Everett program”), described by Everett in the following way: > “This paper proposes to regard pure wave mechanics …as a complete theory. It > postulates that a wave function that obeys a linear wave equation everywhere > and at all times supplies a complete mathematical model for every isolated > physical system without exception. …The wave function is taken as the basic > physical entity with no a priori interpretation. Interpretation only comes > after an investigation of the logical structure of the theory. Here as > always the theory itself sets the framework for its interpretation. …The new > theory is not based on any radical departure from the conventional one. The > special postulates in the old theory which deal with observation are omitted > in the new theory. The altered theory thereby acquires a new character. It > has to be analyzed in and for itself before any identification becomes > possible between the quantities of the theory and the properties of the > world of experience.” [9] There are, of course, lots of variants of many worlds interpretations, and not all of them follow the original pure program. But our point is, of course, not to criticize non-pure variants of many worlds: Instead, our point is that the original, pure program is not viable. Many worlds is not the only such program. Another example is Mermin’s “Ithaca interpretation” (also more appropriately named “Ithaca program”) [15]: On the one hand, Mermin tells that “…I would like to have a quantum mechanics that does not require the existence of a classical domain” and introduces as one of the desiderata “The concept of measurement should play no fundamental role”. On the other hand, we read that “…by quantum mechanics I mean quantum mechanics as it is – not some other theory in which the time evolution is modified by non-linear or stochastic terms, nor even the old theory augmented with some new physical entities (like Bohmian particles) which supplement the conventional formalism without altering any of its observable predictions.” Thus, the basic idea of a pure quantum interpretation is shared by quite different approaches. But this is quite natural. The most questionable part of the Copenhagen interpretation is its classical part, so it is natural that one wants to get rid of it. On the other hand, one wants to minimize the number of assumptions one has to make. And the minimum would be reached if nothing would be added. Unfortunately, because these pure interpretations reject the classical domain of the Copenhagen interpretation, the Copenhagen way to solve our non- uniqueness problem has been lost. The “correct” operators $\hat{p}$ and $\hat{q}$ can no longer be distinguished among the $\hat{p}(s)$, $\hat{q}(s)$ by a postulated association with specific experimental arrangements described in classical language – this is part of what has been removed. On the other hand, once pure interpretations refuse to add some replacement, some new, additional structure, they seem unable to compensate for the loss. Thus, the non-uniqueness result of [1] shows that the “pure program” – the program to develop pure interpretations of quantum theories – cannot be realized and has to be given up. If one removes the association of the canonical operators $\hat{p}$, $\hat{q}$ with certain measurement procedures, which is defined by the classical part of the Copenhagen interpretation, one has to add something else, something which allows to identify the $\hat{p}$, $\hat{q}$, in some other way with momentum and position measurements we make. For this, the $\hat{p}$, $\hat{q}$ have to have some special properties which distinguish them from all the other $\hat{p}(s)$, $\hat{q}(s)$. ## 4\. “Special” interpretations? Let’s return now to the hope that some special symmetries of the problem may be used to distinguish the $\hat{p}$, $\hat{q}$, by their special properties from the other $\hat{p}(s)$, $\hat{q}(s)$. In our toy example this has been the property that all the positions of the eigenstates $q_{k}=\langle\psi_{k}|\mbox{$\hat{q}$}|\psi_{k}\rangle$ are zero. Let’s note here an important and interesting difference between an imagined interpretation based on such an idea and existing interpretations. Canonical quantization works for arbitrary potentials $V(q)$, and the Copenhagen interpretation does not object and gives all these canonical quantum theories the same sort of interpretation. But we can do canonical quantization for all the potentials $V(q,s)$, and the theory defined by $\hat{h}$ as given by (1), and $\hat{p}$ and $\hat{q}$ as given by $\hat{p}(s)$ and $\hat{q}(s)$ defines a realization of the canonical quantization for the potential $V(q,s)$. If an interpretation forgets now about the canonical operators $\hat{p}$, $\hat{q}$ as defined by the canonical quantization procedure, and makes a new choice of the $\hat{p}$, $\hat{q}$ based some mathematical properties of their relation to $\hat{h}$ (like the property $q_{k}=0$) then we do not recover in the classical limit the original theory we have canonically quantized – with potential $V(q,s)$ – but another one, with the potential $V(q,s^{\prime})$ for the preferred $s^{\prime}$. Thus, if we follow this strategy, we obtain a lot of changes in the general picture of quantization: Only a few potentials, distinguished by some special properties, allow to be quantized. Canonical quantization of other potentials gives, of course, a canonical quantum theory as before, but the classical limit of this theory, as described by an interpretation of this type, leads to a different classical theory with different potential. For example, if we would use the property $\forall k\;q_{k}=0$, the corresponding potentials would have the symmetry $V(q)=V(-q)$, and only potentials of this type could be obtained as a classical limit of quantum theories in this interpretation. This is not obviously false – essentially, to be viable, an interpretation should be able to quantize only a single potential, the one we observe in our universe. Then, such a restriction of the allowed potentials is a testable, falsifiable prediction, also something nice. And if the potentials preferred by this interpretation have, moreover, nice additional symmetry properties, as the $V(q)=V(-q)$ symmetry of our toy example, this gives the interpretation some advantage in beauty. So this may be an interesting way to meet the non-uniqueness problem of [1]. But it does not meet the criteria of the “pure program”, because it adds new physics, even important new physics, by restricting the class of potentials $V(q)$ allowed in canonical quantum theories. Thus, an interpretation of this type is physically very different from the Copenhagen interpretation (which does not make any such restrictions). And, in particular, if we start with a canonical theory which has a “wrong” potential, an interpretation of this type makes physical predictions different from the Copenhagen interpretation. Thus, the thesis in the title of our paper is not endangered by interpretations of this type. Therefore we can ignore them in the remaining part of the paper and focus our interest on interpretations which are not “special” in this sense, interpretations which handle all potentials $V(q)$ on equal foot. ## 5\. The necessity of a new physical structure That means, we assume that they allow canonical quantization for all sufficiently well-behaved potentials $V(q)$, and position and momentum measurements, as described on the base of these interpretations, have some association with the canonical operators. Note that in interpretations which do not contain the Copenhagen classical part this association has to be derived, because it is no longer postulated. And we assume that this derivation, whatever the potential $V(q)$ used in the theory, recovers at least approximately the Copenhagen association of the canonical operators with the canonical measurements and recovers also the classical limit. The point we want to make in this section is that this requires the introduction of some additional physical structure. ### 5.1. Pure labels are not sufficient The problem is that a canonical quantum theory in itself gives only labels. There is some operator denoted $\hat{p}$ with the label “momentum operator”, some other operator denoted $\hat{q}$ with the label “position operator”, which form an irreducible representation of their commutation relations $[\mbox{$\hat{p}$},\mbox{$\hat{q}$}]=-i\hbar$. The Hamilton operator $\hat{h}$ has the form (3) with some potential $V(q)$. That’s all what is given by the canonical quantum theory itself. Now let’s compare this with some other choice of $s$. We have now another operator, denoted here $\hat{p}$’, which has now the label “momentum operator”, and also another operator $\hat{q}$’ which has the label “position operator”. But in all other aspects this is a standard canonical quantum theory. Thus, there is some (other) potential $V^{\prime}(q)$, but the general form of the Hamilton operator $\hat{h}$ in terms of the $\hat{p}$’, $\hat{q}$’ is the same canonical form (3). This other theory is simply equivalent to standard canonical quantum theory for a different potential $V^{\prime}(q)$. But as a consequence of our assumptions, momentum and position measurements for these two theories have to be different. In the first canonical theory, we obtain the predictions for momentum and position for the potential $V(q)$, in the second theory those for the potential $V^{\prime}(q)$. But the canonical theories themself have distinguished the operators $\hat{p}$ and $\hat{q}$ only by giving them different labels. The operator $\hat{h}$ which defines the time evolution was the same, the operators $\hat{p}$ and $\hat{q}$ define an unitarily equivalent representation of the same commutation relation $[\mbox{$\hat{p}$},\mbox{$\hat{q}$}]=[\mbox{$\hat{p}$}^{\prime},\mbox{$\hat{q}$}^{\prime}]=-i\hbar$. Pure labels don’t change anything. Thus, no physical predictions should differ simply because we have decided to name $\hat{p}$’ instead of $\hat{p}$ the “momentum operator”. Thus, there should be also something else which changes together with the label “momentum operator”. Something physical, because it leads to differences in the physical predictions, in particular for momentum measurements. There should be some connection between the label “momentum operator” and physics, a connection which is not covered by the mathematics of canonical quantum theories (that means, by the irreducible representation of the canonical commutation relations and the general form (3) of the Hamilton operator), but which allows to identify the expectation value $\langle\psi|\mbox{$\hat{p}$}|\psi\rangle$ of the operator $\hat{p}$ (the one with the label “momentum operator”) with the expectation value of some real physical experiment which measures momentum. In the Copenhagen interpretation, such a connection exists – the association between the label “momentum operator” and the momentum measurement is simply postulated in the classical part of this interpretation. Removing this part of the Copenhagen interpretation would remove this association, reducing “momentum operator” to a pure label without association to measurement procedures. But we have to recover this association, because this is what the theory predicts. So there should be something else, some physics defined by the interpretation, which allows to establish such an association. To clarify what is meant with a new physical structure, let’s consider a few examples. ### 5.2. Theories of pilot wave type With “theories of pilot wave type” we mean a large number of quite different interpretations. First, there are of course de Broglie-Bohm pilot wave theories [4, 5] with different choices of the configuration space. But we include here also some stochastic theories like Bell-type field theories [3] and Nelsonian stochastics [16]. To combine them all into a single class is justified only because for the question discussed here their differences do not matter. They use, essentially, the same type of additional physical structure – an explicit trajectory $q(t)\in Q$ in the configuration space $Q$. This trajectory may be deterministic in pilot wave theories theories, stochastic in Nelsonian stochastics, and even discontinuous stochastic in the case of discrete configuration spaces $Q$. But in all these theories we have a new physical law, a variant of the “guiding equation” of pilot wave theory, which defines the evolution of the configuration $q(t)$. Then it is postulated what our own state is described by the configuration $q(t)$ instead of the wave function $\psi(q)$. This postulate allows to identify measurements as something which has to change the physical state of our brain, thus, as something which changes the value of some particular configuration variables $q_{brain}(t)$. This is a sufficient base for the development of a measurement theory. In particular, in the classical limit we obtain the classical trajectory $q(t)$ simply as the limit of the quantum trajectory $q(t)$. The new physical structure, therefore, consists of the following elements: The identification of the configuration space $Q$, or, in other words, of the operator $\hat{q}$, a new equation for the evolution of $q(t)$, and the identification of the state of the universe with the configuration of the universe $q$. The canonical operator $\hat{q}$ has therefore a direct connection with the new structure, which does not exist for the other $\hat{q}(s)$. The canonical theory based on the other operator $\hat{q}$’ leads to a very different pilot wave theory, with another configuration space $Q^{\prime}$. The trajectory $q(t)$ of the first theory and the trajectory $q^{\prime}(t)$ of the second theory have nothing to do with each other – we cannot even compare them because they live in different spaces. ### 5.3. Physical collapse theories Another class of interpretations which have introduced a new physical structure are physical collapse theories [11, 10]. In these theories the new physics consists of a modification of the Schrödinger equation. Some additional physical collapse mechanism disturbs the unitary Schrödinger evolution and leads to a localization of the wave function. This localization happens in the position representation $\psi(q)\in\mathcal{L}^{2}(Q,\mbox{$\mathbb{C}$})$. Given the collapse mechanism, we do not have to consider all wave functions $\psi(q)$ in the classical limit, but only a small subclass of localized wave functions $\psi(q,t)\approx\delta(q-q(t))$ which are localized around the classical trajectory. The new physical structure in these theories is defined by the terms which modify the Schrödinger equation. These terms depend on something which explicitly depends on the canonical operator $\hat{q}$. Thus, the wave functions obtained in different canonical quantum theories follow different equations, and the classical trajectories $q(t)\in Q$ and $q^{\prime}(t)\in Q^{\prime}$ approximating them have nothing to do with each other. The author prefers theories of pilot wave type, considering de Broglie’s old argument that “[I]t seems a little paradoxical to construct a configuration space with the coordinates of points which do not exist” [5] as sufficiently strong. But this preference is irrelevant for the question considered in this paper. What is interesting here is that above classes of theories have a sufficient additional physical structure and therefore no non-uniqueness problem. ### 5.4. Predefined subsystems In the previous examples, the configuration space $Q$ itself has already played a special physical role. But in principle the new structure may be of a quite different type. A nice example to illustrate this is a predefined subdivision $\mathcal{H}=\mathcal{H}_{A}\otimes\mathcal{H}_{B}$ of the Hilbert space into physically different subspaces, for example into a bosonic and a fermionic part, as considered, for example, by Kent [14]. Then we can apply techniques like decoherence or the Schmidt decomposition to derive a preferred basis in one of them, defined, say, by some operator $\mbox{$\hat{q}$}_{A}$ on $\mathcal{H}_{A}$. Here, the additional structure is defined by the subdivision $\mathcal{H}=\mathcal{H}_{A}\otimes\mathcal{H}_{B}$ itself and the connection between the Hamilton operator and this subdivision. In the simplest case, one could, for example, imagine a Hamilton operator (4) $\mbox{$\hat{h}$}=\frac{1}{2m_{A}}\mbox{$\hat{p}$}_{A}^{2}+\frac{1}{2m_{B}}\mbox{$\hat{p}$}_{B}^{2}+V(\mbox{$\hat{q}$}_{A},\mbox{$\hat{q}$}_{B})$ which restricts observations of $A$ made by the $B$-part to measurements of $\mbox{$\hat{q}$}_{A}$. In [1] we have presented some arguments against interpretations of this type. But these arguments are irrelevant for the point of this paper, which is that we need an additional physical structure. This additional physical structure is present, and it is also sufficient to identify the canonical operator, even if it is only the operator $\mbox{$\hat{q}$}_{A}$ of some part of the theory $\mathcal{H}_{A}$. ### 5.5. Summary: What we need Thus, to solve the non-uniqueness problem, we need an additional physical structure. The pure labels “position operator” and “momentum operator” which remain if we remove the classical part of the Copenhagen interpretation (which have given them an explicit, even if only postulated, connection with position and momentum measurements) are not sufficient. We need something which gives different predictions for these measurements for different choices of the canonical operators among the $\hat{p}(s)$, $\hat{q}(s)$. This requirement is not too strong, as we have seen in some examples of interpretations which have such additional structures. To solve the non- uniqueness problem, it is important that, first, we have an additional structure, and, second, that this additional structure is sufficient to make a choice among the candidates for the canonical operators $\hat{p}(s)$, $\hat{q}(s)$. ## 6\. Consistent histories And interesting example where the question if the additional structure is sufficient is problematic is the “consistent histories interpretation”. An implicit reference to it we have already cited – our quote from Brown and Wallace [7] which describes what we have named the “many laws” solution has used the language of consistent histories. And this seems not to be an accident. It seems quite reasonable to expect that in consistent histories different choices of $s$ will be associated with different consistent families of histories.. In its intentions, the “consistent histories interpretation” seems close to a pure interpretation, despite the fact that it includes some additional structure. In particular, it rejects the classical Copenhagen part (“The interpretive scheme which results is applicable to closed (isolated) quantum systems, …has no need for wave function ‘collapse,’ makes no reference to processes of measurement (though it can be used to analyze such processes) …” [12]). What it adds to the quantum formalism is “…an extension of the standard transition probability formula of nonrelativistic quantum mechanics to certain situations, we call them ‘consistent histories,’ in which it is possible to assign joint probability distributions to events occurring at different times in a closed system without assuming that the corresponding quantum operators commute.” Is the additional structure added by consistent histories sufficient to identify the canonical operators? The answer seems to be negative. Or, more accurate, I see no reason for hope that the consistency condition for families alone allows to distinguish between different standard quantum theories having the same standard form (5) $\mbox{$\hat{h}$}=\frac{1}{2m}\mbox{$\hat{p}$}^{2}+V(\mbox{$\hat{q}$})$ only with different potentials $V(\mbox{$\hat{q}$},s)$. But this is what would have to happen if the only thing added – the consistency condition for families – would allow to distinguish between the different $s$. Indeed, let’s look what we would need. We have a definition of histories, a definition of families of histories, and some consistency conditions for these families. What would solve the problem would be the identification of a history which has a natural association with the canonical operators $\hat{p}$, $\hat{q}$. Now, histories are by definition given only at some discrete times $t_{i}$, and at each moment of time the operators $E^{\alpha}(t_{i})$ defining the possible events have to commute. But these seem to be purely technical complications. If there would be a consistent family of histories (6) $\mathcal{H}=\\{O_{jk}(t_{0}),O_{jk}(t_{1}),\ldots,O_{jk}(t_{n})\\}$ where each event $O_{jk}$ gives $\langle\mbox{$\hat{p}$}\rangle\approx p_{j}$, $\langle\mbox{$\hat{q}$}\rangle\approx q_{k}$ with appropriate accuracy $\Delta p$, $\Delta q$, one could consider this part of the problem as solved. But the problem we want to solve is not simply that for one of the $\hat{p}(s)$, $\hat{q}(s)$ such a consistent family should exist. The problem is that the structure added by the consistent histories approximation should identify a single $s$. It would not be a very big problem if this is only an approximate identification modulo some $\Delta s$ such that measurement results of the operators $\hat{q}(s)$ cannot be distinguished from each other. But some preferred $s$ should be distinguished at least approximately. What does it mean? If we forget a moment about $\hat{h}$, then all the canonical pairs $\hat{p}(s)$, $\hat{q}(s)$ are unitarily equivalent (that’s how they have been constructed in [1]). Thus, if there is a family of histories $\mathcal{H}$ associated with one $\hat{p}$, $\hat{q}$, we can simply use this equivalence to construct families of histories $\mathcal{H}_{s}$ associated with every $\hat{p}(s)$, $\hat{q}(s)$. The original $\mathcal{H}$ is consistent for the Hamilton operator $\hat{h}$. The question is if the $\mathcal{H}_{s}$ are consistent. In principle, they may not – the question if $\mathcal{H}_{s}$ is consistent given the Hamilton operator $\hat{h}$ is unitarily equivalent to the question if the original family $\mathcal{H}$ remains consistent if $V(q)$ will be replaced by $V(q,s)$. Of course, the consistency of a family of histories depends on the Hamilton operator. So, in principle, it may be possible that it among the $V(q,s)$ there is only one value of $s$ such that the family $\mathcal{H}$ is consistent. But would you bet that this will happen? I will certainly not. The $V(q,s)$ are solutions of the Korteweg-de Vries equation with $s$ as the “time” parameter [1]. Their minima are localized at very different positions $q$, but look qualitatively equally nice and have equally nice formal properties (they are smooth, decrease at infinity) and even some important properties like the eigenvalues of $\hat{h}$ are the same. What could be a base for the hope that a pure consistency requirement allows to prefer, among them, a single value of $s$? I cannot see anything supporting such a hope. So, if the additional structure which the consistent histories interpretation adds to pure quantum theory is some variant of a consistency condition for families of histories, there seems no reason to hope that the non-uniqueness problem may be solved. But is it possible to save consistent histories by adding more structure? This seems not only possible, there is even a natural candidate – some preferred consistent family of histories. The various criteria for consistency of families may have different solutions, different families of histories which are consistent, nice and beatiful according to various criteria. But the different families are incompatible with each other. If we hear different incompatible histories in everyday life, we believe at most one of them, and even if we have not yet decided which story we believe, we do not doubt that at most one of the stories can possibly be true. So all we have to do is to apply this rule of common sense to consistent histories. That means there is one consistent family which is correct, and everything incompatible with this family of histories has to be rejected. Now, if this preferred family is somehow associated with one set of canonical operators $\hat{p}$, $\hat{q}$ but not with others, then everything is fine. This hypothesis seems already quite natural. Thus, while consistent histories as it is (with various consistency conditions, but no definite choice of a preferred family of histories) seems unable to solve the non-uniqueness problem, it probably may be solved by introducing a preferred family of consistent histories. ## 7\. Consequences of the loss of purity Even if one accepts that one needs additional structure to solve the non- uniqueness problem, one may decide that particular attempts to develop pure interpretations have their own value and should not be given up, even if the initial hope to obtain a pure interpretation cannot be realized. This seems sociologically plausible in particular for the Everett program. What would be the consequences? Most importantly, the previously pure interpretation would lose its most attractive property – its purity. ### 7.1. The fate of the denial-argument An example of an application of purity is the argument that “[P]ilot-wave theories are parallel-universe theories in a state of chronic denial” [8]. This argument is quite popular in the many worlds community [26, 6, 23]. Given the counterargumentation by Valentini [20], one would concede far too much if one would accept this argument as somehow endangering pilot wave theory, even if it remains popular among the many worlders [21]. But let’s nonetheless assume, simply for the sake of the argument, that the argument in its original version is not completely invalid. Assume now that, to meet our non-uniqueness argument, one introduces some additional structure into many worlds. In this case, it is very probable that the argument becomes invalid, for the simple reason that the new many worlds structure is not part of pilot wave theory. Pilot wave theory already has an additional structure – the trajectory of the configuration $q(t)\in Q$ guided by the guiding equation – which distinguishs a certain $\hat{q}$, thus, there is no reason to introduce anything else. But the argument works only if all real, physical parts of the many worlds interpretation are also real, physical parts of pilot wave theory and follow the same equations (like the Schrödinger equation for the wave function). Thus, the argument depends on the purity of the many worlds interpretation relative to pilot wave theory: Everything which is physical in the Everett interpretation should be physical in pilot wave theory too. If we save many worlds by the introduction of some additional structure, the argument has to be reconsidered. If the new structure is not part of pilot wave theory too, the argument becomes invalid. Of course, one cannot exclude completely that the many worlders use an additional structure which is also part of pilot wave theory, so that the denial-argument survives. But this would be a rather strange choice. Last but not least, the additional structure is the configuration $q(t)\in Q$. This hidden variable is considered as unnecessary today and does not seem to be the first candidate to be embraced by the many worlds community. Even more, one could even question if a theory which gives a $q(t)\in Q$ the status of reality is yet correctly classified as “many worlds” – it may be better characterized as a variant of pilot wave theory. It would be much closer to the current many worlds approach if, instead, some fundamental “decomposition into systems” would be used as the additional structure. But once no such “decomposition into systems” is part of pilot wave theory, the denial argument would be dead in this case. But this may be not the only loss. One of the major arguments in favour of many worlds as well as of other pure interpretations is their claimed compatibility with relativistic symmetry. 111 Given that a preferred frame allows a simple explanation of the SM fermions and gauge fields in terms of a condensed matter model [18], relativistic symmetry does no longer seem to have the fundamental importance which is attributed to it by the relativistic tradition. But whatever the additional structure, it may restrict the symmetry group of the theory. In particular, the configuration space itself – the structure defined by the operator $\hat{q}$ we have to choose among the $\hat{q}(s)$ – is (at least in its usual form) not covariant. The danger that some additional structure will destroy relativistic symmetry is recognized, for example, by Wallace, who notes that “…there seems to be no relativistically covariant way to define a world …” [23]. ### 7.2. Does consistent histories have to modify logic? On the other hand, the loss of purity may also lead to improvements. The additional structure may destroy arguments against the interpretation. Here, our proposal to introduce a preferred family of histories into the consistent histories interpretation may be an example. This is not only a possibility to solve the non-uniqueness problem, but removes also another argument against consistent histories – that it modifies classical logic without necessity. The problem (discussed for example in [27]) is the incompatibility of different, separately consistent, families of histories. A situation where we have different sets of statements which are internally consistent but incompatible with each other is quite common in everyday life – these are simply different incompatible theories. Because they are incompatible with each other, at most one of them can be true. And even if we do not have sufficient information to identify the true theory, if all of them, taken separately, are compatible with all we know, it would not change our certainty that at most one of the theories may be true. This is, essentially, the whole point of logic. But in consistent histories this everyday situation is interpreted in a completely different way: “Note that incompatibility, the fact that the two families cannot be combined, does not mean that one is ‘wrong’ and the other is ‘right.’ Seeking some law of nature which ‘chooses’ one rather than the other is to misunderstand the nature of quantum descriptions.” [13]. In other words, we have different incompatible theories, but they are somehow all equally true. The consistent historians are, of course, aware of the straightforward logical consequence – if two theories which are incompatible with each other are above true, one can construct contradictions. They have “solved” this problem by introducing a new rule of logic – that one is not allowed to combine statements which belong to different families: “Since both $\mathcal{F}_{a}$ and $\mathcal{F}_{b}$ are consistent families, the conclusions of a probabilistic analysis applied using just one of them while disregarding the other will be correct. However, the families are incompatible, and so these conclusions cannot be combined. One cannot say that at time $t_{2}$ the particle is both in a superposition state $c$ AND that it is moving on the upper trajectory $u$, for that would be meaningless in the same way that ‘$S_{x}=+1/2\text{ AND }S_{z}=+1/2$’ makes no sense.” [13]. This “solution” is not accepted as satisfactoy by the critics. It looks like there are true statements $A$ and $B$, but to combine them into the statement $A\text{ AND }B$, something which is always allowed in classical logic, appears to be forbidden. Is this some sort of modification of the rules of logic, some variant of “quantum logic”? If yes, then it seems extremely difficult to justify it. Even if the very foundations of the scientific method, including the logic, are in principle open to discussion and modification, the justification for a modification of logic should be extremely strong. And, given that there are viable alternatives which do not require modifications of logic, this does not seem to be the case. If classical logic is not changed, then what is modified if the incompatibility of two families of statements does not mean that at most one of them can be right? Whatever, all these problems with incompatibility simply vanish if we introduce, as an additional physical structure, one consistent family of histories – the one which contains the histories which are really possible. Thus, the additional structure which seems necessary to solve the non- uniqueness problem would, by the way, solve also another weak point of the consistent histories interpretation. ## 8\. Discussion We have argued that the only way to handle our non-uniqueness result is to make a choice among the $\hat{p}(s)$, $\hat{q}(s)$, and to associate the preferred $\hat{p}$, $\hat{q}$ with some physical structure powerful enough to distinguish them as associated with momentum and position measurements. This destroys the minimal program for the improvement of the Copenhagen interpretation – to throw away the classical part of the Copenhagen interpretation (which solves this non-uniqueness problem) without adding any new physical structure to its quantum part. This “pure program” is unable to give viable interpretations, interpretations which are able to solve our non- uniqueness problem. A quantum interpretation which does not embrace the classical part of the Copenhagen interpretation needs an additional physical structure. It was not the aim of the paper to present a complete overview over all the proposed interpretations of quantum theory whose viability is endangered in the light of our non-uniqueness problem. We have presented some examples – the Everett, Ithaca, and consistent histories interpretations. These examples illustrate that the problem is relevant for quite different approaches to the foundations of quantum theory. But it was also not the aim of this paper to claim that the particular interpretations we have considered cannot be saved. Instead, one can save them by adding some new physical structure. Sometimes reasonable candidates are already part of the mathematical apparatus, and giving them physical significance could even improve them. We have argued that this in the case of consistent histories if one introduces one consistent family of histories as preferred. On the other hand, the introduction of an additional physical structure means also some sort of loss. There is clearly a loss of purity. The interpretation becomes in some sense more complicate. It possibly decreases the symmetry of the interpretation and destroys some arguments in favour of it. We have discussed this for the case of the “pilot wave theory is many worlds in a state of denial” argument. The decision if the particular interpretations are worth to be saved, and what are the best ways to save them, the optimal choices for the additional structure, is something we leave to the proponents of these interpretations. The interpretations preferred by the author – theories of pilot wave type which have a physically preferred configuration space $Q$ with a trajectory $q(t)\in Q$ – do not have any non-uniqueness problem. This means not only that the problem is solvable and solved by other interpretations. It means also that what was a strong argument against pilot wave theory – the existence of such an additional structure – becomes now a strong argument in its favour. ## References * [1] Schmelzer, I.: Why the Hamilton operator alone is not enough, Found. Phys. vol. 39, p. 486-498 (2009), http://arxiv.org/abs/arXiv:0901.3262arXiv:0901.3262 * [2] Ablowitz, M. J., Clarkson, P. A.: Solitons, nonlinear evolution equations and inverse scattering, London Mathematical Society Lecture Note Series, 149, Cambridge University Press, Cambridge (1991) * [3] J.S. Bell, Beables for quantum field theory, Phys. Rep. 137, 49-54, 1986 * [4] Bohm, D: A suggested interpretation of the quantum theory in terms of “hidden” variables, Phys. Rev. 85, 166-193 (1952) * [5] de Broglie, L., La nouvelle dynamique des quanta, in Electrons et Photons: Rapports et Discussions du Cinquieme Conseil de Physique, ed. J. Bordet, Gauthier-Villars, Paris, 105-132 (1928), English translation in: Bacciagaluppi, G., Valentini, A.: “Quantum Theory at the Crossroads: Reconsidering the 1927 Solvay Conference”, Cambridge University Press, and http://arxiv.org/abs/arXiv:quant-ph/0609184arXiv:quant-ph/0609184 (2006) * [6] Brown, H.R., Comment on Valentini, “De Broglie-Bohm Pilot-Wave Theory: Many Worlds in Denial?”, http://arxiv.org/abs/arXiv:0901.1278arXiv:0901.1278 * [7] Brown, H.R., Wallace, D.: Solving the measurement problem: de Broglie-Bohm loses out to Everett, Foundations of Physics, Vol. 35, No. 4, 517 (2005) http://arxiv.org/abs/arXiv:quant-ph/0403094arXiv:quant-ph/0403094 * [8] D. Deutsch, Comment on Lockwood. British Journal for the Philosophy of Science 47, 222–228 (1996) * [9] Everett, H.: ”Relative State” Formulation of Quantum Mechanics, Rev. Mod. Phys. vol. 29. n. 3 (1957) * [10] Ghirardi, G. C. (2002). Collapse theories. In the Stanford Encyclopedia of Philosophy (Summer 2002 edition), Edward N. Zalta (ed.), available online at . http://plato.stanford.edu/archives/spr2002/entries/qm-collapsehttp://plato.stanford.edu/archives/spr2002/entries/qm-collapse * [11] Ghirardi, G., A. Rimini, and T. Weber: Unified Dynamics for Micro and Macro Systems. Physical Review D 34, 470-491 (1986) * [12] Griffiths, R. B.: Consistent Histories and the Interpretation of Quantum Mechanics, Journal of Statistical Physics, vol. 36, nr. 1/2, 219-272 (1984) * [13] Griffiths, R. B.: Quantum mechanics without measurements, http://arxiv.org/abs/arXiv:quant-ph/0612065arXiv:quant-ph/0612065 (2006) * [14] Kent, A., Real World Interpretations of Quantum Theory, http://arxiv.org/abs/arXiv:0708.3710arXiv:0708.3710 (2007) * [15] Mermin, N. D.: The Ithaca Interpretation of Quantum Mechanics, Pramana 51, 549-565 (1998) http://arxiv.org/abs/arXiv:quant-ph/9609013arXiv:quant-ph/9609013 * [16] E. Nelson, Derivation of the Schrödinger Equation from Newtonian Mechanics, Phys.Rev. 150, 1079-1085 (1966) * [17] Saunders, S.: Time, Decoherence and Quantum Mechanics. Synthese 102, 235-266 (1995) * [18] Schmelzer, I.: A Condensed Matter Interpretation of SM Fermions and Gauge Fields, Foundations of Physics, vol. 39, 1, p. 73, http://arxiv.org/abs/arXiv:0908.0591arXiv:0908.0591 (2009) * [19] Tegmark, M.: The Mathematical Universe, Found Phys 38: 101-150 (2008) * [20] Valentini, A.: De Broglie-Bohm Pilot-Wave Theory: Many Worlds in Denial? in [22], http://arxiv.org/abs/arXiv:0811.0810arXiv:0811.0810 * [21] Brown, H.R.: Comment on Valentini, “De Broglie-Bohm Pilot-Wave Theory: Many Worlds in Denial?”, in [22], http://arxiv.org/abs/arXiv:0901.1278arXiv:0901.1278 * [22] Saunders, S., Barrett, J., Kent, A., Wallace, D. (eds.), Many Worlds? Realism, Everett, and quantum mechanics, Oxford University Press (2009) * [23] Wallace, D.: Worlds in the Everett interpretation, Studies in the History and Philosopy of Modern Physics 33, 637–661, http://arxiv.org/abs/arXiv:quant-ph/0103092arXiv:quant-ph/0103092 (2002) * [24] Wallace, D.: The quantum measurement problem: state of play, http://arxiv.org/abs/arXiv:0712.0149arXiv:0712.0149 (2007) * [25] Weinberg, S.: Living in the Multiverse, http://arxiv.org/abs/arXiv:hep-th/0511037v1arXiv:hep-th/0511037v1 * [26] H.D. Zeh, Why Bohm’s Quantum Theory? http://arxiv.org/abs/arXiv:quant-ph/9812059arXiv:quant-ph/9812059 * [27] An Exchange of Letters in Physics Today on “Quantum Theory Without Observers”, February 1999, http://www.math.rutgers.edu/ oldstein/papers/qtwoe/qtwoe.htmlwww.math.rutgers.edu/$\sim$oldstein/papers/qtwoe/qtwoe.html
arxiv-papers
2009-03-26T16:58:37
2024-09-04T02:49:01.452557
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/4.0/", "authors": "I. Schmelzer", "submitter": "Ilja Schmelzer", "url": "https://arxiv.org/abs/0903.4657" }
0903.5041
# Theory of incompressible MHD turbulence with scale-dependent alignment and cross-helicity J. J. Podesta and A. Bhattacharjee Center for Integrated Computation and Analysis of Reconnection and Turbulence,University of New Hampshire, Durham, New Hampshire, 03824 ###### Abstract A phenomenological anisotropic theory of MHD turbulence with nonvanishing cross-helicity is constructed based on Boldyrev’s phenomenology and probabilities $p$ and $q$ for fluctuations $\delta\bm{v}_{\perp}$ and $\delta\bm{b}_{\perp}$ to be positively or negatively aligned. The positively aligned fluctuations occupy a fractional volume $p$ and the negatively aligned fluctuations occupy a fractional volume $q$. Guided by observations suggesting that the normalized cross-helicity $\sigma_{c}$ and the probabilities $p$ and $q$ are approximately scale invariant in the inertial range, a generalization of Boldyrev’s theory is derived that depends on the three ratios $w^{+}/w^{-}$, $\epsilon^{+}/\epsilon^{-}$, and $p/q$. It is assumed that the cascade process for positively and negatively aligned fluctuations are both in a state of critical balance and that the eddy geometries are scale invariant. The theory reduces to Boldyrev’s original theory when $\sigma_{c}=0$, $\epsilon^{+}=\epsilon^{-}$, and $p=q$ and extends the theory of Perez and Boldyrev when $\sigma_{c}\neq 0$. The theory is also an anisotropic generalization of the theory of Dobrowolny, Mangeney, and Veltri. ## I Introduction Phenomenological theories of incompressible MHD turbulence that take into account the anisotropy of the fluctuations with respect to the direction of the mean magnetic field $\bm{B}_{0}$ were pioneered by Goldreich & Sridhar and others in the 1990s. The influencial and somewhat controversial theory of Goldreich & Sridhar (Goldreich and Sridhar, 1995, 1997) established the idea that the timescale or coherence time for motions of a turbulent eddy parallel and perpendicular to $\bm{B}_{0}$ must be equal to each other and this unique timescale then defines the energy cascade time. This concept, called critical balance, leads immediately to the perpendicular energy spectrum $E(k_{\perp})\propto k_{\perp}^{-5/3}$ and to the scaling relation $k_{\parallel}\propto k_{\perp}^{2/3}$ describing the anisotropy of the turbulent eddies. The decade following the publication of the paper by Goldreich & Sridhar in 1995 was a time when significant advances in computing power were brought to bear on computational studies of MHD turbulence. Simulations of incompressible MHD turbulence during this time showed that when the mean magnetic field is strong, $B_{0}^{2}\gg(\delta b)^{2}$, the perpendicular energy spectrum exhibits a power-law scaling closer to $k_{\perp}^{-3/2}$ than $k_{\perp}^{-5/3}$ (Maron and Goldreich, 2001; Müller et al., 2003; Müller and Grappin, 2005). Motivated by this result, Boldyrev modified the Goldreich & Sridhar theory to explain the $k_{\perp}^{-3/2}$ power-law seen in simulations (Boldyrev, 2005, 2006). A new concept that emerged in Boldyrev’s theory is the scale dependent alignment of velocity and magnetic field fluctuations whereby the angle $\theta$ formed by $\delta\bm{v}_{\perp}$ and $\delta\bm{b}_{\perp}$ scales like $\lambda_{\perp}^{1/4}$ in the inertial range. This alignment effect weakens the nonlinear interactions and yields the perpendicular energy spectrum $E(k_{\perp})\propto k_{\perp}^{-3/2}$. Evidence for this alignment effect has been found in numerical simulations of incompressible MHD turbulence (Mason et al., 2006, 2008) and in studies of solar wind data (Podesta et al., 2008, 2009). The phenomenological theory of Galtier et al. (2005) can also be used to explain the observed $k_{\perp}^{-3/2}$ energy spectrum. Using a slightly modified critical balance relation that retains the $k_{\parallel}\propto k_{\perp}^{2/3}$ scaling of the Goldreich & Sridhar theory, their model admits the $k_{\perp}^{-3/2}$ energy spectrum (as well as other solutions). However, the theory of Galtier et al. (2005) does not include the scale dependent alignment that arises in Boldyrev’s theory and, more importantly, is seen in the solar wind (Podesta et al., 2008, 2009). The theories discussed so far (Goldreich and Sridhar, 1995, 1997; Boldyrev, 2005, 2006; Galtier et al., 2005) all assume that the cross-helicity vanishes and, therefore, these theories cannot be applied to solar wind turbulence. When the cross-helicity of the turbulence is nonzero it is necessary to take into account the cascades of both energy and cross-helicity. A generalization of the Goldreich & Sridhar theory to turbulence with nonvanishing cross- helicity, also called imbalanced turbulence, has been developed by Lithwick, Goldreich, & Sridhar (Lithwick et al., 2007). Other theories of imbalanced turbulence have been derived by Beresnyak & Lazarian (Beresnyak and Lazarian, 2008) and Chandran (Chandran, 2008; Chandran et al., 2009). However, none of these theories contains the scale dependent alignment of velocity and magnetic field fluctuations seen in the solar wind. Therefore, to develop a theory that may be applicable to solar wind turbulence it is of interest to generalize Boldyrev’s theory to incompressible MHD turbulence with non-vanishing cross- helicity. An extension of Boldyrev’s theory to imbalanced turbulence has been discussed by Perez & Boldyrev (Perez and Boldyrev, 2009). The purpose of the present paper is to develop a theoretical framework which generalizes the results of Perez & Boldyrev and is consistent with solar wind observations. Our theory is founded, in part, on two new solar wind observations presented in this paper. The first is the observation that the normalized cross-helicity $\sigma_{c}$, the ratio of cross-helicity to energy, is _scale invariant_ in the inertial range. The second is the observation that the probabilities $p$ and $q$ that fluctuations are positively or negatively aligned, respectively, are also _scale invariant_ , that is, these quantities are approximately constant in the inertial range. Experimental evidence for the scale invariance of $\sigma_{c}$ comes from solar wind observations by Marsch and Tu (1990) and also Figure 1 below, and from numerical simulations (Verma et al., 1996; Perez and Boldyrev, 2009). Evidence for the scale invariance of $p$ and $q$ is shown in Figure 2 below. Assuming these quantities are all scale invariant we deduce expressions for the energy cascade rates and the rms fluctuations that generalize the results in (Boldyrev, 2006) and (Perez and Boldyrev, 2009) and are consistent with the concept of scale dependent alignment of velocity and magnetic field fluctuations, a concept neglected in other phenomenological theories (Galtier et al., 2005; Lithwick et al., 2007; Beresnyak and Lazarian, 2008; Chandran, 2008). The resulting theory, which is founded on the concept of scale-invariance and grounded in solar wind observations, contains the theories of Boldyrev (2006) and Perez and Boldyrev (2009) as special cases, but opens up a broader range of physical possibilities. Consistent with numerical simulations and solar wind observations, in our approach the fluctuations at a given point may assume one of two possible states referred to as positively aligned $\delta\bm{v}_{\perp}\cdot\delta\bm{b}_{\perp}>0$ and negatively aligned $\delta\bm{v}_{\perp}\cdot\delta\bm{b}_{\perp}<0$. Each state is characterized by its own rms energy $v^{2}$, alignment angle $\theta$, and nonlinear timescale $\tau$. Positively aligned fluctuations have a characteristic spatial gradient which determines their nonlinear timescale and negatively aligned fluctuations have a different spatial gradient which determines their nonlinear timescale. These timescales are estimated from the nonlinear terms in the MHD equations as described in sections 2 and 3. Section 2 describes the geometries of velocity and magnetic field fluctuations that are either aligned ‘$\uparrow$’ or anti-aligned ‘$\downarrow$’ and these are used to form estimates of the nonlinear terms in the MHD equations. From this foundation, estimates of the energy cascade times are constructed in section 3 and the theory of the energy cascade process is developed in section 4. The summary and conclusions are presented in section 5. ## II Fluctuations in imbalanced turbulence Consider velocity and magnetic field fluctuations measured between two points separated by a distance $\lambda_{\perp}$ in the field perpendicular plane. Let $\bm{v}$ and $\bm{b}$ denote the fluctuations in the plane perpendicular to the local mean magnetic field, where $\bm{v}$ and $\bm{b}$ are both measured in velocity units. Suppose that $\bm{v}$ and $\bm{b}$ are aligned with some small angle $\theta>0$ and assume, as for Alfvén waves, that $|\bm{v}|=|\bm{b}|$. Then $\bm{w}^{+}=\bm{v}+\bm{b}$ is nearly aligned with $\bm{v}$ and $\bm{w}^{-}=\bm{v}-\bm{b}$ is nearly perpendicular to $\bm{v}$ as sketched in Figure 1. Figure 1: Geometry of the fluctuation vectors $\bm{v}$ and $\bm{b}$ for positively aligned fluctuations (a) denoted by ‘$\uparrow$’ and negatively aligned fluctuations (b) denoted by ‘$\downarrow$’. The gradient is perpendicular to the velocity fluctuation $\bm{v}$. The magnitude of $\bm{v}$ for positively and negatively aligned fluctuations are $v_{\uparrow}$ and $v_{\downarrow}$, respectively. The angles formed by $\bm{v}$ and $\bm{b}$, $\theta_{\uparrow}$ and $\theta_{\downarrow}$, are both assumed to be small. It follows from the identity $\bm{w}^{\pm}\times\bm{v}=\mp\bm{v}\times\bm{b}$ that $w^{+}\sin\theta^{+}=v\sin\theta=w^{-}\sin\theta^{-},$ (1) where $\theta^{+}$ is the angle formed by $\bm{w}^{+}$ and $\bm{v}$, $\theta^{-}$ is the angle formed by $\bm{w}^{-}$ and $\bm{v}$, and $\theta$ is the angle formed by $\bm{v}$ and $\bm{b}$. In addition, $\theta^{+}+\theta^{-}=\pi/2$. Following Boldyrev (2006), suppose that the gradient of the fluctuations is in the direction perpendicular to $\bm{v}$. In this case, $(\bm{w}^{-}\cdot\nabla)\simeq\frac{w^{-}\sin\theta^{-}}{\lambda_{\perp}}=\frac{v\sin\theta}{\lambda_{\perp}}$ (2) and $(\bm{w}^{+}\cdot\nabla)\simeq\frac{w^{+}\sin\theta^{+}}{\lambda_{\perp}}=\frac{v\sin\theta}{\lambda_{\perp}}.$ (3) The time rate of change caused by nonlinear interactions is estimated from the relations $\frac{\partial}{\partial t}\frac{|\bm{w}^{+}|^{2}}{2}\simeq\bm{w}^{+}\cdot(\bm{w}^{-}\cdot\nabla)\bm{w}^{+}$ (4) and $\frac{\partial}{\partial t}\frac{|\bm{w}^{-}|^{2}}{2}\simeq\bm{w}^{-}\cdot(\bm{w}^{+}\cdot\nabla)\bm{w}^{-}.$ (5) If $\bm{v}$ and $\bm{b}$ are aligned with some small angle $\theta$, then the fluctuations are called “positively aligned” and denoted by ‘$\uparrow$’ (Figure 1a). Similarly, if $\bm{v}$ and $-\bm{b}$ are aligned with some small angle $\theta$, then the fluctuations are called “negatively aligned” or “anti-aligned” and denoted by ‘$\downarrow$’ (Figure 1b). For positively aligned fluctuations, equations (2)–(5) imply $\frac{\partial}{\partial t}\frac{(w^{+}_{\uparrow})^{2}}{2}\simeq\frac{(w^{+}_{\uparrow})^{2}w^{-}_{\uparrow}\sin\theta^{-}_{\uparrow}}{\lambda_{\perp}}=\frac{(w^{+}_{\uparrow})^{2}v_{\uparrow}\sin\theta_{\uparrow}}{\lambda_{\perp}}$ (6) and $\frac{\partial}{\partial t}\frac{(w^{-}_{\uparrow})^{2}}{2}\simeq\frac{(w^{-}_{\uparrow})^{2}w^{+}_{\uparrow}\sin\theta^{+}_{\uparrow}}{\lambda_{\perp}}=\frac{(w^{-}_{\uparrow})^{2}v_{\uparrow}\sin\theta_{\uparrow}}{\lambda_{\perp}},$ (7) where $\theta_{\uparrow}$ is the angle formed by $\bm{v}$ and $\bm{b}$ and quantities with the subscript $\uparrow$ describe positively aligned fluctuations. It is clear from the middle term in equation (6) that the time rate of change of $w^{+}_{\uparrow}$ depends on $w^{-}_{\uparrow}$, consistent with the nonlinear terms in the MHD equations, although this dependence is not immediately apparent in the last term in (6). For negatively aligned fluctuations, equations (2)–(5) imply $\frac{\partial}{\partial t}\frac{(w^{+}_{\downarrow})^{2}}{2}\simeq\frac{(w^{+}_{\downarrow})^{2}w^{-}_{\downarrow}\sin\theta^{-}_{\downarrow}}{\lambda_{\perp}}=\frac{(w^{+}_{\downarrow})^{2}v_{\downarrow}\sin\theta_{\downarrow}}{\lambda_{\perp}}$ (8) and $\frac{\partial}{\partial t}\frac{(w^{-}_{\downarrow})^{2}}{2}\simeq\frac{(w^{-}_{\downarrow})^{2}w^{+}_{\downarrow}\sin\theta^{+}_{\downarrow}}{\lambda_{\perp}}=\frac{(w^{-}_{\downarrow})^{2}v_{\downarrow}\sin\theta_{\downarrow}}{\lambda_{\perp}},$ (9) where $\theta_{\downarrow}$ is the angle formed by $\bm{v}$ and $-\bm{b}$ and quantities with the subscript $\downarrow$ describe negatively aligned fluctuations. Here, $0<\theta_{\uparrow}<\pi/2$ and $0<\theta_{\downarrow}<\pi/2$. In general, the fluctuations $\bm{v}$ and $\bm{b}$ observed at any point $(\bm{x},t)$ are either positively or negatively aligned. For a point $(\bm{x},t)$ picked at random, let $p$ and $q$ be the probabilities the alignment is positive or negative, respectively ($p+q=1$). Then, on average, $\frac{\partial}{\partial t}\frac{(\tilde{w}^{+})^{2}}{2}\simeq\frac{1}{\lambda_{\perp}}\big{[}p(w^{+}_{\uparrow})^{2}v_{\uparrow}\sin\theta_{\uparrow}+q(w^{+}_{\downarrow})^{2}v_{\downarrow}\sin\theta_{\downarrow}\big{]}$ (10) and $\frac{\partial}{\partial t}\frac{(\tilde{w}^{-})^{2}}{2}\simeq\frac{1}{\lambda_{\perp}}\big{[}p(w^{-}_{\uparrow})^{2}v_{\uparrow}\sin\theta_{\uparrow}+q(w^{-}_{\downarrow})^{2}v_{\downarrow}\sin\theta_{\downarrow}\big{]},$ (11) where the rms values $\tilde{w}^{\pm}$ are defined by $\displaystyle(\tilde{w}^{+})^{2}$ $\displaystyle=p(w_{\uparrow}^{+})^{2}+q(w_{\downarrow}^{+})^{2},$ (12) $\displaystyle(\tilde{w}^{-})^{2}$ $\displaystyle=p(w_{\uparrow}^{-})^{2}+q(w_{\downarrow}^{-})^{2}.$ (13) The following relations also hold. For a positively aligned fluctuation, assuming $|\bm{v}|=|\bm{b}|$, $\displaystyle\bm{w}_{\uparrow}^{+}\cdot\bm{w}_{\uparrow}^{+}$ $\displaystyle=2v_{\uparrow}^{2}(1+\cos\theta_{\uparrow}),$ (14) $\displaystyle\bm{w}_{\uparrow}^{-}\cdot\bm{w}_{\uparrow}^{-}$ $\displaystyle=2v_{\uparrow}^{2}(1-\cos\theta_{\uparrow}),$ (15) and $w^{+}_{\uparrow}w^{-}_{\uparrow}=2v_{\uparrow}^{2}\sin\theta_{\uparrow}$. The energy of a positively aligned fluctuation is $v_{\uparrow}^{2}$. For a negatively aligned fluctuation $\displaystyle\bm{w}_{\downarrow}^{+}\cdot\bm{w}_{\downarrow}^{+}$ $\displaystyle=2v_{\downarrow}^{2}(1-\cos\theta_{\downarrow}),$ (16) $\displaystyle\bm{w}_{\downarrow}^{-}\cdot\bm{w}_{\downarrow}^{-}$ $\displaystyle=2v_{\downarrow}^{2}(1+\cos\theta_{\downarrow}),$ (17) and $w^{+}_{\downarrow}w^{-}_{\downarrow}=2v_{\downarrow}^{2}\sin\theta_{\downarrow}$. The energy of a negatively aligned fluctuation is $v_{\downarrow}^{2}$. Thus, the rms values (12) and (13) are $\displaystyle(\tilde{w}^{+})^{2}$ $\displaystyle=2\big{[}pv_{\uparrow}^{2}(1+\cos\theta_{\uparrow})+qv_{\downarrow}^{2}(1-\cos\theta_{\downarrow})\big{]},$ (18) $\displaystyle(\tilde{w}^{-})^{2}$ $\displaystyle=2\big{[}pv_{\uparrow}^{2}(1-\cos\theta_{\uparrow})+qv_{\downarrow}^{2}(1+\cos\theta_{\downarrow})\big{]}.$ (19) If the angles are small, $\theta_{\uparrow}\ll 1$ and $\theta_{\downarrow}\ll 1$, then the small parameter $\theta$ can be used to order the terms in equations (18) and (19) so that to leading order $(\tilde{w}^{+})^{2}\simeq 4v_{\uparrow}^{2}p\qquad\mbox{and}\qquad(\tilde{w}^{-})^{2}\simeq 4v_{\downarrow}^{2}q,$ (20) where $p+q=1$. This may be derived as follows. In equations (18) and (19) assume that the angles are both small and then substitute $1+\cos\theta\simeq 2$ and $1-\cos\theta=2\sin^{2}(\theta/2)$ to obtain $(\tilde{w}^{+})^{2}\simeq 4\big{[}pv_{\uparrow}^{2}+qv_{\downarrow}^{2}\sin^{2}(\theta_{\downarrow}/2)\big{]}\\\ $ (21) and $(\tilde{w}^{-})^{2}\simeq 4\big{[}pv_{\uparrow}^{2}\sin^{2}(\theta_{\uparrow}/2)+qv_{\downarrow}^{2}\big{]}.$ (22) As $\lambda_{\perp}\rightarrow 0$, both $\theta_{\uparrow}\rightarrow 0$ and $\theta_{\downarrow}\rightarrow 0$ and, therefore, to first order, the terms proportional to $\sin^{2}(\theta)$ may be neglected. Alternatively, note that $\bigg{(}\frac{\tilde{w}^{+}}{\tilde{w}^{-}}\bigg{)}^{2}\simeq\frac{(pv_{\uparrow}^{2}/qv_{\downarrow}^{2})+\sin^{2}(\theta_{\downarrow}/2)}{(pv_{\uparrow}^{2}/qv_{\downarrow}^{2})\sin^{2}(\theta_{\uparrow}/2)+1}.$ (23) As discussed below, solar wind observations show that this quantity is approximately constant in the inertial range. Now, as $\theta_{\uparrow}\rightarrow 0$ and $\theta_{\downarrow}\rightarrow 0$ the only way that this can remain constant is if $pv_{\uparrow}^{2}/qv_{\downarrow}^{2}$ is bounded away from zero and $\bigg{(}\frac{\tilde{w}^{+}}{\tilde{w}^{-}}\bigg{)}^{2}\simeq\frac{pv_{\uparrow}^{2}}{qv_{\downarrow}^{2}}.$ (24) This justifies the approximation in Eqn (20). Equation (20) shows that at a given scale $\lambda_{\perp}$ the total energy $[(\tilde{w}^{+})^{2}+(\tilde{w}^{-})^{2}]/4$ is partitioned into two parts, the energy $(\tilde{w}^{+})^{2}/4$ associated with positive alignment and the energy $(\tilde{w}^{-})^{2}/4$ associated with negative alignment. The normalized cross-helicity $\sigma_{c}$ is defined as the ratio of the cross- helicity to the energy at a given scale and can be written $\sigma_{c}=\frac{(\tilde{w}^{+})^{2}-(\tilde{w}^{-})^{2}}{(\tilde{w}^{+})^{2}+(\tilde{w}^{-})^{2}}.$ (25) For small angles, equations (10) and (11) become, to leading order, $\displaystyle\frac{\partial}{\partial t}\frac{(\tilde{w}^{+})^{2}}{2}$ $\displaystyle\simeq\frac{4pv_{\uparrow}^{3}\theta_{\uparrow}}{\lambda_{\perp}},$ (26) $\displaystyle\frac{\partial}{\partial t}\frac{(\tilde{w}^{-})^{2}}{2}$ $\displaystyle\simeq\frac{4qv_{\downarrow}^{3}\theta_{\downarrow}}{\lambda_{\perp}}.$ (27) To express these in terms of the rms values $\tilde{w}^{\pm}$, eliminate $v_{\uparrow}$ and $v_{\downarrow}$ using equation (20). This yields $\displaystyle\frac{\partial}{\partial t}\frac{(\tilde{w}^{+})^{2}}{2}$ $\displaystyle\simeq\frac{(\tilde{w}^{+})^{3}\theta_{\uparrow}}{2\lambda_{\perp}p^{1/2}},$ (28) $\displaystyle\frac{\partial}{\partial t}\frac{(\tilde{w}^{-})^{2}}{2}$ $\displaystyle\simeq\frac{(\tilde{w}^{-})^{3}\theta_{\downarrow}}{2\lambda_{\perp}q^{1/2}}.$ (29) These estimates shall be used to derive the cascade times. ## III Energy cascade time When nonlinear interactions are strong and a large number of Fourier modes are excited, fluctuations occur continuously in time and space. During a time $\tau$ the fractional change in the quantity $(\tilde{w}^{+})^{2}$ is, from (28), $\chi^{+}(\tau)\simeq\frac{(w^{+})^{3}\theta_{\uparrow}}{2\lambda_{\perp}p^{1/2}}\cdot\frac{2\tau}{(w^{+})^{2}}=\frac{w^{+}\theta_{\uparrow}\tau}{\lambda_{\perp}p^{1/2}},\qquad\tau\leq\tau^{+},$ (30) where $\tau^{+}$ is the cascade time at the lengthscale $\lambda_{\perp}$ and the tildes have been dropped. Similarly, the fractional change in the quantity $(\tilde{w}^{-})^{2}$ is, from (29), $\chi^{-}(\tau)\simeq\frac{(w^{-})^{3}\theta_{\downarrow}}{2\lambda_{\perp}q^{1/2}}\cdot\frac{2\tau}{(w^{-})^{2}}=\frac{w^{-}\theta_{\downarrow}\tau}{\lambda_{\perp}q^{1/2}},\qquad\tau\leq\tau^{-},$ (31) where $\tau^{-}$ is the cascade time of $\tilde{w}^{-}$ and the tildes have been dropped for brevity. Hereafter, the tildes will be omitted and $w^{+}$ and $w^{-}$ will always represent the rms values. According to the definition of the energy cascade time, the fractional change $\chi^{+}$ is of order unity when the interaction time $\tau$ is equal to the cascade time $\tau^{+}$. Therefore, the relations (30) and (31) imply $\tau^{+}\simeq\frac{\lambda_{\perp}p^{1/2}}{w^{+}\theta_{\uparrow}},\qquad\tau^{-}\simeq\frac{\lambda_{\perp}q^{1/2}}{w^{-}\theta_{\downarrow}}.$ (32) By similar reasoning, equations (6) and (9) imply $\tau_{\uparrow}\simeq\frac{\lambda_{\perp}}{2v_{\uparrow}\theta_{\uparrow}},\qquad\tau_{\downarrow}\simeq\frac{\lambda_{\perp}}{2v_{\downarrow}\theta_{\downarrow}}.$ (33) Moreover, equations (32), (33), and (20) imply $\tau^{+}=\tau_{\uparrow}$ and $\tau^{-}=\tau_{\downarrow}$. Thus, the energy cascade times for the rms Elsasser amplitudes are equal to the energy cascade times for the positively and negatively aligned fluctuations. For balanced turbulence, $\sigma_{c}\rightarrow 0$, $w^{+}/w^{-}\rightarrow 1$, $p=q$, $\theta_{\uparrow}=\theta_{\downarrow}$, and the energy cascade times (32) reduce to the cascade time in Boldyrev’s original theory (Boldyrev, 2006). For imbalanced turbulence, $\sigma_{c}\neq 0$, the cascade times (32) are different from the cascade times $\tau^{\pm}\sim\lambda_{\perp}/w^{\mp}\theta^{\mp}$ in the theory of Perez & Boldyrev (Perez and Boldyrev, 2009). The theory presented here is different from the theory of Perez & Boldyrev (Perez and Boldyrev, 2009) because the latter theory does not take into account the existence of two separate types of fluctuations, positively and negatively aligned, with separate probabilities of occurrence $p$ and $q$. Taking this into account and also the definitions of the rms amplitudes (12) and (13), it follows from the preceding analysis that the timescales for the rms amplitudes take the form (32). As pointed out by Kraichnan (Kraichnan, 1965), Dobrowolny, Mangeney, and Veltri (Dobrowolny et al., 1980), and others, the energy cascade in MHD turbulence occurs through collisions between Alfvén wavepackets propagating in opposite directions along the mean magnetic field. In other words, it is the interaction between $w^{+}$ and $w^{-}$ waves that causes the energy to cascade to smaller scales in MHD turbulence. Consequently, the cascade time for $w^{+}$, say, should depend on $w^{-}$. While it may appear from equations (32)–(33) that the timescale for $w^{+}$ fluctuations depends only on $w^{+}$ and, therefore, the interaction with the $w^{-}$ waves is absent, this is not true. The interactions are still present in the expressions (32) and (33) through the dependence on the angles and other parameters as will be shown in the next section. ## IV Theory of the energy cascade process Assuming there is no direct injection of energy or cross-helicity within the inertial range and there is no dissipation of energy or cross-helicity within the inertial range, the energy cascade rate $\varepsilon$ and the cross- helicity cascade rate $\varepsilon_{c}$ are scale-invariant in the inertial range. It follows that the energy cascade rates for the two Elsasser variables $\varepsilon^{\pm}=\varepsilon\pm\varepsilon_{c}$ are also scale-invariant. The theory of the energy cascade process is based on Kolmogorov’s relations $\frac{(w^{+})^{2}}{2\tau^{+}}=\varepsilon^{+}\qquad\mbox{and}\qquad\frac{(w^{-})^{2}}{2\tau^{-}}=\varepsilon^{-},$ (34) where the non-zero constants $\varepsilon^{+}$ and $\varepsilon^{-}$ are the energy cascade rates per unit mass for the two Elsasser variables $w^{+}$ and $w^{-}$, respectively. These equations describe the conservation of energy flux in $\bm{k}$-space (Fourier space). In addition to Kolmogorov’s relations, there are two observational constraints that must be taken into account. Solar wind observations show that the energy and cross-helicity spectra of the turbulence follow approximately the same power law in the inertial range (Fig. 2) Figure 2: Typical energy $E$ and cross-helicity spectra $C$ (trace spectra) obtained using 3-second plasma velocity and magnetic field data from the Wind spacecraft near the orbit of the earth at 1 AU. (a) An interval of highly Alfvénic high-speed wind from 3 Jan 1995 09:00 to 8 Jan 1995 00:00, 4.625 days. (b) A weak high-speed stream embedded in low-speed wind; 24 Jul 1996 12:00 to 7 Aug 1996 00:00, 14 days. (c) The normalized cross-helicity $\sigma_{c}=C/E$ as a function of frequency. The rapid change in $\sigma_{c}$ near the Nyquist frequency is at least partly caused by the FFT processing techniques and may not be a real physical effect. which implies that the normalized cross-helicity $\sigma_{c}$ is approximately constant. In other words, the quantity $\sigma_{c}$ is approximately scale invariant. Similar results have been found in simulations of incompressible MHD turbulence (Verma et al., 1996; Perez and Boldyrev, 2009; Beresnyak and Lazarian, 2008). In particular, the 3D simulations of Perez & Boldyrev (Perez and Boldyrev, 2009) indicate that the perpendicular Elsasser spectra are proportional to each other in Fourier space. Solar wind observations also suggest that the probabilities $p$ and $q$ are approximately scale invariant as shown in Fig. 3. These observations will now be taken into account in the theory. Assuming $\sigma_{c}$ and $p$ are both scale invariant quantities, then $w^{+}/w^{-}$, $v_{\uparrow}/v_{\downarrow}$, $\tau^{+}/\tau^{-}$, and $\theta_{\downarrow}/\theta_{\uparrow}$ are scale invariant by equations (25), (24), (34), and (32), respectively. In all, there are six different scale invariant ratios in the theory $\frac{w^{+}}{w^{-}},\quad\frac{\varepsilon^{+}}{\varepsilon^{-}},\quad\frac{p}{q},\quad\frac{v_{\uparrow}}{v_{\downarrow}},\quad\frac{\tau^{+}}{\tau^{-}},\quad\frac{\theta_{\uparrow}}{\theta_{\downarrow}}.$ (35) At most, only three of these are independent, say, the first three. Equations (24), (34), and (32) imply $\displaystyle\frac{v_{\uparrow}}{v_{\downarrow}}=\sqrt{\frac{q}{p}}\cdot\frac{w^{+}}{w^{-}},$ (36) $\displaystyle\frac{\tau^{+}}{\tau^{-}}=\left(\frac{w^{+}}{w^{-}}\right)^{2}\frac{\varepsilon^{-}}{\varepsilon^{+}},$ (37) $\displaystyle\frac{\theta_{\downarrow}}{\theta_{\uparrow}}=\sqrt{\frac{q}{p}}\left(\frac{w^{+}}{w^{-}}\right)^{3}\frac{\varepsilon^{-}}{\varepsilon^{+}}.$ (38) Therefore, the six scale invariant ratios (35) can all be expressed in terms of the first three $w^{+}/w^{-}$, $\varepsilon^{+}/\varepsilon^{-}$, and $p/q$. Figure 3: The probabilities $p$ and $q$ obtained from solar wind data by integrating the observed probability density function for the angle $\theta$ from 0 to $\pi/2$ and from $\pi/2$ to $\pi$, respectively. The data was acquired by the Wind spacecraft between 8 Jan 1997 and 9 June 1997 and analyzed using the techniques described in (Podesta et al., 2009). Examples of the probability density functions can be found in (Podesta et al., 2009). To be able to solve Kolmogorov’s relations (34) for $w^{\pm}$ it is necessary to express the alignment angle $\theta_{\uparrow}$ in terms of $w^{\pm}$. In general, $\theta_{\uparrow}$ can depend on $w^{+}$, $w^{-}$, the Alfvén speed $v_{A}$, the lengthscale $\lambda_{\perp}$, the cascade rates $\varepsilon^{+}$ and $\varepsilon^{-}$, and the probabilities $p$ and $q$. By dimensional analysis, $\theta_{\uparrow}$ must be a function of the following six dimensionless quantities $\frac{w^{+}}{v_{A}},\quad\frac{w^{-}}{v_{A}},\quad\frac{\varepsilon^{+}\lambda_{\perp}}{v_{A}^{3}},\quad\frac{\varepsilon^{-}\lambda_{\perp}}{v_{A}^{3}},\quad p,\quad q.$ (39) Moreover, $\theta_{\uparrow}$ must change into $\theta_{\downarrow}$ when $w^{+}$, $\varepsilon^{+}$, and $p$ are interchanged with $w^{-}$, $\varepsilon^{-}$, and $q$, respectively, to be consistent with the nonlinear terms (28) and (29). For a theory composed of power law functions, the only forms that satisfy all these requirements are $\displaystyle\theta_{\uparrow}$ $\displaystyle\propto\bigg{(}\frac{w^{+}}{v_{A}}\bigg{)}^{\\!\alpha}\bigg{(}\frac{w^{-}}{v_{A}}\bigg{)}^{\\!\beta}\bigg{(}\frac{\varepsilon^{+}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!\gamma}\bigg{(}\frac{\varepsilon^{-}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!\delta}p^{\mu}q^{\nu},$ (40) $\displaystyle\theta_{\downarrow}$ $\displaystyle\propto\bigg{(}\frac{w^{-}}{v_{A}}\bigg{)}^{\\!\alpha}\bigg{(}\frac{w^{+}}{v_{A}}\bigg{)}^{\\!\beta}\bigg{(}\frac{\varepsilon^{-}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!\gamma}\bigg{(}\frac{\varepsilon^{+}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!\delta}q^{\mu}p^{\nu},$ (41) where $\alpha$, $\beta$, $\gamma$, $\delta$, $\mu$, and $\nu$ are constants that must be determined by the theory. In addition, there is a leading coefficient which is omitted. The substitution of (40) and (41) into equation (38) yields $\beta=\alpha+3$, $\delta=\gamma-1$, and $\nu=\mu-1/2$. The parameters are further constrained by considering the geometry of the “turbulent eddies” associated with the fluctuations $v_{\uparrow}$ and $v_{\downarrow}$. The parallel correlation length is defined by $\lambda_{\parallel}^{\uparrow}=v_{A}\tau_{\uparrow}$ and the correlation length in the direction of the velocity fluctuation is $\bm{\xi}_{\uparrow}=\bm{v}_{\uparrow}\tau_{\uparrow}$. Similarly, the correlation lengths for negatively aligned fluctuations are $\lambda_{\parallel}^{\downarrow}=v_{A}\tau_{\downarrow}$ and $\xi_{\downarrow}=v_{\downarrow}\tau_{\downarrow}$. In the plane perpendicular to the local mean magnetic field $\bm{\xi}$ is parallel to $\bm{v}$, the gradient direction is perpendicular to $\bm{v}$ with lengthscale $\lambda_{\perp}$, and the eddy dimensions are $\xi\times\lambda_{\perp}$. The dimension parallel to the mean magnetic field is $\lambda_{\parallel}$. Hence, in physical space the turbulent eddies can be visualized as three-dimensional structures with dimensions $\lambda_{\perp}\times\xi\times\lambda_{\parallel}$. The coherence times for longitudinal and transverse motions of the eddy must be equal to each other and also to the cascade time. This is the critical balance condition of Goldreich and Sridhar which is also implicit in the work of Higdon Higdon (1984). Equation (33) and the definitions of the correlation lengths in the last paragraph immediately yield the critical balance condition $\tau_{\uparrow}=\frac{\lambda_{\parallel}^{\uparrow}}{v_{A}}=\frac{\xi_{\uparrow}}{v_{\uparrow}}\simeq\frac{\lambda_{\perp}}{2v_{\uparrow}\theta_{\uparrow}}$ (42) with a similar condition for the negatively aligned fluctuations $\tau_{\downarrow}=\frac{\lambda_{\parallel}^{\downarrow}}{v_{A}}=\frac{\xi_{\downarrow}}{v_{\downarrow}}\simeq\frac{\lambda_{\perp}}{2v_{\downarrow}\theta_{\downarrow}}.$ (43) Now consider the eddy geometry. When the mean magnetic field is strong enough that $w^{\pm}/v_{A}<1$, then $\lambda_{\parallel}>\xi>\lambda_{\perp}$ and the eddies are elongated in the parallel direction. The condition $w^{\pm}/v_{A}<1$ is assumed hereafter. Equation (42) shows that the aspect ratio in the field perpendicular plane is $\phi_{\uparrow}=\lambda_{\perp}/\xi_{\uparrow}=2\theta_{\uparrow}$ and the aspect ratio in the parallel direction is, from equations (42) and (20), $\psi_{\uparrow}=\frac{\xi_{\uparrow}}{\lambda_{\parallel}^{\uparrow}}=\frac{v_{\uparrow}}{v_{A}}=\frac{w^{+}}{2v_{A}p^{1/2}}.$ (44) The two aspect ratios will scale in the same way if $\phi_{\uparrow}/\psi_{\uparrow}$ is scale invariant. This implies that $\alpha=-1$ and $\gamma=1/2$. The assumption that the ratio $\phi_{\uparrow}/\psi_{\uparrow}$ is scale invariant is different from Boldyrev’s original approach in which he assumed that the alignment angles in and out of the field perpendicular plane are simultaneously minimized. Nevertheless, our assumption retains the spirit of Boldyrev’s original theory which implies the geometry of turbulent fluctuations are scale-invariant. Solving Kolmogorov’s relation (34) using (32), (40), (41), and the parameter values obtained so far, one finds $\frac{w^{\pm}}{v_{A}}\simeq\bigg{(}\frac{w^{+}}{w^{-}}\bigg{)}^{\\!\pm 1/2}\bigg{(}\frac{\varepsilon^{-}}{\varepsilon^{+}}\bigg{)}^{\\!\pm 1/8}\bigg{(}\frac{\varepsilon^{\pm}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!1/4}(pq)^{-\nu/4}$ (45) and the total energy cascade rate $\varepsilon=(\varepsilon^{+}+\varepsilon^{-})/2$ is $\varepsilon=\frac{(w^{+}w^{-})^{2}}{4v_{A}\lambda_{\perp}}\Bigg{(}\sqrt{\frac{\varepsilon^{+}}{\varepsilon^{-}}}+\sqrt{\frac{\varepsilon^{-}}{\varepsilon^{+}}}\Bigg{)}(pq)^{\nu}.$ (46) The total energy at scale $\lambda_{\perp}$ is $\frac{(w^{+})^{2}+(w^{-})^{2}}{4}=\frac{w^{+}w^{-}}{4}\bigg{(}\frac{w^{+}}{w^{-}}+\frac{w^{-}}{w^{+}}\bigg{)}\equiv v^{2}.$ (47) Therefore, the energy cascade rate can be written $\epsilon=\frac{4v^{4}}{v_{A}\lambda_{\perp}}\Bigg{(}\sqrt{\frac{\varepsilon^{+}}{\varepsilon^{-}}}+\sqrt{\frac{\varepsilon^{-}}{\varepsilon^{+}}}\Bigg{)}\bigg{(}\frac{w^{+}}{w^{-}}+\frac{w^{-}}{w^{+}}\bigg{)}^{\\!-2}(pq)^{\nu}.$ (48) Assuming the rms energy $v^{2}$ at scale $\lambda_{\perp}$ is held constant, the terms on the right-hand side describe the dependence of the energy cascade rate on the ratios $\varepsilon^{+}/\varepsilon^{-}$ and $w^{+}/w^{-}$. The value of $\nu$ may be determined by comparison with experiment or possibly by further physical considerations. This parameter does not affect the inertial range scaling laws and is left undetermined for the moment. At this point it is of interest to return to the expressions (32) for the cascade times and ask: How do the cascade times depend on the rms Elsasser amplitudes? Using the parameter values obtained previously, equation (40) becomes $\theta_{\uparrow}\sim\bigg{(}\frac{w^{+}}{v_{A}}\bigg{)}^{\\!-1}\bigg{(}\frac{w^{-}}{v_{A}}\bigg{)}^{\\!2}\bigg{(}\frac{\varepsilon^{+}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!1/2}\bigg{(}\frac{\varepsilon^{-}\lambda_{\perp}}{v_{A}^{3}}\bigg{)}^{\\!-1/2}p^{\nu+1/2}q^{\nu}$ (49) and the substitution of this result into equation (32) yields $\tau^{+}\simeq\frac{\lambda_{\perp}}{v_{A}}\bigg{(}\frac{v_{A}}{w^{-}}\bigg{)}^{\\!2}\bigg{(}\frac{\varepsilon^{-}}{\varepsilon^{+}}\bigg{)}^{\\!1/2}(pq)^{-\nu}.$ (50) A similar expression holds for $\tau^{-}$ so that the ratio $\tau^{+}/\tau^{-}$ satisfies (37). Ignoring scale invariant factors, the preceding equation shows that $\tau^{+}\propto\frac{\lambda_{\perp}v_{A}}{(w^{-})^{2}}\qquad\mbox{and}\qquad\tau^{-}\propto\frac{\lambda_{\perp}v_{A}}{(w^{+})^{2}}.$ (51) In this form, the angle dependence has been eliminated. Note that the simple estimate $\tau^{+}\sim\lambda_{\perp}/w^{-}$ suggested by the nonlinear term in the MHD equations is modified by the factor $v_{A}/w^{-}$ which accounts for the weakening of nonlinear interactions caused by scale dependent alignment. The presence of this algebraic factor is one of the hallmarks of Boldyrev’s original (2006) theory which is generalized here to imbalanced turbulence. Remarkably, the relations (51) are identical to those in the isotropic theory of imbalanced turbulence developed by Dobrowolny, Mangeney, and Veltri; see equation (10) in (Dobrowolny et al., 1980). Recall that Dobrowolny, Mangeney, and Veltri concluded from their expressions for the cascade times that steady state turbulence with nonvanishing cross-helicity is impossible. On the contrary, the theory presented here allows such a steady state because the additional coefficients shown in (50) but not (51) maintain the relation (37) even when $\varepsilon^{+}\neq\varepsilon^{-}$. Thus, the theory presented here is also a generalization of the theory of Dobrowolny, Mangeney, and Veltri (Dobrowolny et al., 1980). A remark about the timescales in the theory should be mentioned. If $w^{+}>w^{-}$, then equation (37) implies it is possible that $\tau^{+}<\tau^{-}$ since there is nothing in the theory that prevents this. That is, the energy of the more energetic Elsasser species may be transferred to smaller scales in less time than the energy of the less energetic Elsasser species. This is not inconsistent with dynamic alignment, a well known effect seen in simulations of decaying incompressible MHD turbulence where the minority species usually decays more rapidly than the dominant species causing the magnitude of the normalized cross-helicity to increase with time (Dobrowolny et al., 1980; Matthaeus et al., 1983; Matthaeus and Montgomery, 1984; Pouquet et al., 1986). In freely decaying turbulence, dynamic alignment occurs whenever the total energy decays more rapidly than the cross-helicity, that is, $\varepsilon>|\varepsilon_{c}|$, where the cascade rate of cross-helicity $\varepsilon_{c}$ may be positive or negative. From the relations $\varepsilon>0$ and $\varepsilon^{\pm}=\varepsilon\pm\varepsilon_{c}$, it follows that dynamic alignment occurs if and only if $\varepsilon^{+}>0$ and $\varepsilon^{-}>0$. If $w^{+}>w^{-}$, it is not necessary that $\tau^{+}>\tau^{-}$, only that $\frac{\tau^{+}}{\tau^{-}}>\frac{\varepsilon^{-}}{\varepsilon^{+}},$ (52) as can be seen from equation (37). Therefore, even though the relation $\tau^{+}<\tau^{-}$ may seem counter-intuitive, it is not inconsistent with dynamic alignment. ## V Summary and Conclusions Observations of scale dependent alignment of velocity and magnetic field fluctuations $\delta\bm{v}_{\perp}$ and $\delta\bm{b}_{\perp}$ in the solar wind suggest that this effect must be included in any theory of solar wind turbulence (Podesta et al., 2008, 2009). Perez and Boldyrev (2009) have recently discussed a theory of imbalanced turbulence that includes scale dependent alignment of the fluctuations $\delta\bm{v}_{\perp}$ and $\delta\bm{b}_{\perp}$ in the inertial range. We have extended the Perez- Boldyrev theory by including the probabilities $p$ and $q$ which solar wind observations indicate are not necessarily equal. Operationally, the probabilities $p$ and $q$ may be defined as follows. Suppose space is covered by a uniform cartesian grid or three dimensional mesh. At each grid-point one may compute the fluctuations $\delta\bm{v}_{\perp}$ and $\delta\bm{b}_{\perp}$ and the angle between them $\theta$. If the angle lies in the range $0<\theta<\pi/2$, then the fluctuation is positively aligned and if $\pi/2<\theta<\pi$, then the fluctuation is negatively aligned. By counting the number of positively and negatively aligned fluctuations in a large volume $V$, much larger than the lengthscales of the turbulent eddies, the probabilities $p$ and $q$ may be defined as the fractional numbers of positively and negatively aligned fluctuations in the volume $V$. The phenomenological theory developed in this paper was guided primarily by two new solar wind observations. It should be noted that both of these solar wind observations are necessary for the development of the theory. At first glance, it may seem that the condition $\sigma_{c}=$ const implies that $p$ and $q$ are both constant. Or that these two conditions are somehow equivalent. However, the relation $(w^{+}/w^{-})^{2}\simeq pv_{\uparrow}^{2}/qv_{\downarrow}^{2}$, equation (24), shows that $p/q$ can vary with the lengthscale even if $w^{+}/w^{-}$ is constant. Therefore, it is essential to have separate observations of the scale invariance of $\sigma_{c}$ and the scale invariance of $p$ and $q$ to support the theoretical framework developed here. In summary, using estimates of the cascade times derived from the nonlinear terms in the incompressible MHD equations and two new observational constraints derived from studies of solar wind data, we have constructed a generalization of Boldyrev’s theory (Boldyrev, 2006) that depends on the three parameters $w^{+}/w^{-}$, $\varepsilon^{+}/\varepsilon^{-}$, and $p/q$. The theory reduces to the original theory of Boldyrev (2006) when $w^{+}=w^{-}$, $\epsilon^{+}=\epsilon^{-}$, and $p=q$ since in this limit $\theta_{\uparrow}=\theta_{\downarrow}$ and the cascade times (32) become equal to those of Boldyrev (2006). For imbalanced turbulence $w^{+}\neq w^{-}$, $p\neq q$, and the theory predicts the scaling laws $w^{\pm}\propto\lambda_{\perp}^{1/4}$, $\theta_{\uparrow\downarrow}\propto\lambda_{\perp}^{1/4}$, and $\lambda_{\parallel}^{\pm}\propto\lambda_{\perp}^{1/2}$. Interestingly, the scaling laws for balanced and imbalanced turbulence are the same. The perpendicular energy spectrum defined by $k_{\perp}E^{\pm}\sim|w^{\pm}|^{2}$ has the inertial range scaling $E^{\pm}\propto k_{\perp}^{-3/2}$ with $\frac{E^{+}}{E^{-}}=\bigg{(}\frac{w^{+}}{w^{-}}\bigg{)}^{\\!2}=\frac{1+\sigma_{c}}{1-\sigma_{c}}=\mbox{const}.$ (53) The theory assumes that the cascades for positively and negatively aligned fluctuations are both in a state of critical balance (42), although they are governed by different timescales, and that the eddy geometry is scale invariant. The positively aligned fluctuations occupy a fractional volume $p$ and the negatively aligned fluctuations occupy a fractional volume $q$ so that the energy cascade rate is $\varepsilon=p\frac{v_{\uparrow}^{2}}{\tau_{\uparrow}}+q\frac{v_{\downarrow}^{2}}{\tau_{\downarrow}}$ (54) or, equivalently, $\varepsilon=\frac{(w^{+})^{2}}{4\tau^{+}}+\frac{(w^{-})^{2}}{4\tau^{-}}.$ (55) In the discussion following equation (35) it was shown that at most three of the ratios $w^{+}/w^{-}$, $\varepsilon^{+}/\varepsilon^{-}$, and $p/q$ can be independent. However, the two ratios $w^{+}/w^{-}$ and $\varepsilon^{+}/\varepsilon^{-}$ cannot be independent since in the case of homogeneous steady-state turbulence $w^{+}=w^{-}$ implies $\varepsilon^{+}=\varepsilon^{-}$ and vice versa. This is because the injection of cross-helicity into the system, $\varepsilon_{c}\neq 0$ or $\varepsilon^{+}\neq\varepsilon^{-}$, will create a nonzero cross-helicity spectrum and a cascade of cross-helicity from large to small scales which implies a net accumulation of cross-helicity within the volume ($\sigma_{c}\neq 0$). Hence, at most two of the ratios and $w^{+}/w^{-}$ and $p/q$ are independent. Whether $p/q$ can be expressed in terms of $w^{+}/w^{-}$ and $\varepsilon^{+}/\varepsilon^{-}$ is an open question. ###### Acknowledgements. We are grateful to S. Boldyrev for valuable comments on an earlier version of the manuscript and to Pablo Mininni and Jean Perez for helpful discussions. This research is supported by DOE grant number DE-FG02-07ER46372, NASA grant number NNX06AC19G, and NSF. Additional support for John Podesta comes from the NASA Solar and Heliospheric Physics Program and the NSF SHINE Program. ## References * Goldreich and Sridhar (1995) P. Goldreich and S. Sridhar, Astrophys. J. 438, 763 (1995). * Goldreich and Sridhar (1997) P. Goldreich and S. Sridhar, Astrophys. J. 485, 680 (1997). * Maron and Goldreich (2001) J. Maron and P. Goldreich, Astrophys. J. 554, 1175 (2001). * Müller et al. (2003) W.-C. Müller, D. Biskamp, and R. Grappin, Phys. Rev. E. 67, 066302 (2003). * Müller and Grappin (2005) W.-C. Müller and R. Grappin, Phys. Rev. Lett. 95, 114502 (2005). * Boldyrev (2005) S. Boldyrev, Astrophys. J. Lett. 626, L37 (2005). * Boldyrev (2006) S. Boldyrev, Phys. Rev. Lett. 96, 115002 (2006). * Mason et al. (2006) J. Mason, F. Cattaneo, and S. Boldyrev, Phys. Rev. Lett. 97, 255002 (2006). * Mason et al. (2008) J. Mason, F. Cattaneo, and S. Boldyrev, Phys. Rev. E. 77, 036403 (2008). * Podesta et al. (2008) J. J. Podesta, A. Bhattacharjee, B. D. G. Chandran, M. L. Goldstein, and D. A. Roberts, in _Particle Acceleration and Transport in the Heliosphere and Beyond_ (2008), vol. 1039 of _AIP Conference Series_ , pp. 81–86. * Podesta et al. (2009) J. J. Podesta, B. D. G. Chandran, A. Bhattacharjee, D. A. Roberts, and M. L. Goldstein, Journal of Geophysical Research (Space Physics) 114, A01107 (2009). * Galtier et al. (2005) S. Galtier, A. Pouquet, and A. Mangeney, Phys. Plasmas 12, 092310 (2005), eprint arXiv:physics/0504207. * Lithwick et al. (2007) Y. Lithwick, P. Goldreich, and S. Sridhar, Astrophs. J. 655, 269 (2007), eprint arXiv:astro-ph/0607243. * Beresnyak and Lazarian (2008) A. Beresnyak and A. Lazarian, Astrophys. J. 682, 1070 (2008), eprint arXiv:0709.0554. * Chandran (2008) B. D. G. Chandran, Astrophs. J. 685, 646 (2008), eprint 0801.4903. * Chandran et al. (2009) B. D. G. Chandran, E. Quataert, G. G. Howes, J. V. Hollweg, and W. Dorland, Astrophys. J. 701, 652 (2009), eprint 0905.3382. * Perez and Boldyrev (2009) J. C. Perez and S. Boldyrev, Phys. Rev. Lett. 102, 025003 (2009), eprint 0807.2635. * Marsch and Tu (1990) E. Marsch and C.-Y. Tu, J. Geophys. Res. 95, 8211 (1990). * Verma et al. (1996) M. K. Verma, D. A. Roberts, M. L. Goldstein, S. Ghosh, and W. T. Stribling, J. Geophys. Res. 101, 21619 (1996). * Kraichnan (1965) R. H. Kraichnan, Phys. Fluids 8, 1385 (1965). * Dobrowolny et al. (1980) M. Dobrowolny, A. Mangeney, and P. Veltri, Phys. Rev. Lett. 45, 144 (1980). * Higdon (1984) J. C. Higdon, Astroph. J. 285, 109 (1984). * Matthaeus et al. (1983) W. H. Matthaeus, M. L. Goldstein, and D. C. Montgomery, Phys. Rev. Lett. 51, 1484 (1983). * Matthaeus and Montgomery (1984) W. H. Matthaeus and D. C. Montgomery, _Statistical physics and chaos in fusion plasmas_ (Edited by C. W. Horton and L. E. Reichl, Wiley, New York, 1984), pp. 285–291. * Pouquet et al. (1986) A. Pouquet, M. Meneguzzi, and U. Frisch, Phys. Rev. A 33, 4266 (1986).
arxiv-papers
2009-03-29T12:36:10
2024-09-04T02:49:01.475453
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "J. J. Podesta and A. Bhattacharjee", "submitter": "John Podesta", "url": "https://arxiv.org/abs/0903.5041" }
0903.5072
# Chemical Engineering Science 65 (2010) 2310-2324 Asymptotology of Chemical Reaction Networks A. N. Gorban ag153@le.ac.uk University of Leicester, UK Corresponding author: University of Leicester, LE1 7RH, UK O. Radulescu ovidiu.radulescu@univ- rennes1.fr IRMAR, UMR 6625, University of Rennes 1, Campus de Beaulieu, 35042 Rennes, France A. Y. Zinovyev andrei.zinovyev@curie.fr Institut Curie, U900 INSERM/Curie/Mines ParisTech, 26 rue d’Ulm, F75248, Paris, France ###### Abstract The concept of the limiting step is extended to the asymptotology of multiscale reaction networks. Complete theory for linear networks with well separated reaction rate constants is developed. We present algorithms for explicit approximations of eigenvalues and eigenvectors of kinetic matrix. Accuracy of estimates is proven. Performance of the algorithms is demonstrated on simple examples. Application of algorithms to nonlinear systems is discussed. ###### keywords: Reaction network , asymptotology , dominant system , limiting step , multiscale asymptotic , model reduction ###### PACS: 64.60.aq , 82.40.Qt , 82.39.Fk , 82.39.Rt 87.15.R- , 89.75.Fb ## 1 Introduction Most of mathematical models that really work are simplifications of the basic theoretical models and use in the backgrounds an assumption that some terms are big, and some other terms are small enough to neglect or almost neglect them. The closer consideration shows that such a simple separation on “small” and “big” terms should be used with precautions, and special culture was developed. The name “asymptotology” for this direction of science was proposed by Kruskal (1963), but fundamental research in this direction are much older, and many fundamental approaches were developed by I. Newton (Newton polyhedron, and many other things). Following Kruskal (1963), asymptotology is “the art of describing the behavior of a specified solution (or family of solutions) of a system in a limiting case. … The art of asymptotology lies partly in choosing fruitful limiting cases to examine … The scientific element in asymptotology resides in the nonarbitrariness of the asymptotic behavior and of its description, once the limiting case has been decided upon.” Asymptotic behavior of rational functions of several positive variables $k_{i}>0$ gives us a toy-example. Let $R(k_{1},\ldots k_{n})=P(k_{1},\ldots k_{n})/Q(k_{1},\ldots k_{n})$ be such a function and $P,Q$ be polynomials. To derive fruitful limiting cases we consider logarithmic straight lines $\ln k_{i}=\theta_{i}\xi$ and study asymptotical behavior of $R$ for $\xi\to\infty$. In this asymptotics, for almost every vector $(\theta_{i})$ (outside several hyperplanes) there exists such a dominant monomial $R_{\infty}(k)=A\prod_{i}k_{i}^{\alpha_{i}}$ that $R=R_{\infty}+o(R_{\infty})$. The function that associates a monomial with vector $(\theta_{i})$ is piecewise constant: it is constant inside some polyhedral cones. Implicit functions given by equations which depend on parameters provide plenty of more interesting examples, especially in the case when the implicit function theorem is not applicable. Some analytical examples are presented by Andrianov & Manevitch (2002) and White (2006). Introduction of algebraic backgrounds and special software is provided by Greuel & Pfister (2002). For a difficult problem, analysis of eigenvalues and eigenvectors of non- symmetric matrices, Vishik & Ljusternik (1960) studied asymptotic behavior of spectra and spectral projectors along the logarithmic straight lines in the space of matrices. This analysis was continued by Lidskii (1965). We study networks of linear reactions. For a linear system with reaction rate constants $k_{i}$ all the dynamical information is contained in eigenvalues and eigenvectors of the kinetic matrix or, more precisely, in its transformation to the Jordan normal form. It is computationally expensive task to find this transformation for a non-symmetric matrix which is usually stiff (Golub & Van Loan (1996)). Moreover, the answer could be very sensitive to the errors in constants $k_{i}$. Nevertheless, it appears that stiffness can help us to find a robust approximation, and in the limit when all constants are very different (well-separated constants) the asymptotical behavior of eigenvalues and eigenvectors follow simple explicit expressions. Analysis of this asymptotics is our main goal. In our approach, we study asymptotic behavior of eigenvalues and eigenvectors of kinetic matrices along logarithmic straight lines, $\ln k_{i}=\theta_{i}\xi$ in the space of constants. We significantly use the graph representation of chemical reaction networks and demonstrate, that for almost every vector $(\theta_{i})$ there exists a simple reaction network which describes the dominant term of this asymptotic. Following the asymptotology terminology (White (2006)), we call this simple network the dominant system. For these dominant system there are explicit formulas for eigenvalues and eigenvectors. The topology of dominant systems is rather simple: they are acyclic networks without branching. This allows us to construct the explicit asymptotics of eigenvectors and eigenvalues. All algorithms are represented topologically by transformation of the graph of reaction (labeled by reaction rate constants). The reaction rate constants for dominant systems may not coincide with constant of original network. In general, they are monomials of the original constants. This result fully supports the observation by Kruskal (1963): “And the answer quite generally has the form of a new system (well posed problem) for the solution to satisfy, although this is sometimes obscured because the new system is so easily solved that one is led directly to the solution without noticing the intermediate step.” The dominant systems can be used for direct computation of steady states and relaxation dynamics, especially when kinetic information is incomplete, for design of experiments and mining of experimental data, and could serve as a robust first approximation in perturbation theory or for preconditioning. They can be used to answer an important question: given a network model, which are its critical parameters? Many of the parameters of the initial model are no longer present in the dominant system: these parameters are non-critical. Parameters of dominant subsystems indicate putative targets to change the behavior of the large network. Most of reaction networks are nonlinear, it is nevertheless useful to have an efficient algorithm for solving linear problems. First, nonlinear systems often include linear subsystems, containing reactions that are (pseudo)monomolecular with respect to species internal to the subsystem (at most one internal species is reactant and at most one is product). Second, for binary reactions $A+B\to...$, if concentrations of species $A$ and $B$ ($c_{A},c_{B}$) are well separated, say $c_{A}\gg c_{B}$ then we can consider this reaction as $B\to...$ with rate constant proportional to $c_{A}$ which is practically constant, because its relative changes are small in comparison to relative changes of $c_{B}$. We can assume that this condition is satisfied for all but a small fraction of genuinely nonlinear reactions (the set of nonlinear reactions changes in time but remains small). Under such an assumption, nonlinear behavior can be approximated as a sequence of such systems, followed one each other in a sequence of “phase transitions”. In these transitions, the order relation between some of species concentrations changes. Some applications of this approach to systems biology are presented by Radulescu, Gorban, Zinovyev & Lilienbaum (2008). The idea of controllable linearization “by excess” of some reagents is in the background of the efficient experimental technique of Temporal Analysis of Products (TAP), which allows to decipher detailed mechanisms of catalytic reactions (Yablonsky, Olea, & Marin (2003)). In chemical kinetics various fundamental ideas about asymptotical analysis were developed (Klonowski (1983)): quasieqiulibrium asymptotic (QE), quasi steady-state asymptotic (QSS), lumping, and the idea of limiting step. Most of the works on nonequilibrium thermodynamics deal with the QE approximations and corrections to them, or with applications of these approximations (with or without corrections). There are two basic formulation of the QE approximation: the thermodynamic approach, based on entropy maximum, or the kinetic formulation, based on selection of fast reversible reactions. The very first use of the entropy maximization dates back to the classical work of Gibbs (1902), but it was first claimed for a principle of informational statistical thermodynamics by Jaynes (1963). A very general discussion of the maximum entropy principle with applications to dissipative kinetics is given in the review by Balian, Alhassid & Reinhardt (1986). Corrections of QE approximation with applications to physical and chemical kinetics were developed by Gorban, Karlin, Ilg, & Öttinger (2001); Gorban & Karlin (2005). QSS was proposed by Bodenstein (1913) and was elaborated into an important tool for analysis of chemical reaction mechanism and kinetics (Semenov (1939); Christiansen (1953); Helfferich (1989)). The classical QSS is based on the relative smallness of concentrations of some of “active” reagents (radicals, substrate-enzyme complexes or active components on the catalyst surface) (Aris (1965); Segel & Slemrod (1989)). Lumping analysis aims to combine reagents into “quasicomponents” for dimension reduction (Wei & Kuo (1969); Kuo & Wei (1969); Li & Rabitz (1989); Toth, Li, Rabitz, & Tomlin (1997). The concept of limiting step gives the limit simplification: the whole network behaves as a single step. This is the most popular approach for model simplification in chemical kinetics and in many areas beyond kinetics. In the form of a bottleneck approach this approximation is very popular from traffic management to computer programming and communication networks. The proposed asymptotic analysis can be considered as a wide extension of the classical idea of limiting step (Gorban & Radulescu (2008)). The structure of the paper is as follows. In Sec. 2 we introduce basic notions and notations. We consider thermodynamic restrictions on the reaction rate constants and demonstrate how appear systems with arbitrary constants (as subsystems of more detailed models). For linear networks, the main theorems which connect ergodic properties with topology of network, are reminded. Four basic ideas of model reduction in chemical kinetics are described: QE, QSS, lumping analysis and limiting steps. In Sec. 3, we introduce the dominant system for a simple irreversible catalytic cycle with limiting step. This is just a chain of reactions which appears after deletion the limiting step from the cycle. Even for such simple examples several new observation are presented: * • The relaxation time for a cycle with limiting step is inverse second reaction rate constant; * • For chains of reactions with well separated rate constants left eigenvectors have coordinates close to 0 or 1, and right eigenvectors have coordinates close to 0 or $\pm 1$. For general reaction networks instead of linear chains appear general acyclic non-branching networks. For them we also provide explicit formulas for eigenvectors and their 0, $\pm 1$ asymptotics for well-separated constants (Sec. 4). In (Sec. 5) the main algorithm is presented. Sec. 6 is devoted to a simple demonstration of the algorithm application. In Sec. 7, we briefly discuss further corrections to dominant systems. The estimates of accuracy are given in Appendix. ## 2 Main Asymptotic Ideas in Chemical Kinetics ### 2.1 Chemical Reaction Networks To define a chemical reaction network, we have to introduce: * • a list of components (species); * • a list of elementary reactions; * • a kinetic law of elementary reactions. The list of components is just a list of symbols (labels) $A_{1},...A_{n}$. Each elementary reaction is represented by its stoichiometric equation $\sum_{i}\alpha_{si}A_{i}\to\sum_{si}\beta_{si}A_{i},$ (1) where $s$ enumerates the elementary reaction, and the non-negative integers $\alpha_{si}$, $\beta_{si}$ are the stoichiometric coefficients. A stoichiomentric vector $\gamma_{s}$ with coordinates $\gamma_{si}=\beta_{si}-\alpha_{si}$ is associated with each elementary reaction. For analysis of closed chemical systems with detailed balance it is usual practice to group reactions in pairs, direct and inverse reactions together, but in more general settings this is not convenient. A non-negative real extensive variable $N_{i}\geq 0$, amount of $A_{i}$, is associated with each component $A_{i}$. It measures “the number of particles of that species” (in particles, or in moles). The concentration of $A_{i}$ is an intensive variable: $c_{i}=N_{i}/V$, where $V$ is volume. It is necessary to stress, that in many practically important cases the extensive variable $V$ is neither constant, nor the same for all components $A_{i}$. For more details see, for example the book of Yablonskii, Bykov, Gorban, & Elokhin (1991). For simplicity, we will consider systems with one constant volume and under constant temperature, but it is necessary always keep in mind the possibility to return to general equations. For that conditions, the kinetic equations have the following form $\frac{{\mathrm{d}}c}{{\mathrm{d}}t}=\sum_{s}w_{s}(c,T)\gamma_{s}+\upsilon,$ (2) where $\upsilon$ is the vector of external fluxes normalized to unit volume. It may be useful to represent external fluxes as elementary reactions by introduction of new component $\varnothing$ together with incoming and outgoing reactions $\varnothing\to A_{i}$ and $A_{i}\to\varnothing$. The most popular kinetic law of elementary reactions is the mass action law for perfect systems: $w_{s}(c,T)=k_{s}(T)\prod c_{i}^{\alpha_{si}},$ (3) where “kinetic constant” $k_{s}(T)$ depends on temperature $T$. More general kinetic law, which can be used for most of non-ideal (non-perfect) systems is $w_{s}(c,T)=\varphi_{s}\exp\left(\frac{1}{RT}\sum_{i}\alpha_{si}\mu_{i}\right),$ (4) where $R$ is the universal gas constant, $\mu_{i}$ is the chemical potential, $\mu_{i}=\frac{\partial F(N,T,V)}{\partial N_{i}}=\frac{\partial G(N,T,P)}{\partial N_{i}}$, $F$ is the Helmgoltz free energy, $G$ is the Gibbs energy (free enthalpy), $P$ is pressure and $\varphi_{s}>0$ is an intensive variable, kinetic factor, which can depend on any set of intensive variables, first of all, on $T$. Chemical thermodynamics (Prigogine & Defay (1954)) provides tools of choice for stability analysis of reaction networks (Procaccia & Ross (1977)) and chemical reactors (Aris (1965)). The laws of thermodynamics have been used for analyzing of structural stability of process systems by Hangos, Bokor, & Szederkényi (2004). In general reaction network coefficients $k_{s}$ (3) or $\varphi_{s}$ (4) are not independent. In order to respect the second law of thermodynamics, they should satisfy some equations and inequalities. The most famous sufficient condition gives the principle of detailed balance. Let us group the elementary reactions in pairs, direct and inverse reactions, and mark the variables for direct reactions by superscript $+$, and for inverse reactions by $-$. Then the principle of detailed balance for general kinetics (4) reads: $\varphi_{s}^{+}=\varphi_{s}^{-}$ (5) (Feinberg (1972)). For the isothermal mass action law the principle of detailed balance can be formulated as follows: there exists a strictly positive point $c^{*}$ of detailed balance, at this point $w_{s}^{+}(c^{*})=w_{s}^{-}(c^{*})$ (6) for all $s$. This is, essentially, the same principle: if we substitute in the general reaction rate (4) the fraction $\mu_{i}/RT$ by $\ln(c_{i}/c_{i}^{*})$, then we will get the mass action law, and $\varphi_{s}^{+}=\varphi_{s}^{-}$. The principle of detailed balance is closely related to the microreversibility and Onsager relations. More general condition was invented by Stueckelberg (1952) for the Boltzmann equation. He produced them from the $S$-matrix unitarity (the quantum complete probability formula). For the general law (4) without direct-inverse reactions grouping for any state the following identity holds: $\begin{split}&\sum_{s}\varphi_{s}\exp\left(\frac{1}{RT}\sum_{i}\alpha_{si}\mu_{i}\right)\\\ &\equiv\sum_{s}\varphi_{s}\exp\left(\frac{1}{RT}\sum_{i}\beta_{si}\mu_{i}\right).\end{split}$ (7) Even more general condition which guarantees the second law and has clear microscopic sense (the complete probability does not increase) was obtained by Gorban (1984): for any state $\begin{split}&\sum_{s}\varphi_{s}\exp\left(\frac{1}{RT}\sum_{i}\alpha_{si}\mu_{i}\right)\\\ &\geq\sum_{s}\varphi_{s}\exp\left(\frac{1}{RT}\sum_{i}\beta_{si}\mu_{i}\right).\end{split}$ (8) To obtain formulas for the isothermal mass action law, it is sufficient just to apply the general law (4) with constant $\varphi_{s}$ to the perfect free energy $F=RT\sum_{i}c_{i}(\ln c_{i}+\mu_{i0})$ with constant $\mu_{i0}$. More detailed analysis was presented, by Gorban (1984). In any case, reaction constants are dependent, and this dependence guarantees stability of equilibrium and existence of global thermodynamic Lyapunov functions for closed systems (2) with $\upsilon=0$. Nevertheless, we often study equations for such systems with oscillations, bifurcations, chaos, and other effects, which are impossible in systems with global Lyapunov function. Usually this means that we study a subsystem of a large system, where some of concentrations do not change because they are stabilized by external fluxes or by a large external reservoir. These constant (or very slow) concentrations are included into new reaction constants, and after this redefinition they can loose any thermodynamic property. ### 2.2 Linear Networks and Ergodicity In this Sec., we consider a general network of linear reactions. This network is represented as a directed graph (digraph) (Temkin, Zeigarnik, & Bonchev (1996)): vertices correspond to components $A_{i}$, edges correspond to reactions $A_{i}\to A_{j}$ with kinetic constants $k_{ji}>0$. For each vertex, $A_{i}$, a positive real variable $c_{i}$ (concentration) is defined. A basis vector $e^{i}$ corresponds to $A_{i}$ with components $e^{i}_{j}=\delta_{ij}$, where $\delta_{ij}$ is the Kronecker delta. The kinetic equation for the system is $\frac{{\mathrm{d}}c_{i}}{{\mathrm{d}}t}=\sum_{j}(k_{ij}c_{j}-k_{ji}c_{i}),$ (9) or in vector form: $\dot{c}=Kc$. We don’t assume any special relation between constants, and consider them as independent quantities. The thermodynamic restrictions on constants are not applicable here because, in general, we study pseudomonomolecular systems which are subsystems of larger nonlinear systems and don’t represent by themselves closed monomolecular systems. For any network of linear reactions the matrix of kinetic coefficients $K$ has the following properties: * • non-diagonal elements of $K$ are non-negative; * • diagonal elements of $K$ are non-positive; * • elements in each column of $K$ have zero sum. For any $K$ with these properties there exists a network of linear reactions with kinetic equation $\dot{c}=Kc$. This family of matrices coincide with the family of generators of finite Markov chains, and this class of kinetic equations coincide with the class of inverse Kolmogorov’s equations or master equations for the finite Markov chains in continuous time (Meyn & Tweedie (2009); Meyn (2007)). A linear conservation law is a linear function defined on the concentrations $b(c)=\sum_{i}b_{i}c_{i}$, whose value is preserved by the dynamics (9). The conservation laws coefficient vectors $b_{i}$ are left eigenvectors of the matrix $K$ corresponding to the zero eigenvalue. The set of all the conservation laws forms the left kernel of the matrix $K$. Equation (9) always has a linear conservation law: $b^{0}(c)=\sum_{i}c_{i}={\rm const}$. If there is no other independent linear conservation law, then the system is weakly ergodic. A set $E$ is positively invariant with respect to kinetic equations (9), if any solution $c(t)$ that starts in $E$ at time $t_{0}$ ($c(t_{0})\in E$) belongs to $E$ for $t>t_{0}$ ($c(t)\in E$ if $t>t_{0}$). It is straightforward to check that the standard simplex $\Sigma=\\{c\,|\,c_{i}\geq 0,\,\sum_{i}c_{i}=1\\}$ is positively invariant set for kinetic equation (9): just to check that if $c_{i}=0$ for some $i$, and all $c_{j}\geq 0$ then $\dot{c}_{i}\geq 0$. This simple fact immediately implies the following properties of ${K}$: * • All eigenvalues $\lambda$ of ${K}$ have non-positive real parts, $Re\lambda\leq 0$, because solutions cannot leave $\Sigma$ in positive time; * • If $Re\lambda=0$ then $\lambda=0$, because intersection of $\Sigma$ with any plane is a polygon, and a polygon cannot be invariant with respect to rotations to sufficiently small angles; * • The Jordan cell of ${K}$ that corresponds to zero eigenvalue is diagonal – because all solutions should be bounded in $\Sigma$ for positive time. * • The shift in time operator $\exp({K}t)$ is a contraction in the $l_{1}$ norm for $t>0$. * • For weakly ergodic systems there exists such a monotonically decreasing function $\delta(t)$ ($t>0$, $0<\delta(t)<1$, $\delta(t)\to 0$ when $t\to\infty$) that for any two solutions of (9) $c(t),c^{\prime}(t)\in\Sigma$ $\sum_{i}|c_{i}(t)-c^{\prime}_{i}(t)|\leq\delta(t)\sum_{i}|c_{i}(0)-c^{\prime}_{i}(0)|\ .$ (10) The ergodicity coefficient $\delta(t)$ was introduced by Dobrushin (1956) (see also a book by Seneta (1981)). It can be estimated using the structure of the network graph (Gorban, Bykov & Yablonskii (1986); Meyn (2007)). Two vertices are called adjacent if they share a common edge. A path is a sequence of adjacent vertices. A graph is connected if any two of its vertices are linked by a path. A maximal connected subgraph of graph $G$ is called a connected component of $G$. Every graph can be decomposed into connected components. A directed path is a sequence of adjacent edges where each step goes in direction of an edge. A vertex $A$ is reachable from a vertex $B$, if there exists a directed path from $B$ to $A$. A nonempty set $V$ of graph vertices forms a sink, if there are no directed edges from $A_{i}\in V$ to any $A_{j}\notin V$. For example, in the reaction graph $A_{1}\leftarrow A_{2}\rightarrow A_{3}$ the one-vertex sets $\\{A_{1}\\}$ and $\\{A_{3}\\}$ are sinks. A sink is minimal if it does not contain a strictly smaller sink. In the previous example, $\\{A_{1}\\}$, $\\{A_{3}\\}$ are minimal sinks. Minimal sinks are also called ergodic components. A digraph is strongly connected, if every vertex $A$ is reachable from any other vertex $B$. Ergodic components are maximal strongly connected subgraphs of the graph, but inverse is not true: there may exist maximal strongly connected subgraphs that have outgoing edges and, therefore, are not sinks. The weak ergodicity of the network follows from its topological properties. Theorem 1. The following properties are equivalent (and each one of them can be used as an alternative definition of weak ergodicity): 1. 1. There exist the only independent linear conservation law for kinetic equations (9) (this is $b^{0}(c)=\sum_{i}c_{i}={\rm const}$). 2. 2. For any normalized initial state $c(0)$ ($b^{0}(c)=1$) there exists a limit state $c^{*}=\lim_{t\rightarrow\infty}\exp(Kt)\,c(0)$ that is the same for all normalized initial conditions: For all $c$, $\lim_{t\rightarrow\infty}\exp(Kt)\,c=b^{0}(c)c^{*}.$ 3. 3. For each two vertices $A_{i},\>A_{j}\>(i\neq j)$ we can find such a vertex $A_{k}$ that is reachable both from $A_{i}$ and from $A_{j}$. This means that the following structure exists: $A_{i}\to\ldots\to A_{k}\leftarrow\ldots\leftarrow A_{j}.$ One of the paths can be degenerated: it may be $i=k$ or $j=k$. 4. 4. The network has only one minimal sink (one ergodic component).$\square$ The proof of this theorem could be extracted from detailed books about Markov chains and networks (Meyn (2007); Van Mieghem (2006)). In its present form it was published by Gorban, Bykov & Yablonskii (1986) with explicit estimations of ergodicity coefficients. For every monomolecular kinetic system, the maximal number of independent linear conservation laws (i.e. the geometric multiplicity of the zero eigenvalue of the matrix $K$) is equal to the maximal number of disjoint ergodic components (minimal sinks). ### 2.3 Quasi-equilibrium (QE) or Fast Equilibrium Quasi-equilibrium approximation uses the assumption that a group of reactions is much faster than other and goes fast to its equilibrium. We use below superscripts ‘f’ and ‘s’ to distinguish fast and slow reactions. A small parameter appears in the following form $\begin{split}\frac{{\mathrm{d}}c}{{\mathrm{d}}t}=&\sum_{\sigma,\ {\rm slow}}w_{\sigma}^{\rm s}(c,T)\gamma_{\sigma}^{\rm s}+\frac{1}{\varepsilon}\sum_{\varsigma,\ {\rm fast}}w^{\rm f}_{\varsigma}(c,T)\gamma_{\varsigma}^{\rm f},\end{split}$ (11) To separate variables, we have to study the spaces of linear conservation law of the initial system (11) and of the fast subsystem $\frac{{\mathrm{d}}c}{{\mathrm{d}}t}=\frac{1}{\varepsilon}\sum_{\varsigma,\ {\rm fast}}w^{\rm f}_{\varsigma}(c,T)\gamma_{\varsigma}^{\rm f}$ If they coincide, then the fast subsystem just dominates, and there is no fast-slow separation for variables (all variables are either fast, or constant). But if there exist additional linearly independent linear conservation laws for the fast system, then let us introduce new variables: linear functions $b^{1}(c),...b^{n}(c)$, where $b^{1}(c),...b^{m}(c)$ is the basis of the linear conservation laws for the initial system, and $b^{1}(c),...b^{m+l}(c)$ is the basis of the linear conservation laws for the fast subsystem. Then $b^{m+l+1}(c),...b^{n}(c)$ are fast variables, $b^{m+1}(c),...b^{m+l}(c)$ are slow variables, and $b^{1}(c),...b^{m}(c)$ are constant. The quasi-equilibrium manifold is given by the equations $\sum_{\varsigma}w^{\rm f}_{\varsigma}(c,T)\gamma_{\varsigma}^{\rm f}=0$ and for small $\varepsilon$ it serves as an approximation to a slow manifold. In the old and standard approach it is assumed that system (11) as well as system of fast reactions satisfies the thermodynamic restrictions, and the quasi- equilibrium is just a partial thermodynamic equilibrium, and could be defined by conditional extremum of thermodynamic functions. This guarantees global stability of fast subsystems and all the classical singular perturbation theory like Tikhonov theorem could be applied. Recently, Vora & Daoutidis (2001) took notice that this type of reasoning does not require classical thermodynamic restrictions on constants. For example, let us consider the mass action law kinetics and group the reactions in pairs, direct and inverse reactions. If the set of stoichiometric vectors for fast reactions is linearly independent, then for this system the detailed balance principle holds (obviously), and it demonstrates the “thermodynamic behaviour” without connection to classical thermodynamics. This case of “stoichiometrically independent fast reactions” can be generalized for irreversible reactions too (Vora & Daoutidis (2001)). For such fast system the quasiequilbrium manifold has the same nice properties as for thermodynamic partial equilibrium, and approximates slow dynamics for sufficiently small $\varepsilon$. There are other classes of mass action law subsystems with such a “quasi- thermodynamic” behaviour, which depends on structure, but not on constants. For example, any system of reactions without interactions has such a property (Gorban, Bykov, & Yablonskii (1986)). These reactions have the form $\alpha A_{i}\to\sum...$: any linear reaction are allowed, as well as reactions like $2A_{i}\to A_{j}+A_{k}$, $3A_{i}\to A_{j}+A_{k}+A_{l}$, etc. All such fast subsystems can serve for quasi-equilibrium approximation, because for them dynamics is globally stable. Quasi-equilibrium manifold approximates exponentially attractive slow manifold and is used in many areas of kinetics either as initial approximation for slow motion, or just by itself (more discussion and further references are presented by Gorban & Karlin (2005)). ### 2.4 Quasi Steady-State (QSS) or Fast Species The quasi steady-state (or pseudo steady state) assumption was invented in chemistry for description of systems with radicals or catalysts. In the most usual version the species are split in two groups with concentration vectors $c^{\rm s}$ (“slow” or basic components) and $c^{\rm f}$ (“fast intermediates”). For catalytic reactions there is additional balance for $c^{\rm f}$, amount of catalyst, usually it is just a sum $b_{\rm f}=\sum_{i}c^{\rm f}_{i}$. The amount of the fast intermediates is assumed much smaller than the amount of the basic components, but the reaction rates are of the same order, or even the same (both intermediates and slow components participate in the same reactions). This is the source of a small parameter in the system. Let us scale the concentrations $c^{\rm f}$ and $c^{\rm s}$ to the compatible amounts. After that, the fast and slow time appear and we could write $\dot{c}^{\rm s}=W^{\rm s}(c^{\rm s},c^{\rm f})$, $\dot{c}^{\rm f}=\frac{1}{\varepsilon}W^{\rm f}(c^{\rm s},c^{\rm f})$, where $\varepsilon$ is small parameter, and functions $W^{\rm s},W^{\rm f}$ are bounded and have bounded derivatives (are “of the same order”). We can apply the standard singular perturbation techniques. If dynamics of fast components under given values of slow concentrations is stable, then the slow attractive manifold exists, and its zero approximation is given by the system of equations $W^{\rm f}(c^{\rm s},c^{\rm f})=0$. Bifurcations in fast system correspond to critical effects, including ignition and explosion. This scheme was analyzed many times with plenty of details, examples, and some complications. Exhaustive case study of the simplest enzyme reaction was provided by Segel & Slemrod (1989) . For heterogenious catalytic reactions, the book by Yablonskii, Bykov, Gorban, & Elokhin (1991) gives analysis of scaling of fast intermediates (there are many kinds of possible scaling). In the context of the Computational Singular Perturbation (CSP) approach, Lam (1993) and Lam & Goussis (1994) developed concept of the CSP radicals. Gorban & Karlin (2003, 2005) considered QSS as initial approximation for slow invariant manifold. Analysis of the error of the QSS was provided by Turanyi, Tomlin, & Pilling (1993). The QE approximation is also extremely popular and useful. It has simpler dynamical properties (respects thermodynamics, for example, and gives no critical effects in fast subsystems of closed systems). Nevertheless, neither radicals in combustion, nor intermediates in catalytic kinetics are, in general, close to quasi-equilibrium. They are just present in much smaller amount, and when this amount grows, then the QSS approximation fails. The simplest demonstration of these two approximation gives the simple reaction: $S+E\leftrightarrow SE\to P+E$ with reaction rate constants $k^{\pm}_{1}$ and $k_{2}$. The only possible quasi-equilibrium appears when the first equilibrium is fast: $k^{\pm}_{1}=\kappa^{\pm}/\varepsilon$. The corresponding slow variable is $C^{s}=c_{S}+c_{SE}$, $b_{E}=c_{E}+c_{SE}=const$. For the QE manifold we get a quadratic equation $\frac{k_{1}^{-}}{k_{1}^{+}}c_{SE}=c_{S}c_{E}=(C^{s}-c_{SE})(b_{E}-c_{SE})$. This equation gives the explicit dependence $c_{SE}(C^{s})$, and the slow equation reads $\dot{C}^{s}=-k_{2}c_{SE}(C^{s})$, $C^{s}+c_{P}=b_{S}=const$. For the QSS approximation of this reaction kinetics, under assumption $b_{E}\ll b_{S}$, we have fast intermediates $E$ and $SE$. For the QSS manifold there is a linear equation $k^{+}_{1}c_{S}c_{E}-k_{1}^{-}c_{SE}-k_{2}c_{SE}=0$, which gives us the explicit expression for $c_{SE}(c_{S})$: $c_{SE}=k_{1}^{+}c_{S}b_{E}/(k_{1}^{+}c_{S}+k_{1}^{-}+k_{2})$ (the standard Michaelis–Menten formula). The slow kinetics reads $\dot{c}_{S}=-k_{1}^{+}c_{S}(b_{E}-c_{SE}(c_{S}))+k_{1}^{-}c_{SE}(c_{S})$. The difference between the QSS and the QE in this example is obvious. The terminology is not rigorous, and often QSS is used for all singular perturbed systems, and QE is applied only for the thermodynamic exclusion of fast variables by the maximum entropy (or minimum of free energy, or extremum of another relevant thermodynamic function) principle (MaxEnt). This terminological convention may be convenient. Nevertheless, without any relation to terminology, the difference between these two types of introduction of a small parameter is huge. There exists plenty of generalizations of these approaches, which aim to construct a slow and (almost) invariant manifold, and to approximate fast motion as well. The following references can give a first impression about these methods: Method of Invariant Manifolds (MIM) (Roussel & Fraser (1991); Gorban & Karlin (2005), Method of Invariant Grids (MIG), a discrete analogue of invariant manifolds (Gorban, Karlin, & Zinovyev (2004)), Computational Singular Perturbations (CSP) (Lam (1993); Lam & Goussis (1994); Zagaris, Kaper, & Kaper (2004)) Intrinsic Low-Dimensional Manifolds (ILDM) by Maas, & Pope (1992), developed further in series of works by Bykov, Goldfarb, Gol’dshtein, & Maas, U. (2006)), methods based on the Lyapunov auxiliary theorem (Kazantzis & Kravaris (2006)). ### 2.5 Lumping Analysis Wei & Prater (1962) demonstrated that for (pseudo)monomolecular systems there exist linear combinations of concentrations which evolve in time independently. These linear combinations (quasicomponents) correspond to the left eigenvectors of kinetic matrix: if $lK=\lambda l$ then ${\mathrm{d}}(l,c)/{\mathrm{d}}t=(l,c)\lambda$, where the standard inner product $(l,c)$ is concentration of a quasicomponent. They also demonstrated how to find these quasicomponents in a properly organized experiment. This observation gave rise to a question: how to lump components into proper quasicomponents to guarantee the autonomous dynamics of the quasicomponents with appropriate accuracy. Wei and Kuo studied conditions for exact (Wei & Kuo (1969)) and approximate (Kuo & Wei (1969)) lumping in monomolecular and pseudomonomolecular systems. They demonstrated that under certain conditions large monomolecular system could be well–modelled by lower–order system. More recently, sensitivity analysis and Lie group approach were applied to lumping analysis (Li & Rabitz (1989); Toth, Li, Rabitz, & Tomlin (1997)), and more general nonlinear forms of lumped concentrations are used (for example, concentration of quasicomponents could be rational function of $c$). Hutchinson & Luss (1970) studied lumping-analysis of mixtures with many parallel first order reactions. Farkas (1999) generalized these results and characterized those lumping schemes which preserve the kinetic structure of the original system. Coxson & Bischoff (1987) placed lumping analysis in the linear systems theory and demonstrated the relationships between lumpability and the concepts of observability, controllability and minimal realization. Djouad & Sportisse (2002) considered the lumping procedures as efficient techniques leading to nonstiff systems and demonstrated efficiency of developed algorithm on kinetic models of atmospheric chemistry. Lin, Leibovici & Jorgensen (2008) formulated an optimal lumping problem as a mixed integer nonlinear programming (MINLP) and demonstrated that it can be efficiently solved with a stochastic optimization method, Tabu Search (TS) algorithm. The power of lumping using a time-scale based approach was demonstrated by Whitehouse, Tomlin, & Pilling (2004). This computationally cheap approach combines ideas of sensitivity analysis with simple and useful grouping of species with similar lifetimes and similar topological properties caused by connections of the species in the reaction networks. The lumped concentrations in this approach are simply sums of concentrations in groups. For example, species with similar composition and functionalities could be lumped into one single representative species (Pepiot-Desjardins & Pitsch (2008)). Lumping analysis based both on mathematical arguments and fundamental physical and chemical properties of the components is now one of the main tools for model reduction in highly multicomponent systems, such as the hydrocarbon mixture in petroleum chemistry (Zavala & Rodriguez & Vargas-Villamil (2004)) or biochemical networks in systems biology (Maria (2006)). The optimal solution of lumping problem often requires the exhaustive search, and instead of them various heuristics are used to avoid combinatorial explosion. For the lumping analysis of the systems biology models Dokoumetzidis & Aarons (2009) developed a heuristic greedy search strategy which allowed them to avoid the exhaustive search of proper lumped components. Procedures of lumping analysis form a part of general algebra of model building and model simplification transformations. Hangos & Cameron (2001) applied formal methods of computer science and artificial intelligence for analysis of this algebra. In particular, a formal method for defining syntax and semantics of process models has been proposed. The modern systems and control theory provides efficient tools for lumping–analysis. The so-called balanced model reduction was invented in late 1970s (Moore (1981)). For a linear system a set of “target variables” is selected. The dimension of the system $n$ is large, while the number of the target variables, for example, inputs $m$ and outputs $p$, usually satisfies $m,p\ll n$. The balanced model reduction problem can be stated as follows (Gugercin & Antoulas (2004)): find a reduced order system such that the following properties are satisfied: 1. 1. The approximation error in the target variables is small, and there exists a global error bound. 2. 2. System properties, like stability and passivity, are preserved. 3. 3. The procedure is computationally efficient. In large dimensions, special efforts are needed to resolve the accuracy/efficiency dilemma and to find efficiently the approximate solution of the model reduction problem (Antoulas & Sorensen (2002)). Various methods for balanced truncation are developed: Lyapunov balancing, stochastic balancing, bounded real balancing, positive real balancing, and frequency weighted balancing (Gugercin & Antoulas (2004)). Nonlinear generalizations are proposed as well (Lall, Marsden & Glavaki (2002); Condon & Ivanov (2004)). ### 2.6 Limiting Steps In the IUPAC Compendium of Chemical Terminology (2007) one can find a definition of limiting steps. Rate-controlling step (2007): “A rate- controlling (rate-determining or rate-limiting) step in a reaction occurring by a composite reaction sequence is an elementary reaction the rate constant for which exerts a strong effect – stronger than that of any other rate constant – on the overall rate.” Let us complement this definition by additional comment: usually when people are talking about limiting step they expect significantly more: there exists a rate constant which exerts such a strong effect on the overall rate that the effect of all other rate constants together is significantly smaller. For the IUPAC Compendium definition a rate-controlling step always exists, because among the control functions generically exists the biggest one. On the contrary, for the notion of limiting step that is used in practice, there exists a difference between systems with limiting step and systems without limiting step. During XX century, the concept of the limiting step was revised several times. First simple idea of a “narrow place” (the least conductive step) could be applied without adaptation only to a simple cycle or a chain of irreversible steps that are of the first order (see Chap. 16 of the book Johnston (1966) or the paper by Boyd (1978)). When researchers try to apply this idea in more general situations they meet various difficulties such as: * • Some reactions have to be “pseudomonomolecular.” Their constants depend on concentrations of outer components, and are constant only under condition that these outer components are present in constant concentrations, or change sufficiently slow (i.e. are present in significantly bigger amount). * • Even under fixed or slow outer components concentration, the simple “narrow place” behaviour could be spoiled by branching or by reverse reactions. The simplest example is given by the cycle: $A_{1}\leftrightarrow A_{2}\to A_{3}\to A_{1}$. Even if the constant of the last step $A_{3}\to A_{1}$ is the smallest one, the stationary rate may be much smaller than $k_{3}b$ (where $b$ is the overall balance of concentrations, $b=c_{1}+c_{2}+c_{3}$), if the constant of the reverse reaction $A_{2}\to A_{1}$ is sufficiently big. In a series of papers, Northrop (1981, 2001) clearly explained these difficulties and suggested that the concept of rate–limiting step is “outmoded”. Nevertheless, the main idea of limiting is so attractive that Northrop’s arguments stimulated the search for modification and improvement of the main concept. Ray (1983) proposed the use of sensitivity analysis. He considered cycles of reversible reactions and suggested a definition: The rate–limiting step in a reaction sequence is that forward step for which a change of its rate constant produces the largest effect on the overall rate. Ray’s approach was revised by Brown & Cooper (1993) from the system control analysis point of view (see the book of Cornish-Bowden & Cardenas (1990)). They stress again that there is no unique rate–limiting step specific for an enzyme, and this step, even if it exists, depends on substrate, product and effector concentrations. Near critical conditions the critical simplification appears, which is also a type of limitation, because some reactions become critically important (Yablonsky, Mareels, & Lazman (2003)) Two classical examples of limiting steps demonstrate us the chain of linear reaction and the linear catalytic cycle, when they include a reaction which is significantly slower, than other reactions. A linear chain of reactions, $A_{1}\to A_{2}\to...A_{n}$, with reaction rate constants $k_{i}$ (for $A_{i}\to A_{i+1}$), gives the first example of limiting steps. Let the reaction rate constant $k_{q}$ be the smallest one. Then we expect the following behaviour of the reaction chain in time scale $\gtrsim 1/k_{q}$: all the components $A_{1},...A_{q-1}$ transform fast into $A_{q}$, and all the components $A_{q+1},...A_{n-1}$ transform fast into $A_{n}$, only two components, $A_{q}$ and $A_{n}$ are present (concentrations of other components are small) , and the whole dynamics in this time scale can be represented by a single reaction $A_{q}\to A_{n}$ with reaction rate constant $k_{q}$. This picture becomes more exact when $k_{q}$ becomes smaller with respect to other constants. The catalytic cycle is one of the most important substructures that we study in reaction networks. In the reduced form the catalytic cycle is a set of linear reactions: $A_{1}\to A_{2}\to\ldots A_{n}\to A_{1}.$ Reduced form means that in reality some of these reaction are not monomolecular and include some other components (not from the list $A_{1},\ldots A_{n}$). But in the study of the isolated cycle dynamics, concentrations of these components are taken as constant and are included into kinetic constants of the cycle linear reactions. For the constant of elementary reaction $A_{i}\to$ we use the simplified notation $k_{i}$ because the product of this elementary reaction is known, it is $A_{i+1}$ for $i<n$ and $A_{1}$ for $i=n$. The elementary reaction rate is $w_{i}=k_{i}c_{i}$, where $c_{i}$ is the concentration of $A_{i}$. The kinetic equation is: $\dot{c}_{i}=k_{i-1}c_{i-1}-k_{i}c_{i},$ (12) where by definition $c_{0}=c_{n}$, $k_{0}=k_{n}$, and $w_{0}=w_{n}$. In the stationary state ($\dot{c}_{i}=0$), all the $w_{i}$ are equal: $w_{i}=w$. This common rate $w$ we call the cycle stationary rate, and $w=\frac{b}{\frac{1}{k_{1}}+\ldots\frac{1}{k_{n}}};\;\;c_{i}=\frac{w}{k_{i}},$ (13) where $b=\sum_{i}c_{i}$ is the conserved quantity for reactions in constant volume. Let one of the constants, $k_{\min}$, be much smaller than others (let it be $k_{\min}=k_{n}$): $k_{i}\gg k_{\min}\ \ {\rm if}\ \ i\neq n\ .$ (14) In this case, in linear approximation $w=k_{n}b$, $c_{n}=b\left(1-\sum_{i<n}\frac{k_{n}}{k_{i}}\right),\ {\rm and}\;c_{i}=b\frac{k_{n}}{k_{i}}\ {\rm for}\ i\neq n\ .$ (15) The simplest zero order approximation for the steady state gives $c_{n}=b,\;c_{i}=0\;(i\neq n).$ (16) This is trivial: all the concentration is collected at the starting point of the “narrow place,” but may be useful as an origin point for various approximation procedures. So, the stationary rate of a cycle is determined by the smallest constant, $k_{\min}$, if it is much smaller than the constants of all other reactions (14): $w\approx k_{\min}b.$ (17) In that case we say that the cycle has a limiting step with constant $k_{\min}$. ## 3 Dynamics of Catalytic Cycle with Limiting Step ### 3.1 Eigenvalues There is significant difference between the examples of limiting steps for the chain of reactions and for irreversible cycle. For the chain, the steady state does not depend on nonzero rate constants. It is just $c_{n}=b,c_{1}=c_{2}=...=c_{n-1}=0$. The smallest rate constant $k_{q}$ gives the smallest positive eigenvalue, the relaxation time is $\tau=1/k_{q}$. The corresponding approximation of eigenmode (right eigenvector) $r^{1}$ has coordinates: $r^{1}_{1}=...=r^{1}_{q-1}=0$, $r^{1}_{q}=1$, $r^{1}_{q+1}=...=r^{1}_{n-1}=0$, $r_{n}=-1$. This exactly corresponds to the statement that the whole dynamics in the time scale $\gtrsim 1/k_{q}$ can be represented by a single reaction $A_{q}\to A_{n}$ with reaction rate constant $k_{q}$. The left eigenvector for eigenvalue $k_{q}$ has approximation $l^{1}$ with coordinates $l^{1}_{1}=l^{1}_{2}=...=l^{1}_{q}=1$, $l^{1}_{q+1}=...=l^{1}_{n}=0$. This vector provides the almost exact lumping on time scale $\gtrsim 1/k_{q}$. Let us introduce a new variable $c_{\rm lump}=\sum_{i}l_{i}c_{i}$, i.e. $c_{\rm lump}=c_{1}+c_{2}+...+c_{q}$. For the time scale $\gtrsim 1/k_{q}$ we can write $c_{\rm lump}+c_{n}\approx b$, ${\mathrm{d}}c_{\rm lump}/{\mathrm{d}}t\approx-k_{q}c_{\rm lump}$, ${\mathrm{d}}c_{n}/{\mathrm{d}}t\approx k_{q}c_{\rm lump}$. In the example of a cycle, we approximate the steady state, that is, the right eigenvector $r^{0}$ for zero eigenvalue (the left eigenvector is known and corresponds to the main linear balance $b$: $l^{0}_{i}\equiv 1$). In the zero- order approximation, this eigenvector has coordinates $r^{0}_{1}=...=r^{0}_{n-1}=0$, $r^{0}_{n}=1$. If ${k_{n}}/{k_{i}}$ is small for all $i<n$, then the kinetic behaviour of the cycle is determined by a linear chain of $n-1$ reactions $A_{1}\to A_{2}\to...A_{n}$, which we obtain after cutting the limiting step. The characteristic equation for an irreversible cycle, $\prod_{i=1}^{n}(\lambda+k_{i})-\prod_{i=1}^{n}k_{i}=0$, tends to the characteristic equation for the linear chain, $\lambda\prod_{i=1}^{n-1}(\lambda+k_{i})=0$, when $k_{n}\to 0$. The characteristic equation for a cycle with limiting step ($k_{n}/k_{i}\ll 1$) has one simple zero eigenvalue that corresponds to the conservation law $\sum c_{i}=b$ and $n-1$ nonzero eigenvalues $\lambda_{i}=-{k_{i}}+\delta_{i}\;(i<n).$ (18) where $\delta_{i}\to 0$ when $\sum_{i<n}\frac{k_{n}}{k_{i}}\to 0$. A cycle with limiting step (12) has real eigenspectrum and demonstrates monotonic relaxation without damped oscillations. Of course, without limitation such oscillations could exist, for example, when all $k_{i}\equiv k>0$, ($i=1,...n$). The relaxation time of a stable linear system (12) is, by definition, $\tau=1/\min\\{Re(-\lambda_{i})\\}$ ($\lambda\neq 0$). For small $k_{n}$, $\tau\approx 1/k_{\tau}$, $k_{\tau}=\min\\{k_{i}\\}$, ($i=1,...n-1$). In other words, for a cycle with limiting step, $k_{\tau}$ is the second slowest rate constant: $k_{\min}\ll k_{\tau}\leq...$. ### 3.2 Eigenvectors for Reaction Chain and for Catalytic Cycle with Limiting Step Let the irreversible cycle include a limiting step: $k_{n}\ll k_{i}$ ($i=1,...,n-1$) and, in addition, $k_{n}\ll|k_{i}-k_{j}|$ ($i,j=1,...,n-1$, $i\neq j$), then the eigenvectors of the kinetic matrix almost coincide with the eigenvectors for the linear chain of reactions $A_{1}\to A_{2}\to...A_{n}$, with reaction rate constants $k_{i}$ (for $A_{i}\to A_{i+1}$) (Gorban & Radulescu (2008)). The kinetic equation for the linear chain is $\dot{c_{i}}=k_{i-1}c_{i-1}-k_{i}c_{i},$ (19) The coefficient matrix $K$ of these equations is very simple. It has nonzero elements only on the main diagonal, and one position below. The eigenvalues of $K$ are $-k_{i}$ ($i=1,...n-1$) and 0. The left and right eigenvectors for 0 eigenvalue, $l^{0}$ and $r^{0}$, are: $l^{0}=(1,1,...1),\;\;r^{0}=(0,0,...0,1),$ (20) all coordinates of $l^{0}$ are equal to 1, the only nonzero coordinate of $r^{0}$ is $r^{0}_{n}$ and we represent vector–column $r^{0}$ in row. Below we use explicit form of $K$ left and right eigenvectors. Let vector–column $r^{i}$ and vector–row $l^{i}$ be right and left eigenvectors of $K$ for eigenvalue $-k_{i}$. For coordinates of these eigenvectors we use notation $r^{i}_{j}$ and $l^{i}_{j}$. Let us choose a normalization condition $r^{i}_{i}=l^{i}_{i}=1$. It is straightforward to check that $r^{i}_{j}=0$ $(j<i)$ and $l^{i}_{j}=0$ $(j>i)$, $r^{i}_{j+1}=k_{j}r_{j}/(k_{j+1}-k_{i})$ $(j\geq i)$ and $l^{i}_{j-1}=k_{j-1}l_{j}/(k_{j-1}-k_{j})$ $(j\leq i)$, and $r^{i}_{i+m}=\prod_{j=1}^{m}\frac{k_{i+j-1}}{k_{i+j}-k_{i}};\;l^{i}_{i-m}=\prod_{j=1}^{m}\frac{k_{i-j}}{k_{i-j}-k_{i}}.$ (21) It is convenient to introduce formally $k_{0}=0$. Under selected normalization condition, the inner product of eigenvectors is: $l^{i}r^{j}=\delta_{ij}$, where $\delta_{ij}$ is the Kronecker delta. If the rate constants any two constants, $k_{i}$, $k_{j}$ are connected by relation $k_{i}\gg k_{j}$ or $k_{i}\ll k_{j}$ (i.e. they are well separated), then $\frac{k_{i-j}}{k_{i-j}-k_{i}}\approx\left\\{\begin{aligned} &1,\;&\mbox{if}\;k_{i}\ll k_{i-j};\\\ &0,\;&\mbox{if}\;k_{i}\gg k_{i-j},\end{aligned}\right.$ (22) Hence, $|l^{i}_{i-m}|\approx 1$ or $|l^{i}_{i-m}|\approx 0$. To demonstrate that also $|r^{i}_{i+m}|\approx 1$ or $|r^{i}_{i+m}|\approx 0$, we shift nominators in the product (21) on such a way: $r^{i}_{i+m}=\frac{k_{i}}{k_{i+m}-k_{i}}\prod_{j=1}^{m-1}\frac{k_{i+j}}{k_{i+j}-k_{i}}.$ Exactly as in (22), each multiplier $\frac{k_{i+j}}{k_{i+j}-k_{i}}$ here is either almost 1 or almost 0, and $\frac{k_{i}}{k_{i+m}-k_{i}}$ is either almost 0 or almost $-1$. In this zero-one asymptotics $\begin{split}l^{i}_{i}=&1,\;l^{i}_{i-m}\approx 1\;\\\ &\mbox{if}\;k_{i-j}>k_{i}\;\mbox{for all}\;j=1,\ldots m,\;\mbox{else}\;l^{i}_{i-m}\approx 0;\\\ r^{i}_{i}=&1,\;r^{i}_{i+m}\approx-1\;\\\ &\mbox{if}\;k_{i+j}>k_{i}\;\mbox{for all}\;j=1,\ldots m-1\;\\\ &\mbox{and}\;k_{i+m}<k_{i},\;\mbox{else}\;r^{i}_{i+m}\approx 0.\end{split}$ (23) In this asymptotic (Fig. 1), only two coordinates of right eigenvector $r^{i}$ can have nonzero values, $r^{i}_{i}=1$ and $r^{i}_{i+m}\approx-1$ where $m$ is the first such positive integer that $i+m<n$ and $k_{i+m}<k_{i}$. Such $m$ always exists because $k_{n}=0$. For left eigenvector $l^{i}$, $l^{i}_{i}\approx\ldots l^{i}_{i-q}\approx 1$ and $l^{i}_{i-q-j}\approx 0$ where $j>0$ and $q$ is the first such positive integer that $i-q-1>0$ and $k_{i-q-1}<k_{i}$. It is possible that such $q$ does not exist. In that case, all $l^{i}_{i-j}\approx 1$ for $j\geq 0$. It is straightforward to check that in this asymptotic $l^{i}r^{j}=\delta_{ij}$. Figure 1: Graphical representation of eigenvectors approximation for the linear chain of reactions with well separated constants. To find the left ($l$) and right ($r$) eigenvectors for eigenvalue $k$ it is necessary to delete from the chain all the reactions with the rate constants $<k$ (dashed lines) and to find the maximal connected interval, where the reaction with constant $k$ (bold arrow) is situated. The right eigenvector $r$ has coordinate 1 for the vertex, which is the beginning of the reaction with constant $k$, and coordinate $-1$ for the vertex, which is end of the interval in the direction of reactions. The left eigenvector $l$ has coordinate 1 for the beginning of the reaction with constant $k$ and for all preceding vertices from the connected interval. All other coordinates of $r$ and $l$ are zero. The simplest example gives the order $k_{1}\gg k_{2}\gg...\gg k_{n-1}$: $l^{i}_{i-j}\approx 1$ for $j\geq 0$, $r^{i}_{i}=1$, $r^{i}_{i+1}\approx-1$ and all other coordinates of eigenvectors are close to zero. For the inverse order, $k_{1}\ll k_{2}\ll...\ll k_{n-1}$, $l^{i}_{i}=1$, $r^{i}_{i}=1$, $r^{i}_{n}\approx-1$ and all other coordinates of eigenvectors are close to zero. For less trivial example, let us find the asymptotic of left and right eigenvectors for a chain of reactions: $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!5}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{6},$ where the upper index marks the order of rate constants: $k_{4}\gg k_{5}\gg k_{2}\gg k_{3}\gg k_{1}$ ($k_{i}$ is the rate constant of reaction $A_{i}\to...$). For left eigenvectors, rows $l^{i}$, we have the following asymptotics: $\begin{split}&l^{1}\approx(1,0,0,0,0,0),\;l^{2}\approx(0,1,0,0,0,0),\;\\\ &l^{3}\approx(0,1,1,0,0,0),l^{4}\approx(0,0,0,1,0,0),\;\\\ &l^{5}\approx(0,0,0,1,1,0).\end{split}$ (24) For right eigenvectors, columns $r^{i}$, we have the following asymptotics (we write vector-columns in rows): $\begin{split}&r^{1}\approx(1,0,0,0,0,-1),\;r^{2}\approx(0,1,-1,0,0,0),\;\\\ &r^{3}\approx(0,0,1,0,0,-1),r^{4}\approx(0,0,0,1,-1,0),\;\\\ &r^{5}\approx(0,0,0,0,1,-1).\end{split}$ (25) The corresponding approximation to the general solution of the kinetic equations is: $c(t)=(l^{0},c(0))r^{0}+\sum_{i=1}^{n-1}(l^{i}c(0))r^{i}\exp(-k_{i}t),$ (26) where $c(0)$ is the initial concentration vector, and for left and right eigenvectors $l^{i}$ and $r^{i}$ we use their zero-one asymptotic. In other words, approximation of the left eigenvectors provides us with almost exact lumping (for analysis of exact lumping see the paper by Li & Rabitz (1989)) . ## 4 Acyclic Non-branching Network: Explicit Formulas for Eigenvectors So, to analyze asymptotic of eigenvalues and eigenvectors for a irreversible cycle, we cut the reaction with the smallest constant, get a linear chain, and analyze the eigenvalues and eigenvectors for this chain. For a general multiscale reaction network (instead of a cycle) we will come, after some surgery, to acyclic non-branching reaction networks (instead of a linear chain). For any network without branching, we can simplify the notation for the kinetic constants, by introducing $\kappa_{i}=k_{ji}$ for the only reaction $A_{i}\to A_{j}$, or $\kappa_{i}=0$, if there is no such a reaction. Also it is useful to introduce a map $\phi$ on the set of vertices: $\phi(i)=j$, if there exist reaction $A_{i}\to A_{j}$, and $\phi(i)=i$ if there are no outgoing reactions from the $A_{i}\to A_{j}$. For iterations of the map $\phi$ we use notation $\phi^{q}$. For an acyclic non-branching reaction network, for any vertex $A_{i}$ there is an eigenvalue $-\kappa_{i}$ and the corresponding eigenvector. If $A_{i}$ is a sink vertex, then this eigenvalue is zero. For left and right eigenvectors of $K$ that correspond to $A_{i}$ we use notations $l^{i}$ (vector-row) and $r^{i}$ (vector-column), correspondingly. Let us suppose that $A_{f}$ is a sink vertex of the network. Its associated right and left eigenvectors corresponding to the zero eigenvalue are given by: $r^{i}_{j}=\delta_{ij}$; $l^{i}_{j}=1$ if and only if $\phi^{q}(j)=i$ for some $q>0$. Figure 2: Graphical representation of eigenvectors approximation for the acyclic non-branching reaction network with well separated constants (compare to Fig. 1). The eigenvalue $-k$ corresponds to the reaction $A_{i}\to A_{\phi(i)}$ (bold arrow). To the right from $A_{i}$ are vertices $A_{\phi^{q}(i)}$ and to the left are those $A_{j}$, for which there exists such $q$ that $\phi^{q}(j)=i$. The reactions with the rate constants $<k$ (dashed lines) are deleted from the network. The right and left eigenvectors could have nonzero coordinates only for vertices from the maximal connected subgraph of the presented graph, where the $A_{i}$ is situated. The right eigenvector $r$ has coordinate 1 for $A_{i}$ (beginning of the bold arrow), and coordinate $-1$ for the vertex, which is the minimal in that connected subgraph. The left eigenvector $l$ has coordinate 1 for the beginning of the reaction with constant $k$ and for all preceding vertices from the subgraph. All other coordinates of $r$ and $l$ are zero. For nonzero eigenvalues, right eigenvectors will be constructed by recurrence starting from the vertex $A_{i}$ and moving in the direction of the flow. The construction is in opposite direction for left eigenvectors. For right eigenvector $r^{i}$ only coordinates $r^{i}_{\phi^{k}(i)}$ ($k=0,1,\ldots\tau_{i}$) could have nonzero values, and $\begin{split}r^{i}_{\phi^{k+1}(i)}=\frac{\kappa_{\phi^{k}(i)}}{\kappa_{\phi^{k+1}(i)}-\kappa_{i}}r^{i}_{\phi^{k}(i)}=\prod_{j=0}^{k}\frac{\kappa_{\phi^{j}(i)}}{\kappa_{\phi^{j+1}(i)}-\kappa_{i}}\\\ =\frac{\kappa_{i}}{\kappa_{\phi^{k+1}(i)}-\kappa_{i}}\prod_{j=0}^{k-1}\frac{\kappa_{\phi^{j+1}(i)}}{\kappa_{\phi^{j+1}(i)}-\kappa_{i}}.\end{split}$ (27) For left eigenvector $l^{i}$ coordinate $l^{i}_{j}$ could have nonzero value only if there exists such $q\geq 0$ that $\phi^{q}(j)=i$ (this $q$ is unique because the system is acyclic): $l^{i}_{j}=\frac{\kappa_{j}}{\kappa_{j}-\kappa_{i}}l^{i}_{\phi(j)}=\prod_{k=0}^{q-1}\frac{\kappa_{\phi^{k}(j)}}{\kappa_{\phi^{k}(j)}-\kappa_{i}}.$ (28) For well separated constants, we can write the asymptotic representation explicitly, analogously to (23) (Fig. 2). For left eigenvectors, $l^{i}_{i}=1$ and $l^{i}_{j}=1$ (for $i\neq j$) if there exists such $q$ that $\phi^{q}(j)=i$, and $\kappa_{\phi^{d}(j)}>\kappa_{i}$ for all $d=0,\ldots q-1$, else $l^{i}_{j}=0$. For right eigenvectors, $r^{i}_{i}=1$ and $r^{i}_{\phi^{k}(i)}=-1$ if $\kappa_{\phi^{k}(i)}<\kappa_{i}$ and for all positive $m<k$ inequality $\kappa_{\phi^{m}(i)}>\kappa_{i}$ holds, i.e. $k$ is first such positive integer that $\kappa_{\phi^{k}(i)}<\kappa_{i}$ (for fixed point $A_{p}$ we use $\kappa_{p}=0$). Vector $r^{i}$ has not more than two nonzero coordinates. It is straightforward to check that in this asymptotic $l^{i}r^{j}=\delta_{ij}$. For example, let us find that asymptotic for a branched acyclic system of reactions: $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!7}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!5}}\,\,A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{8},\;\;A_{6}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{7}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{4}$ where the upper index marks the order of rate constants: $\kappa_{6}>\kappa_{4}>\kappa_{7}>\kappa_{5}>\kappa_{2}>\kappa_{3}>\kappa_{1}$ ($\kappa_{i}$ is the rate constant of reaction $A_{i}\to...$). For zero eigenvalue, the left and right eigenvectors are $l^{8}=(1,1,1,1,1,1,1,1,1),\;r^{8}=(0,0,0,0,0,0,0,1).$ For left eigenvectors, rows $l^{i}$, that correspond to nonzero eigenvalues we have the following asymptotics: $\begin{split}&l^{1}\approx(1,0,0,0,0,0,0,0),\;l^{2}\approx(0,1,0,0,0,0,0,0),\;\\\ &l^{3}\approx(0,1,1,0,0,0,0,0),l^{4}\approx(0,0,0,1,0,0,0,0),\;\\\ &l^{5}\approx(0,0,0,1,1,1,1,0),\;l^{6}\approx(0,0,0,0,0,1,0,0).\\\ &l^{7}\approx(0,0,0,0,0,1,1,0)\end{split}$ (29) For the corresponding right eigenvectors, columns $r^{i}$, we have the following asymptotics (we write vector-columns in rows): $\begin{split}&r^{1}\\!\approx\\!(1,0,0,0,0,0,0,-1),\,r^{2}\\!\approx\\!(0,1,-1,0,0,0,0,0),\\\ &r^{3}\\!\approx\\!(0,0,1,0,0,0,0,-1),\,r^{4}\\!\approx\\!(0,0,0,1,-1,0,0,0),\\\ &r^{5}\\!\approx\\!(0,0,0,0,1,0,0,-1),\,r^{6}\\!\approx\\!(0,0,0,0,0,1,-1,0),\\\ &r^{7}\\!\approx\\!(0,0,0,0,-1,0,1,0).\end{split}$ (30) ## 5 Calculating the Dominant System for a Linear Multiscale Network ### 5.1 Problem Statement We study asymptotical behavior of the transformation of the kinetic matrix $K$ to the normal form along the lines $\ln k_{ij}=\theta_{ij}\xi$ when $\xi\to\infty$. For almost all direction vectors $(\theta_{ij})$ (outside several hyperplanes) there exists a minimal reaction network which reaction rate constants are monomials of $k_{ij}$ ($\prod_{ij}k_{ij}^{f_{ij}}$, where $f_{ij}$ are not obligatory positive numbers) and eigenvectors and eigenvalues approximate the eigenvectors and eigenvalues when $\xi\to\infty$ with arbitrary high relative accuracy. We call this minimal system the dominant system. Existence of dominant systems is proven by direct construction (this Sec.) and estimates of accuracy of approximations (Appendix). The dominant systems coincide for vectors $(\theta_{ij})$ from some polyhedral cones. Therefore, we don’t need to study a given value of $(\theta_{ij})$ but rather have to build these cones together with the correspondent dominant systems. The following formal rule (“assumption of well separated constants”) allows us to simplify this task: if in construction of dominant systems we need to compare two monomials, $M_{f}=\prod_{ij}k_{ij}^{f_{ij}}$ and $M_{g}=\prod_{ij}k_{ij}^{g_{ij}}$ then we can always state that either $M_{f}\gg M_{g}$ or $M_{f}\ll M_{g}$ and consider the logarithmic hyperplane $M_{f}=M_{g}$ as a boundary between different cones. At the end, we can join all cones with the same dominant system. We are interested in robust asymptotic and do not analyze directions $(\theta_{ij})$ which belong to the boundary hyperplanes. This robust asymptotic with well separated constants and acyclic dominant systems is typical because the exclusive direction vectors belon to a finite number of hyperplanes. There may be other approaches based on (i) the Maslov dequantization and idempotent algebras (Litvinov & Maslov (2005)), (ii) the limit of log-uniform distributions in wide boxes of constants under some conditions (Feng, Hooshangi, Chen, Li, Weiss, & Rabitz (2004); Gorban & Radulescu (2008)), or (iii) on consideration of all possible orderings of all monomials with integer exponents and construction of correspondent dominant systems (Robbiano (1985) proved that there exists only a final number of such orderings and enumerated all of them, see also the book by Greuel & Pfister (2002)). They give the same final result but with different intermediate steps. ### 5.2 Auxiliary Operations #### 5.2.1 From Reaction Network to Auxiliary Dynamical System Let us consider a reaction network $\mathcal{W}$ with a given structure and fixed ordering of constants. The set of vertices of $\mathcal{W}$ is $\mathcal{A}$ and the set of elementary reactions is $\mathcal{R}$. Each reaction from $\mathcal{R}$ has the form $A_{i}\to A_{j}$, $A_{i},A_{j}\in\mathcal{A}$. The corresponding constant is $k_{ji}$. For each $A_{i}\in\mathcal{A}$ we define $\kappa_{i}=\max_{j}\\{k_{ji}\\}$ and $\phi(i)={\rm arg\,max}_{j}\\{k_{ji}\\}$. In addition, $\phi(i)=i$ if $k_{ji}=0$ for all $j$. Figure 3: Construction of the auxiliary reaction network by pruning. For every vertex, it is necessary to leave the outgoing reaction with maximal reaction rate constant. Other reactions should be deleted. The auxiliary discrete dynamical system for the reaction network $\mathcal{W}$ is the dynamical system $\Phi=\Phi_{\mathcal{W}}$ defined by the map $\phi$ on the finite set $\mathcal{A}$. The auxiliary reaction network (Fig. 3) $\mathcal{V}=\mathcal{V}_{\mathcal{W}}$ has the same set of vertices $\mathcal{A}$ and the set of reactions $A_{i}\to A_{\phi(i)}$ with reaction constants $\kappa_{i}$. Auxiliary kinetics is described by $\dot{c}=\tilde{K}c$, where $\tilde{K}_{ij}=-\kappa_{j}\delta_{ij}+\kappa_{j}\delta_{i\,\phi(j)}$. #### 5.2.2 Decomposition of Discrete Dynamical Systems on Finite Sets Discrete dynamical system on a finite set $V=\\{A_{1},A_{2},\ldots A_{n}\\}$ is a semigroup $1,\phi,\phi^{2},...$, where $\phi$ is a map $\phi:V\to V$. $A_{i}\in V$ is a periodic point, if $\phi^{l}(A_{i})=A_{i}$ for some $l>0$; else $A_{i}$ is a transient point. A cycle of period $l$ is a sequence of $l$ distinct periodic points $A,\phi(A),\phi^{2}(A),\ldots\phi^{l-1}(A)$ with $\phi^{l}(A)=A$. A cycle of period one consists of one fixed point, $\phi(A)=A$. Two cycles, $C,C^{\prime}$ either coincide or have empty intersection. The set of periodic points, $V^{\rm p}$, is always nonempty. It is a union of cycles: $V^{\rm p}=\cup_{j}C_{j}$. For each point $A\in V$ there exist such a positive integer $\tau(A)$ and a cycle $C(A)=C_{j}$ that $\phi^{q}(A)\in C_{j}$ for $q\geq\tau(A)$. In that case we say that $A$ belongs to basin of attraction of cycle $C_{j}$ and use notation $Att(C_{j})=\\{A\ |\ C(A)=C_{j}\\}$. Of course, $C_{j}\subset Att(C_{j})$. For different cycles, $Att(C_{j})\cap Att(C_{l})=\varnothing$. If $A$ is periodic point then $\tau(A)=0$. For transient points $\tau(A)>0$. Figure 4: Decomposition of a discrete dynamical system. So, the phase space $V$ is divided onto subsets $Att(C_{j})$ (Fig. 4). Each of these subsets includes one cycle (or a fixed point, that is a cycle of length 1). Sets $Att(C_{j})$ are $\phi$-invariant: $\phi(Att(C_{j}))\subset Att(C_{j})$. The set $Att(C_{j})\setminus C_{j}$ consist of transient points and there exists such positive integer $\tau$ that $\phi^{q}(Att(C_{j}))=C_{j}$ if $q\geq\tau$. Discrete dynamical systems on a finite sets correspond to graphs without branching points. Notice that for the graph that represents a discrete dynamic system, attractors are ergodic components, while basins are connected components. ### 5.3 Algorithm for Calculating the Dominant System For this general case, the algorithm consists of two main procedures: (i) cycles gluing and (ii) cycles restoration and cutting. #### 5.3.1 Cycles Gluing Let us start from a reaction network $\mathcal{W}$ with a given structure and fixed ordering of constants. The set of vertices of $\mathcal{W}$ is $\mathcal{A}$ and the set of elementary reactions is $\mathcal{R}$. If all attractors of the auxiliary dynamic system $\Phi_{\mathcal{W}}$ are fixed points $A_{f1},A_{f2},...\in\mathcal{A}$, then the auxiliary reaction network is acyclic, and the auxiliary kinetics approximates relaxation of the whole network $\mathcal{W}$. In general case, let the system $\Phi_{\mathcal{W}}$ have several attractors that are not fixed points, but cycles $C_{1},C_{2},...$ with periods $\tau_{1},\tau_{2},...>1$. By gluing these cycles in points, we transform the reaction network $\mathcal{W}$ into $\mathcal{W}^{1}$. The dynamical system $\Phi_{\mathcal{W}}$ is transformed into $\Phi^{1}$. For these new system and network, the connection $\Phi^{1}=\Phi_{\mathcal{W}^{1}}$ persists: $\Phi^{1}$ is the auxiliary discrete dynamical system for $\mathcal{W}^{1}$. For each cycle, $C_{i}$, we introduce a new vertex $A^{i}$. The new set of vertices, $\mathcal{A}^{1}=\mathcal{A}\cup\\{A^{1},A^{2},...\\}\setminus(\cup_{i}C_{i})$ (we delete cycles $C_{i}$ and add vertices $A^{i}$). Figure 5: Gluing a cycle with rate constants renormalization. $c^{\rm QS}_{l}$ are the quasistationary concentrations on the cycle. After gluing, we have to leave the outgoing from $A^{1}$ reaction with the maximal renormalized rate constant, and delete others. All the reaction $A\to B$ from the initial set $\mathcal{R}$, ($A,B\in\mathcal{A}$) can be separated into 5 groups: 1. 1. both $A,B\notin\cup_{i}C_{i}$; 2. 2. $A\notin\cup_{i}C_{i}$, but $B\in C_{i}$; 3. 3. $A\in C_{i}$, but $B\notin\cup_{i}C_{i}$; 4. 4. $A\in C_{i}$, $B\in C_{j}$, $i\neq j$; 5. 5. $A,B\in C_{i}$. Reactions from the first group do not change. Reaction from the second group transforms into $A\to A^{i}$ (to the whole glued cycle) with the same constant. Reaction of the third type changes into $A^{i}\to B$ with the rate constant renormalization: let the cycle $C^{i}$ be the following sequence of reactions $A_{1}\to A_{2}\to...A_{\tau_{i}}\to A_{1}$, and the reaction rate constant for $A_{i}\to A_{i+1}$ is $k_{i}$ ($k_{\tau_{i}}$ for $A_{\tau_{i}}\to A_{1}$). For the limiting reaction of the cycle $C_{i}$ we use notation $k_{\lim\,i}$. If $A=A_{j}$ and $k$ is the rate reaction for $A\to B$, then the new reaction $A^{i}\to B$ has the rate constant $kk_{\lim\,i}/k_{j}$. This corresponds to a quasistationary distribution on the cycle (15). The new rate constant is smaller than the initial one: $kk_{\lim\,i}/k_{j}<k$, because $k_{\lim\,i}<k_{j}$ due to definition of limiting constant. The same constant renormalization is necessary for reactions of the fourth type. These reactions transform into $A^{i}\to A^{j}$. Finally, reactions of the fifth type vanish. After we glue all the cycles (Fig. 5) of auxiliary dynamical system in the reaction network $\mathcal{W}$, we get $\mathcal{W}^{1}$. Let us assign $\mathcal{W}:=\mathcal{W}^{1}$, $\mathcal{A}:=\mathcal{A}^{1}$ and iterate until we obtain an acyclic network and exit. This acyclic network is a “forest” and consists of trees oriented from leafs to a root. The number of such trees coincide with the number of fixed points in the final network. After gluing we can identify the reactions, which will be included into the dominant system. Their constants are the critical parameters of the networks. The list of these parameters, consists of all reaction rates of the final acyclic auxiliary network, and of the rate constants of the glued cycles, but without their limiting steps. Some of these parameters are rate constants of the initial network, other have the monomial structure. Other constants and corresponding reactions do not participate in the following operations. To form the structure of the dominant network, we need one more procedure. #### 5.3.2 Cycles Restoration and Cutting We start the reverse process from the glued network $\mathcal{V}^{m}$ on $\mathcal{A}^{m}$. On a step back, from the set $\mathcal{A}^{m}$ to $\mathcal{A}^{m-1}$ and so on, some of glued cycles should be restored and cut. On the $q$th step we build an acyclic reaction network on $\mathcal{A}^{m-q}$, the final network is defined on the initial vertex set and approximates relaxation of $\mathcal{W}$. To make one step back from $\mathcal{V}^{m}$ let us select the vertices of $\mathcal{A}^{m}$ that are glued cycles from $\mathcal{V}^{m-1}$. Let these vertices be $A^{m}_{1},A^{m}_{2},...$. Each $A^{m}_{i}$ corresponds to a glued cycle from $\mathcal{V}^{m-1}$, $A^{m-1}_{i1}\to A^{m-1}_{i2}\to...A^{m-1}_{i\tau_{i}}\to A^{m-1}_{i1}$, of the length $\tau_{i}$. We assume that the limiting steps in these cycles are $A^{m-1}_{i\tau_{i}}\to A^{m-1}_{i1}$. Let us substitute each vertex $A^{m}_{i}$ in $\mathcal{V}^{m}$ by $\tau_{i}$ vertices $A^{m-1}_{i1},A^{m-1}_{i2},...A^{m-1}_{i\tau_{i}}$ and add to $\mathcal{V}^{m}$ reactions $A^{m-1}_{i1}\to A^{m-1}_{i2}\to...A^{m-1}_{i\tau_{i}}$ (that are the cycle reactions without the limiting step) with corresponding constants from $\mathcal{V}^{m-1}$. Figure 6: The main operation of the cycle surgery: on a step back we get a cycle $A_{1}\to...\to A_{\tau}\to A_{1}$ with the limiting step $A_{\tau}\to A_{1}$ and one outgoing reaction $A_{i}\to A_{j}$. We should delete the limiting step, reattach (“recharge”) the outgoing reaction $A_{i}\to A_{j}$ from $A_{i}$ to $A_{\tau}$ and change its rate constant $k$ to the rate constant $kk_{\lim}/k_{i}$. The new value of reaction rate constant is always smaller than the initial one: $kk_{\lim}/k_{i}<k$ if $k_{\lim}\neq k_{i}$. For this operation only one condition $k\ll k_{i}$ is necessary ($k$ should be small with respect to reaction $A_{i}\to A_{i+1}$ rate constant, and can exceed any other reaction rate constant). If there exists an outgoing reaction $A^{m}_{i}\to B$ in $\mathcal{V}^{m}$ then we substitute it by the reaction $A^{m-1}_{i\tau_{i}}\to B$ with the same constant, i.e. outgoing reactions $A^{m}_{i}\to...$ are reattached to the heads of the limiting steps (Fig. 6). Let us rearrange reactions from $\mathcal{V}^{m}$ of the form $B\to A^{m}_{i}$. These reactions have prototypes in $\mathcal{V}^{m-1}$ (before the last gluing). We simply restore these reactions. If there exists a reaction $A^{m}_{i}\to A^{m}_{j}$ then we find the prototype in $\mathcal{V}^{m-1}$, $A\to B$, and substitute the reaction by $A^{m-1}_{i\tau_{i}}\to B$ with the same constant, as for $A^{m}_{i}\to A^{m}_{j}$. After that step is performed, the vertices set is $\mathcal{A}^{m-1}$, but the reaction set differs from the reactions of the network $\mathcal{V}^{m-1}$: the limiting steps of cycles are excluded and the outgoing reactions of glued cycles are included (reattached to the heads of the limiting steps). To make the next step, we select vertices of $\mathcal{A}^{m-1}$ that are glued cycles from $\mathcal{V}^{m-2}$, substitute these vertices by vertices of cycles, delete the limiting steps, attach outgoing reactions to the heads of the limiting steps, and for incoming reactions restore their prototypes from $\mathcal{V}^{m-2}$, and so on. After all, we restore all the glued cycles, and construct an acyclic reaction network on the set $\mathcal{A}$. This acyclic network approximates relaxation of the network $\mathcal{W}$. We call this system the dominant system of $\mathcal{W}$ and use notation ${\rm dom\,mod}(\mathcal{W})$. In the simplest case, the dominant system is determined by the ordering of constants. But for sufficiently complex systems we need to introduce auxiliary elementary reactions. They appear after cycle gluing and have monomial rate constants of the form $k_{\varsigma}=\prod_{i}k_{i}^{\varsigma_{i}}$, where ${\varsigma_{i}}$ are integers, but not mandatory positive. The dominant system depends on the place of these monomial values among the ordered constants. For systems with well separated constants we can also assume that each of these new constants will be well separated from other constants (Gorban & Radulescu (2008)). ### 5.4 Example To demonstrate a possible branching of described algorithm for cycles surgery (gluing, restoring and cutting) with necessity of additional orderings, let us consider the following system: $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3},\;\;A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!5}}\,\,A_{2},\;\;$ (31) (where the upper index marks the order of rate constants). The auxiliary discrete dynamical system for reaction network (31) is $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}.$ It has only one attractor, a cycle $A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}$. This cycle is not a sink for the whole network (31) because reaction $A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!5}}\,\,A_{2}$ leads from that cycle. After gluing the cycle into a vertex $A^{1}_{3}$ we get the new network $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$. The rate constant for the reaction $A^{1}_{3}{\rightarrow}A_{2}$ is $k^{1}_{23}=k_{24}k_{35}/k_{54}$, where $k_{ij}$ is the rate constant for the reaction $A_{j}\to A_{i}$ in the initial network ($k_{35}$ is the cycle limiting reaction). The new network coincides with its auxiliary system and has one cycle, $A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$. This cycle is a sink, hence, we can start the back process of cycles restoring and cutting. One question arises immediately: which constant is smaller, $k_{32}$ or $k^{1}_{23}$. The smallest of them is the limiting constant, and the answer depends on this choice. Let us consider two possibilities separately: (1) $k_{32}>k^{1}_{23}$ and (2) $k_{32}<k^{1}_{23}$. (1) Let as assume that $k_{32}>k^{1}_{23}$. The final auxiliary system after gluing cycles is $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$. Let us delete the limiting reaction $A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$ from the cycle. We get an acyclic system $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}$. The component $A^{1}_{3}$ is the glued cycle $A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}$. Let us restore this cycle and delete the limiting reaction $A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}$. We get the dominant system $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}$. Relaxation of this system approximates relaxation of the initial network (31) under additional condition $k_{32}>k^{1}_{23}$. (2) Let as assume now that $k_{32}<k^{1}_{23}$. The final auxiliary system after gluing cycles is the same, $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$, but the limiting step in the cycle is different, $A_{2}{\rightarrow^{\\!\\!\\!\\!\\!\\!6}}\,\,A^{1}_{3}$. After cutting this step, we get acyclic system $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}{\leftarrow^{\\!\\!\\!\\!?}}\,A^{1}_{3}$, where the last reaction has rate constant $k^{1}_{23}$. The component $A^{1}_{3}$ is the glued cycle $A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}\,.$ Let us restore this cycle and delete the limiting reaction $A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{3}$. The connection from glued cycle $A^{1}_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$ with constant $k^{1}_{23}$ transforms into connection $A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}$ with the same constant $k^{1}_{23}$. We get the dominant system: $A_{1}{\rightarrow^{\\!\\!\\!\\!\\!\\!1}}\,\,A_{2}\,,\;A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!?}}\,\,A_{2}\,.$ The order of constants is now known: $k_{21}>k_{43}>k_{54}>k^{1}_{23}$, and we can substitute the sign “?” by “4”: $A_{3}{\rightarrow^{\\!\\!\\!\\!\\!\\!2}}\,\,A_{4}{\rightarrow^{\\!\\!\\!\\!\\!\\!3}}\,\,A_{5}{\rightarrow^{\\!\\!\\!\\!\\!\\!4}}\,\,A_{2}$. For both cases, $k_{32}>k^{1}_{23}$ ($k^{1}_{23}=k_{24}k_{35}/k_{54}$) and $k_{32}<k^{1}_{23}$ it is easy to find the eigenvectors explicitly and to write the solution to the kinetic equations in explicit form. ## 6 The Reversible Triangle of Reactions In this section, we illustrate the analysis of dominant systems on a simple example, the reversible triangle of reactions. $A_{1}\leftrightarrow A_{2}\leftrightarrow A_{3}\leftrightarrow A_{1}\,$ (32) This triangle appeared in many works as an ideal object for a case study. Our favorite example is the work of Wei & Prater (1962). Now in our study the triangle (32) is not necessarily a closed system. We can assume that it is a subsystem of a larger system, and any reaction $A_{i}\to A_{j}$ represents a reaction of the form $\ldots+A_{i}\to A_{j}+\ldots$, where unknown but slow components are substituted by dots. This means that there are no mandatory relations between reaction rate constants, and six reaction rate constants are arbitrary nonnegative numbers. Let the reaction rate constant $k_{21}$ for the reaction $A_{1}\to A_{2}$ be the largest. Figure 7: Four possible auxiliary dynamical systems for the reversible triangle of reactions with $k_{21}>k_{ij}$ for $(i,j)\neq(2,1)$: (a) $k_{12}>k_{32}$, $k_{23}>k_{13}$; (b) $k_{12}>k_{32}$, $k_{13}>k_{23}$; (c) $k_{32}>k_{12}$, $k_{23}>k_{13}$; (d) $k_{32}>k_{12}$, $k_{13}>k_{23}$. For each vertex the outgoing reaction with the largest rate constant is represented by the solid bold arrow, and other reactions are represented by the dashed arrows. The digraphs formed by solid bold arrows are the auxiliary discrete dynamical systems. Attractors of these systems are isolated in frames. Let us describe all possible auxiliary dynamical systems for the triangle (32). For each vertex, we have to select the fastest outgoing reaction. For $A_{1}$, it is always $A_{1}\to A_{2}$, because of our choice of enumeration (the higher scheme in Fig. 7). There exist two choices of the fastest outgoing reaction for two other vertices and, therefore, only four versions of auxiliary dynamical systems for (32) (Fig. 7). Let us analyze in detail case (a). For the cases (b) and (c) the details of computations are similar. The irreversible cycle (d) is even simpler and was already discussed. ### 6.1 Auxiliary System (a): $A_{1}\leftrightarrow A_{2}\leftarrow A_{3}$; $k_{12}>k_{32}$, $k_{23}>k_{13}$ #### 6.1.1 Gluing Cycles The attractor is a cycle (with only two vertices) $A_{1}\leftrightarrow A_{2}$. This is not a sink, because two outgoing reactions exist: $A_{1}\to A_{3}$ and $A_{2}\to A_{3}$. They are relatively slow: $k_{31}\ll k_{21}$ and $k_{32}\ll k_{12}$. The limiting step in this cycle is $A_{2}\to A_{1}$ with the rate constant $k_{12}$. We have to glue the cycle $A_{1}\leftrightarrow A_{2}$ into one new component $A_{1}^{1}$ and to add a new reaction $A_{1}^{1}\rightarrow A_{3}$ with the rate constant (see Fig. 5) $k_{31}^{1}=\max\\{k_{32},\,k_{31}k_{12}/k_{21}\\}\,.$ (33) As a result, we get a new system, $A_{1}^{1}\leftrightarrow A_{3}$ with reaction rate constants $k_{31}^{1}$ (for $A_{1}^{1}\rightarrow A_{3}$) and initial $k_{23}$ (for $A_{1}^{1}\leftarrow A_{3}$). This cycle is a sink, because it has no outgoing reactions (the whole system is a trivial example of a sink). #### 6.1.2 Dominant System At the next step, we have to restore and cut the cycles. First cycle to cut is the result of cycle gluing, $A_{1}^{1}\leftrightarrow A_{3}$. It is necessary to delete the limiting step, i.e. the reaction with the smallest rate constant. If $k_{31}^{1}>k_{23}$, then we get $A_{1}^{1}\rightarrow A_{3}$. If, inverse, $k_{23}>k_{31}^{1}$, then we obtain $A_{1}^{1}\leftarrow A_{3}$. After that, we have to restore and cut the cycle which was glued into the vertex $A_{1}^{1}$. This is the two-vertices cycle $A_{1}\leftrightarrow A_{2}$. The limiting step for this cycle is $A_{1}\leftarrow A_{2}$, because $k_{21}\gg k_{12}$. If $k_{31}^{1}>k_{23}$, then following the rule visualized by Fig. 6, we get the dominant system $A_{1}\to A_{2}\to A_{3}$ with reaction rate constants $k_{21}$ for $A_{1}\to A_{2}$ and $k_{31}^{1}$ for $A_{2}\to A_{3}$. If $k_{23}>k_{31}^{1}$ then we obtain $A_{1}\to A_{2}\leftarrow A_{3}$ with reaction rate constants $k_{21}$ for $A_{1}\to A_{2}$ and $k_{23}$ for $A_{2}\leftarrow A_{3}$. All the procedure is illustrated by Fig. 8. Figure 8: Dominant systems for case (a) (defined in Fig. 7) #### 6.1.3 Eigenvalues and Eigenvectors The eigenvalues and the corresponding eigenvectors for dominant systems in case (a) are represented below in zero-one asymptotic. 1. 1. $k_{31}^{1}>k_{23}$, the dominant system $A_{1}\to A_{2}\to A_{3}$, $\begin{array}[]{lll}\lambda_{0}=0\,,&r^{0}\approx(0,0,1)\,,&l^{0}=(1,1,1)\,;\\\ \lambda_{1}\approx-k_{21}\,,&r^{1}\approx(1,-1,0)\,,&l^{1}\approx(1,0,0)\,;\\\ \lambda_{2}\approx- k_{31}^{1}\,,&r^{2}\approx(0,1,-1)\,,&l^{2}\approx(1,1,0)\,;\end{array}$ (34) 2. 2. $k_{23}>k_{31}^{1}$, the dominant system $A_{1}\to A_{2}\leftarrow A_{3}$, $\begin{array}[]{lll}\lambda_{0}=0\,,&r^{0}\approx(0,1,0)\,,&l^{0}=(1,1,1)\,;\\\ \lambda_{1}\approx-k_{21}\,,&r^{1}\approx(1,-1,0)\,,&l^{1}\approx(1,0,0)\,;\\\ \lambda_{2}\approx- k_{23}\,,&r^{2}\approx(0,-1,1)\,,&l^{2}\approx(0,0,1)\,.\end{array}$ (35) Here, the value of $k_{31}^{1}$ is given by formula (33). Analysis of examples provided us by an important conclusion: the number of different dominant systems in examples was less than the number of all possible orderings. For many pairs of constants $k_{ij},k_{lr}$ it is not important which of them is larger. There is no need to consider all orderings of monomials. We have to consider only those inequalities between constants and monomials that appear in the construction of the dominant systems. ## 7 Corrections to Dominant Dynamics The hierarchy of systems $\mathcal{W}$, $\mathcal{W}^{1}$, $\mathcal{W}^{2}$, … can be used for multigrid correction of the dominant dynamics. The simple example of multigrid approach gives the algorithm of steady state approximation (Gorban & Radulescu (2008)). For this purpose, on the way up (cycle restoration and cutting, Sec. 5.3.2) we calculate distribution in restoring cycles with higher accuracy, by exact formula (13), or in linear approximation (15) instead of the simplest zero-one asymptotic (16). Essentially, the way up remains the same. After termination of the gluing process, we can find all steady state distributions by restoring cycles in the auxiliary reaction network $\mathcal{V}^{m}$. Let $A^{m}_{f1},A^{m}_{f2},...$ be fixed points of $\Phi^{m}$. The set of steady states for $\mathcal{V}^{m}$ is the set of all distributions on the set of fixed points $\\{A^{m}_{f1},A^{m}_{f2},...\\}$. Let us take one of the basis distributions, $c^{m}_{fi}=1$, other $c_{i}=0$ on $\mathcal{V}^{m}$. If the vertex $A^{m}_{fi}$ is a glued cycle, then we substitute them by all the vertices of this cycle. Redistribute the concentration $c^{m}_{fi}$ between the vertices of the corresponding cycle by the rule (13) (or by an approximation). As a result, we get a set of vertices and a distribution on this set of vertices. If among these vertices there are glued cycles, then we repeat the procedure of cycle restoration. Terminate when there is no glued cycles in the support of the distribution. The resulting distribution is the approximation to a steady state of $\mathcal{W}$, and the basis of steady states for $\mathcal{W}$ can be approximated by this method. For example, for the system Fig. 8 we have, first of all, to compute the stationary distribution in the cycle $A_{1}^{1}\leftrightarrow A_{3}$, $c^{1}_{1}$ and $c_{3}$. On the base of the general formula for a simple cycle (13) we obtain: $w=\frac{1}{\frac{1}{k_{31}^{1}}+\frac{1}{k_{23}}}\,,\;c^{1}_{1}=\frac{w}{k_{31}^{1}}\,,\;c_{3}=\frac{w}{k_{23}}\,.$ (36) After that, we have to restore the cycle glued into $A_{1}^{1}$. This means to calculate the concentrations of $A_{1}$ and $A_{2}$ with normalization $c_{1}+c_{2}=c^{1}_{1}$. Formula (13) gives: $w^{\prime}=\frac{c^{1}_{1}}{\frac{1}{k_{21}}+\frac{1}{k_{12}}}\,,\;c_{1}=\frac{w^{\prime}}{k_{21}}\,,\;c_{2}=\frac{w^{\prime}}{k_{12}}\,.$ (37) For eigenvectors, there appear two operations of corrections: (i) correction for an acyclic network without branching (43), (45), and (ii) corrections for a cycle with relatively slow outgoing reactions (49). These corrections are by-products of the accuracy estimates given in Appendix. ## 8 Conclusion Now, the idea of limiting step is developed to the asymptotology of multiscale reaction networks. We found the main terms of eigenvectors and eigenvalues asymptotic on logarithmic straight lines $\ln k_{ij}=\theta_{ij}\xi$ when $\xi\to\infty$. These main terms could be represented by acyclic dominant system which is a piecewise constant function of the direction vectors $(\theta_{ij})$. This theory gives the analogue of the Vishik & Ljusternik (1960) theory for chemical reaction networks. We demonstrated also how to construct the accuracy estimates and the first order corrections to eigenvalues and eigenvectors. There are several ways of using the developed theory and algorithms: * • For direct computation of steady states and relaxation dynamics; this may be useful for complex systems because of the simplicity of the algorithm and resulting formulas and because often we do not know the rate constants for complex networks, and kinetics that is ruled by orderings rather than by exact values of rate constants may be very useful in practically frequent situation when the values of the various reaction constants are unknown or poorly known; * • For planning experiments and mining the experimental data – the observable kinetics is more sensitive to reactions from the dominant network, and much less sensitive to other reactions, the relaxation spectrum of the dominant network is explicitly connected with the correspondent reaction rate constants, and the eigenvectors (“modes”) are sensitive to the constant ordering, but not to exact values; * • The steady states and dynamics of the dominant system could serve as a robust first approximation in perturbation theory or as a preconditioning in numerical methods. The next step should be development of asymptotic estimates for networks with modular structure and time separations between modules, not between individual reactions. But now it seems that the most important further development should be the asymptotology of nonlinear reaction networks. For multiscale nonlinear reaction networks the expected dynamical behaviour is to be approximated by the system of dominant networks. These networks may change in time (this is the significant difference from the linear case) but remain relatively simple. ## References * Andrianov & Manevitch (2002) Andrianov, I.V. & Manevitch, L.I. (2002). Asymptotology: Ideas, Methods and Applications (Series: Mathematics and Its Applications, Vol. 551), Dordrecht–Boston–London: Springer. * Antoulas & Sorensen (2002) Antoulas, A.C. & Sorensen, D.C. (2002). The Sylvester equation and approximate balanced reduction, Linear Algebra and Its Applications, 351-352, 671–700. * Aris (1965) Aris, R. (1965). Introduction to the Analysis of Chemical Reactors, Englewood Cliffs, New Jersey: Prentice-Hall, Inc. * Balian, Alhassid & Reinhardt (1986) Balian, R., Alhassid, Y., & Reinhardt, H. (1986). Dissipation in many–body systems: A geometric approach based on information theory, Physics Reports 131 (1 ), 1–146. * Bodenstein (1913) Bodenstein, M. (1913). Eine Theorie der Photochemischen Reaktionsgeschwindigkeiten, Z . Phys. Chem. 85, 329–397. * Boyd (1978) Boyd, R. K. (1978). Some common oversimplifications in teaching chemical kinetics, J. Chem. Educ. 55, 84–89. * Brown & Cooper (1993) Brown, G. C., & Cooper, C. E. (1993). Control analysis applied to a single enzymes: can an isolated enzyme have a unique rate–limiting step? Biochem. J. 294, 87–94. * Bykov, Goldfarb, Gol’dshtein, & Maas, U. (2006) Bykov, V., Goldfarb, I., Gol’dshtein, V., Maas, U. (2006). On a Modified Version of ILDM Approach: Asymptotical Analysis Based on Integral Manifolds Method, IMA J. of Applied Mathematics 71 (3), 359–382. * Christiansen (1953) Christiansen, J.A. (1953). The Elucidation of Reaction Mechanisms by the Method of Intermediates in Quasi-Stationary Concentrations, Adv. Catal. 5, 311–353. * Condon & Ivanov (2004) Condon, M. & Ivanov, R. (2004). Empirical Balanced Truncation of Nonlinear Systems, J. Nonlinear Sci. 14, 405–414. * Cornish-Bowden & Cardenas (1990) Cornish-Bowden, A. & Cardenas, M. L. (1990). Control on Metabolic Processes, New York: Plenum Press. * Coxson & Bischoff (1987) Coxson, P.G.& Bischoff, K.B., (1987). Lumping strategy. 2. System theoretic approach, Ind. Eng. Chem. Res., 26 (10), 2151–2157. * Djouad & Sportisse (2002) Djouad, R. & Sportisse, B. (2002). Partitioning techniques and lumping computation for reducing chemical kinetics. APLA: An automatic partitioning and lumping algorithm, Applied Numerical Mathematics, 43 (4), 383–398. * Dobrushin (1956) Dobrushin, R.L. (1956). Central limit theorem for non-stationary Markov chains I, II, Theor. Prob. Appl. 1, 163–80, 329–383. * Dokoumetzidis & Aarons (2009) Dokoumetzidis, A. & Aarons, L. (2009). Proper lumping in systems biology models, IET Systems Biology, 3 (1), 40–51. * Farkas (1999) Farkas, G. (1999). Kinetic lumping schemes, Chem. Eng. Sci., 54 (17), 3909–3915. * Feinberg (1972) Feinberg, M. (1972). On chemical kinetics of a certain class, Arch. Rat. Mech. Anal. 46 (1), 1–41. * Feng, Hooshangi, Chen, Li, Weiss, & Rabitz (2004) Feng, X-J., Hooshangi, S., Chen, D., Li, G., Weiss, R., & Rabitz, H. (2004). Optimizing Genetic Circuits by Global Sensitivity Analysis, Biophys J. 87, 2195–2202. * Gibbs (1902) Gibbs, G.W. (1902). Elementary Principles in Statistical Mechanics, New Haven: Yale University Press. * Golub & Van Loan (1996) Golub, G.H. & Van Loan, C.F. (1996). Matrix Computations (3rd edition), Baltimore: The Johns Hopkins University Press. * Gorban (1984) Gorban, A. N. (1984). Equilibrium encircling. Equations of chemical kinetics and their thermodynamic analysis, Nauka, Novosibirsk. * Gorban, Bykov, & Yablonskii (1986) Gorban, A. N., Bykov, V. I., & Yablonskii, G. S. (1986). Thermodynamic function analogue for reactions proceeding without interaction of various substances, Chem. Eng. Sci. 41 (11), 2739–2745. * Gorban, Bykov & Yablonskii (1986) Gorban, A. N., Bykov, V. I., & Yablonskii G. S. (1986). Essays on chemical relaxation, Novosibirsk: Nauka. * Gorban & Karlin (2003) Gorban, A. N., & Karlin, I. V. (2003). Method of invariant manifold for chemical kinetics, Chem. Eng. Sci. 58, 4751–4768. * Gorban & Karlin (2005) Gorban, A. N., & Karlin, I. V. (2005). Invariant manifolds for physical and chemical kinetics, volume 660 of Lect. Notes Phys. Berlin–Heidelberg–New York: Springer. * Gorban, Karlin, Ilg, & Öttinger (2001) Gorban, A.N., Karlin, I.V., Ilg, P., & Öttinger, H.C. (2001). Corrections and enhancements of quasi–equilibrium states, J.Non–Newtonian Fluid Mech. 96 (2001), 203–219. * Gorban, Karlin, & Zinovyev (2004) Gorban, A.N., Karlin, I.V., Zinovyev, A.Yu. (2004). Invariant grids for reaction kinetics, Physica A 333 (2004), 106–154. Preprint online: http://www.ihes.fr/PREPRINTS/P03/Resu/resu-P03–42.html * Gorban & Radulescu (2008) Gorban, A. N. & Radulescu, O. (2008). Dynamic and static limitation in reaction networks, revisited, Advances in Chemical Engineering 34, 103-173; e-print: http://arxiv.org/abs/physics/0703278 * Greuel & Pfister (2002) Greuel, G.-M. & Pfister, G. (2002). A Singular Introduction to Commutative Algebra, Berlin–Heidelberg–New York: Springer. * Gugercin & Antoulas (2004) Gugercin, S. & Antoulas, A.C. (2004). A survey of model reduction by balanced truncation and some new results, Int. J. Control, 77 (8), 748–766. * Hangos, Bokor, & Szederkényi (2004) Hangos, K.M., Bokor, J., & Szederkényi G. (2004). Analysis and Control of Nonlinear Process Systems, London: Springer-Verlag. * Hangos & Cameron (2001) Hangos, K.M. & Cameron, I.T. (2001), Process Modelling and Model Analysis. London: Academic Press. * Helfferich (1989) Helfferich, F.G. (1989). Systematic approach to elucidation of multistep reaction networks, J. Phys. Chem. 93 (18), 6676–6681 * Hutchinson & Luss (1970) Hutchinson, P. & Luss, D. (1970), Lumping of mixtures with many parallel first order reactions: Chemical Engineering journal, 1, 129–135. * Jaynes (1963) Jaynes, E.T. (1963). Information theory and statistical mechanics, in: Statistical Physics. Brandeis Lectures, V.3, K. W. Ford, ed., New York: Benjamin, pp. 160–185. * Johnston (1966) Johnston, H. S. (1966). Gas phase reaction theory, New York: Roland Press. * Kazantzis & Kravaris (2006) Kazantzis, N. & Kravaris, C. (2006). A New Model Reduction Method for Nonlinear Dynamical Systems using Singular PDE Theory, In: Model Reduction and Coarse-Graining Approaches for Multiscale Phenomena, A.N. Gorban, N. Kazantzis, Y.G. Kevrekidis, H.C. Ottinger and C. Theodoropoulos (eds.), Springer, 3–15. * Klonowski (1983) Klonowski, W. (1983). Simplifying Principles for Chemical and Enzyme Reaction Kinetics, Biophys.Chem. 18, 73–87. * Kruskal (1963) Kruskal, M. D. (1963). Asymptotology, In: Mathematical Models in Physical Sciences, ed. by S. Dobrot, Prentice-Hall, New Jersey, Englewood Cliffs, 17–48. * Kuo & Wei (1969) Kuo, J. C. & Wei, J. (1969). A lumping analysis in monomolecular reaction systems. Analysis of the approximately lumpable system. Ind. Eng. Chem. Fundam. 8, 124–133. * Lam (1993) Lam, S. H. (1993). Using CSP to Understand Complex Chemical Kinetics, Combustion Science and Technology, 89 (5), 375–404. * Lall, Marsden & Glavaki (2002) Lall, S., Marsden, J.E., & Glavaki, S. (2002). A subspace approach to balanced truncation for model reduction of nonlinear control systems, Int. J. Robust Nonlinear Control 12 (6), 519–535. * Lam & Goussis (1994) Lam, S. H., & Goussis, D. A. (1994). The CSP Method for Simplifying Kinetics, International Journal of Chemical Kinetics 26, 461–486. * Li & Rabitz (1989) Li, G., & Rabitz, H. (1989). A general analysis of exact lumping in chemical kinetics. Chem. Eng. Sci. 44, 1413–1430. * Liao & Lightfoot (1988) Liao, J. C. & Lightfoot Jr. E. N. (1988). Lumping analysis of biochemical reaction systems with time scale separation, Biotechnology and Bioengineering 31, 869–879. * Lidskii (1965) Lidskii, V. (1965). Perturbation theory of non-conjugate operators. U.S.S.R. Comput. Math. and Math. Phys., 6, 73–85. * Lin, Leibovici & Jorgensen (2008) Lin, B., Leibovici, C.F., Jorgensen, S.B. (2008), Optimal component lumping: Problem formulation and solution techniques, Computers & Chemical Engineering, 32, 1167–1172. * Litvinov & Maslov (2005) Litvinov, G. L. & Maslov, V. P. (Eds.) (2005). Idempotent mathematics and mathematical physics, Contemporary Mathematics, Providence: AMS. * Maas, & Pope (1992) Maas, U., & Pope, S.B. (1992). Simplifying chemical kinetics: intrinsic low – dimensional manifolds in composition space, Combustion and Flame 88, 239–264. * Marcus & Minc (1992) Marcus, M. & Minc, H. (1992). A survey of matrix theory and matrix inequalities, New-York: Dover. * Maria (2006) Maria, G. (2006), Application of lumping analysis in modelling the living systems : A trade-off between simplicity and model quality, Chemical and Biochemical Engineering Quarterly, 20 (4), 353–373. * Meyn (2007) Meyn, S.R. (2007). Control Techniques for Complex Networks, Cambridge University Press, Cambridge. * Meyn & Tweedie (2009) Meyn, S.P. & Tweedie, R.L. (2009). Markov Chains and Stochastic Stability, 2nd Edition, Cambridge: Cambridge University Press. * Moore (1981) Moore, B.C. (1981) Principal component analysis in linear system: controllability, observability and model reduction. IEEE Transactions on Automatic Control, AC-26. * Northrop (1981) Northrop, D. B. (1981). Minimal kinetic mechanism and general equation for deiterium isotope effects on enzymic reactions: uncertainty in detecting a rate-limiting step, Biochemistry, 20, 4056–4061. * Northrop (2001) Northrop, D. B. (2001). Uses of isotope effects in the study of enzymes, Methods 24, 117–124. * Pepiot-Desjardins & Pitsch (2008) Pepiot-Desjardins, P., Pitsch, H. (2008). An automatic chemical lumping method for the reduction of large chemical kinetic mechanisms Combustion Theory and Modelling, 12 6, 1089–1108. * Prigogine & Defay (1954) Prigogine, I. & Defay, R. (1954). Chemical Thermodynamics London: Longmans. * Procaccia & Ross (1977) Procaccia, I. & Ross, J. (1977). Stability and relative stability in reactive systems far from equilibrium. I. Thermodynamic analysis J. Chem. Phys. 67, 5558–5564. * Radulescu, Gorban, Zinovyev & Lilienbaum (2008) Radulescu, O., Gorban, A., Zinovyev, A., & Lilienbaum, A. (2008). Robust simplifications of multiscale biochemical networks, BMC Systems Biology 2 (1), 86 http://www.biomedcentral.com/1752-0509/2/86 * Rate-controlling step (2007) Rate-controlling step (2007). In: IUPAC Compendium of Chemical Terminology, E-version, http://goldbook.iupac.org/R05139.html. * Ray (1983) Ray, W. J. (Jr.) (1983). A rate–limiting step: a quantitative definition. Application to steady–state enzymic reactions, Biochemistry, 22, 4625–4637. * Robbiano (1985) Robbiano, L. (1985). Term orderings on the polynomial ring, In: Proc. EUROCAL 85, vol. 2, ed. by B. F. Caviness, Lec. Notes in Computer Sciences 204, Berlin–Heidelberg–New York–Tokyo: Springer, 513–518. * Roussel & Fraser (1991) Roussel, M.R., & Fraser, S.J. (1991). On the geometry of transient relaxation. J. Chem. Phys. 94, 7106–7111. * Segel & Slemrod (1989) Segel, L.A., & Slemrod, M. (1989). The quasi-steady-state assumption: A case study in perturbation. SIAM Rev. 31, 446-477. * Semenov (1939) Semenov, N.N. (1939). On the Kinetics of Complex Reactions, J. Chem. Phys. 7, 683–699. * Seneta (1981) Seneta, E. (1981). Nonnegative Matrices and Markov Chains, Springer, New York. * Stueckelberg (1952) Stueckelberg, E.C.G. (1952). Theoreme $H$ et unitarite de $S$, Helv. Phys. Acta 25 (5), 577–580. * Temkin, Zeigarnik, & Bonchev (1996) Temkin, O.N., Zeigarnik, A.V., & Bonchev, D.G. (1996). Chemical Reaction Networks: A Graph-Theoretical Approach, Boca Raton, FL: CRC Press. * Toth, Li, Rabitz, & Tomlin (1997) Toth, J., Li, G., Rabitz, H., & Tomlin, A. S. (1997). The Effect of Lumping and Expanding on Kinetic Differential Equations, SIAM J. Appl. Math. 57, 1531–1556. * Turanyi, Tomlin, & Pilling (1993) Turanyi, T., Tomlin, A.S., & Pilling, M.J. (1993). On the error of the quasi-steady-state approximation, J. Phys. Chem. 97 (1), 163–172. * Van Mieghem (2006) Van Mieghem, P. (2006). Performance Analysis of Communications Networks and Systems, Cambridge University Press, Cambridge. * Varga (2004) Varga, R.S. (2004). Gerschgorin and His Circles, Springer series in computational Mathematics, 36, Berlin – Heidelberg – New York: Springer. * Vishik & Ljusternik (1960) Vishik, M. I., & Ljusternik, L. A. (1960). Solution of some perturbation problems in the case of matrices and self-adjoint or non-selfadjoint differential equations. I, Russian Math. Surveys, 15, 1–73. * Vora & Daoutidis (2001) Vora, N., & Daoutidis, P. (2001). Nonlinear Model Reduction of Chemical Reaction Systems AIChE Journal, 47 (10), 2320–2332. * Wei & Prater (1962) Wei, J., & Prater, C. (1962). The structure and analysis of complex reaction systems. Adv. Catalysis, 13, 203–393. * Wei & Kuo (1969) Wei, J., & Kuo, J. C. (1969). A lumping analysis in monomolecular reaction systems: Analysis of the exactly lumpable system, Ind. Eng. Chem. Fundam., 8, 114–123. * White (2006) White, R. B. (2006). Asymptotic Analysis of Differential Equations, London: Imperial College Press & World Scientific. * Whitehouse, Tomlin, & Pilling (2004) Whitehouse, L. E., Tomlin, A. S., & Pilling, M. J. (2004). Systematic reduction of complex tropospheric chemical mechanisms, Part II: Lumping using a time-scale based approach, Atmos. Chem. Phys., 4, 2057–2081. * Yablonskii, Bykov, Gorban, & Elokhin (1991) Yablonskii, G. S., Bykov, V. I., Gorban, A. N., & Elokhin, V. I. (1991). Kinetic models of catalytic reactions. Comprehensive Chemical Kinetics, Vol. 32, Compton R. G. ed., Amsterdam: Elsevier. * Yablonsky, Mareels, & Lazman (2003) Yablonsky, G.S., Mareels, I.M.Y., Lazman, M. (2003). The Principle of Critical Simplification in Chemical Kinetics, Chem. Eng. Sci. 58, 4833–4842. * Yablonsky, Olea, & Marin (2003) Yablonsky, G.S., Olea, M., & Marin, G.B. (2003). Temporal Analysis of Products (TAP): Basic Principles, Applications and Theory, Journal of Catalysis 216, 120–134. * Zagaris, Kaper, & Kaper (2004) Zagaris, A., Kaper, H.G., Kaper, T.J. (2004). Analysis of the computational singular perturbation reduction method for chemical kinetics, J. Nonlinear Sci. 14, 59–91. * Zavala & Rodriguez & Vargas-Villamil (2004) Zavala, C.D., Rodriguez, J.E.R., Vargas-Villamil, F.D. (2004), An algorithm for pseudocompound delumping and lumping into homologous groups, Petroleum Science and Technology, 22 (1-2), 45–60. * (85) ## Appendix: Mathematical Backgrounds of Accuracy Estimation ### Estimates for Perturbed Acyclic Networks The famous Gerschgorin theorem (Marcus & Minc (1992), Varga (2004)) gives estimates of eigenvalues. We need also estimates of eigenvectors. Below $A=(a_{ij})$ is a complex $n\times n$ matrix, $Q_{i}=\sum_{j,j\neq i}|a_{ji}|$ (sums of non-diagonal elements in columns). Gerschgorin theorem (Marcus & Minc (1992), p. 146): The characteristic roots of $A$ lie in the closed region $G^{Q}$ of the $z$-plane $G^{Q}=\bigcup_{i}G^{Q}_{i}\;\;(G^{Q}_{i}=\\{z\,\bigl{|}\,|z-a_{ii}|\leq Q_{i}\\}.$ (38) Areas $G^{Q}_{i}$ are the Gerschgorin discs. (The same estimate are valid for sums in rows, $P_{i}$. Here and below we don’t duplicate the estimates.) Gerschgorin disks $G^{Q}_{i}$ ($i=1,\ldots n$) are isolated, if $G^{Q}_{i}\cap G^{Q}_{j}=\varnothing$ for $i\neq j$. If disks $G^{P}_{i}$ ($i=1,\ldots n$) are isolated, then the spectrum of $A$ is simple, and each Gerschgorin disk $G^{Q}_{i}$ contains one and only one eigenvalue of $A$ (Marcus & Minc (1992), p. 147). We assume that Gerschgorin disks $G^{Q}_{i}$ ($i=1,\ldots n$) are isolated: for all $i,j$ ($i\neq j$) $|a_{ii}-a_{jj}|>Q_{i}+Q_{j}.$ (39) Let us introduce the following notations: $\begin{split}&\frac{Q_{i}}{|a_{ii}|}=\varepsilon_{i},\;\varepsilon=\max_{i}\varepsilon_{i},\;\frac{|a_{ij}|}{|a_{jj}|}=\chi_{ij},\;\chi=\max_{i,j,i\neq j}\chi_{ij},\\\ &g_{i}=\min_{j,j\neq i}\frac{|a_{ii}-a_{jj}|}{|a_{ii}|},\;g=\min_{i}g_{i}.\end{split}$ (40) Usually, we consider $\varepsilon_{i}$ and $\chi_{ij}$ as sufficiently small numbers. In contrary, the diagonal gap $g$ should not be small, (this is the gap condition). For example, if for any two diagonal elements $a_{ii}$, $a_{jj}$ either $a_{ii}\gg a_{jj}$ or $a_{ii}\ll a_{jj}$, then $g_{i}\gtrsim 1$ for all $i$. Let $\lambda_{i}\in G^{Q}_{i}$ be the eigenvalue of $A$ ($|\lambda_{i}-a_{11}|<Q_{1}$). Let us estimate the corresponding right eigenvector $r^{(i)}$. We take $r^{i}_{i}=1$ and for $j\neq i$ introduce a $(n-1)$-dimensional vector $\tilde{x}^{i}$: $\tilde{x}^{i}_{j}=r^{i}_{j}(a_{jj}-a_{ii})$ ($i\neq j$). For $\tilde{x}^{i}$ we get equation $(1-B^{(i)})\tilde{x}^{i}=-\tilde{a}^{i}$ (41) where $\tilde{a}^{i}$ is a vector of the non-diagonal elements of the $i$th column of $A$ ($\tilde{a}^{i}_{j}=a_{ij}$, $j\neq i$), and the $(n-1)\times(n-1)$ matrix $B^{i}$ has matrix elements ($j,l\neq i$) $b^{(i)}_{jj}=\frac{\lambda_{i}-a_{ii}}{a_{jj}-a_{ii}},\;\;b^{(i)}_{jl}=\frac{a_{jl}}{a_{ll}-a_{ii}}\;(l\neq j)$ (42) Due to the Gerschgorin estimate, $|b^{(i)}_{jj}|<\frac{Q_{i}}{|a_{jj}-a_{ii}|}$. From Eq. (41) we obtain: $\tilde{x}^{i}=-\tilde{a}^{i}-B^{(i)}(1-B^{(i)})^{-1}\tilde{a}^{i}.$ (43) From this definition and simple estimates in $l^{1}$ norm, we get the following estimate of eigenvectors. Theorem 2. Let the Gerschgoring disks be isolated, and the diagonal gap be big enough: $g>n\varepsilon$. Then for the $i$th eigenvector of $A$ the following uniform estimate holds: $|r^{i}_{j}|\leq\frac{\chi}{g}+\frac{n\varepsilon^{2}}{g(g-n\varepsilon)}\;\;(j\neq 1,\ r^{i}_{i}=1).\;\;\square$ (44) So, if the matrix $A$ is diagonally dominant and the diagonal gap $g$ is big enough, then the eigenvectors are proven to be close to the standard basis vectors with explicit evaluation of accuracy. The first correction to eigenvectors is also given by Eq. (43). If for the iteration we use the Gerschgorin estimates for eigenvalue $\lambda_{i}\approx a_{ii}$, then we can write in the next approximation for eigenvectors ($r^{i}_{i}=1,j\neq i$): $r^{i}_{j}=-\frac{a_{ji}}{a_{jj}-a_{ii}}-\frac{(B^{(i)}_{\rm nd}(1-B^{(i)}_{\rm nd})^{-1}\tilde{a}^{i})_{j}}{a_{jj}-a_{ii}}$ (45) where $B^{(i)}_{\rm nd}$ is the non-diagonal part of $B^{(i)}$: it has the same non-diagonal elements and zeros on diagonal. There exists plenty of further simplifications for this iteration formula. For example, one can leave just the first term, that gives the first order approximation in the power of $\varepsilon$ ($\chi\leq\varepsilon$). To apply these estimates to an acyclic network supplemented by additional reactions, we have to use the eigenbasis of this acyclic network (Sec. 4). Direct use of this theorem and estimates for a kinetic matrix $K$ in the standard basis is impossible, the diagonal dominance in this coordinate system is not large, and sums of elements in columns are zero. To apply this theorem we need two lemmas. Let $\mathcal{W}$ be a reaction network without branching (a finite dynamical system) with $n$ vertices. Then the number of reactions in $\mathcal{W}$ is $n-f$, where $f$ is the number of fixed points (the vertices without outgoing reactions). Let $\Gamma$ be the set of stoichiometric vectors for $\mathcal{W}$. Lemma 1. $\Gamma$ forms a basis in the subspace $\\{c\,|\,\sum_{i}c_{i}=0\\}$ if and only if the reaction network $\mathcal{W}$ is acyclic and connected (has only one fixed point). $\square$ Let us consider a general reaction network on the set $A_{1},...A_{n}$. For stoichiometric vector of reaction $A_{i}\to A_{l}$ we use notation $\gamma_{li}$. Assume that the auxiliary dynamical system $i\mapsto\phi(i)$ for a given reaction network is acyclic and has only one attractor, a fixed point. For this auxiliary network, we use notation: $\kappa_{i}=k_{ji}$ for the only reaction $A_{i}\to A_{j}$, or $\kappa_{i}=0$. For every reaction of the initial network, $A_{i}\to A_{l}$, a linear operators $Q_{il}$ can be defined by its action on the basis vectors, $\gamma_{\phi(i)\,i}$: $Q_{il}(\gamma_{\phi(i)\,i})=\gamma_{li},\;Q_{il}(\gamma_{\phi(p)\,p})=0\;\mbox{for}\;p\neq i.$ (46) Lemma 2. The kinetic equation for the whole reaction network (9) could be transformed to the form $\begin{split}\frac{{\mathrm{d}}c}{{\mathrm{d}}t}&=\sum_{i}\left(1+\sum_{l,\,l\neq\phi(i)}\frac{k_{li}}{\kappa_{i}}Q_{il}\right)\gamma_{\phi(i)\,i}\kappa_{i}c_{i}\\\ &=\left(1+\ \sum_{j,l\,(l\neq\phi(j))}\frac{k_{lj}}{\kappa_{j}}Q_{jl}\right)\sum_{i}\gamma_{\phi(i)\,i}\kappa_{i}c_{i}\\\ &=\left(1+\ \sum_{j,l\,(l\neq\phi(j))}\frac{k_{lj}}{\kappa_{j}}Q_{jl}\right)\tilde{K}c,\end{split}$ (47) where $\tilde{K}$ is kinetic matrix of the kinetic equation for the auxiliary network. $\square$ By construction of auxiliary dynamical system, ${k_{li}}<{\kappa_{i}}$ if ${l\neq\phi(i)}$, and for reaction networks with well separated constants ${k_{li}}\ll{\kappa_{i}}$. Notice also that the matrix $Q_{jl}$ does not depend on rate constants values. For matrix $\tilde{K}$ we have the eigenbasis in explicit form. Let us represent system (47) in this eigenbasis of $\tilde{K}$. Any matrix $B$ in this eigenbasis has the form $B=(\tilde{b}_{ij})$, $\tilde{b}_{ij}=l^{i}Br^{j}=\sum_{qs}l^{i}_{q}b_{qs}r^{j}_{s}$, where $(b_{qs})$ is matrix $B$ in the initial basis, $l^{i}$ and $r^{j}$ are left and right eigenvectors of $\tilde{K}$ (27), (28). In eigenbasis of $\tilde{K}$ the estimates of eigenvalues and estimates of eigenvectors are much more efficient than in original coordinates: the system is strongly diagonally dominant. Transformation to this basis is an effective preconditioning for the perturbation theory that uses auxiliary kinetics as a first approximation to the kinetics of the whole system. ### Estimates for Perturbed Ergodic Systems Let us consider a strongly connected network with kinetic matrix $K$. The corresponding kinetics is ergodic and there exists unique normalized steady state $c_{i}^{*}>0$, $\sum_{i}c_{i}^{*}=1$. For each $i$ we define $\kappa_{i}=\sum_{j}k_{ji}$. The number $-\kappa_{i}$ is the $ii$th diagonal element of unperturbed kinetic matrix $K$. Let this network be perturbed by outgoing reactions $A_{i}\to 0$. The perturbation has the “loss form”: the perturbed matrix is $K-{\rm diag}(\varepsilon_{i}\kappa_{i})$, perturbation of each diagonal element is relatively small (diag is the diagonal matrix). The perturbations $\varepsilon_{i}\kappa_{i}$ are relatively small with respect to $\kappa_{i}$, but not obligatory small with respect to other rate constants. First, we do not assume anything about value of $\varepsilon_{i}\geq 0$ and make the following transformation. For an arbitrary normalized vector $r$ ($r_{i}\geq 0$, $\sum_{i}r_{i}=1$) we add to the network reactions $A_{i}\to A_{j}$ with reaction rates $q_{ji}=r_{j}\varepsilon_{i}\kappa_{i}$. We use $Q(r)$ for the kinetic matrix of this additional network. Simple algebra gives $\begin{split}Q(r)+{\rm diag}(\varepsilon_{i}\kappa_{i})&=[\varepsilon_{1}\kappa_{1}r,\varepsilon_{2}\kappa_{2}r,...\varepsilon_{n}\kappa_{n}r]\\\ &=r(\varepsilon_{1}\kappa_{1},\varepsilon_{2}\kappa_{2},...\varepsilon_{n}\kappa_{n}).\end{split}$ (48) Here, in the right hand side we have a matrix, all columns of which are proportional to the vector $r$, this is a product of $r$ on the vector-raw of coefficients. We represent the perturbed matrix in the form $K-{\rm diag}(\varepsilon_{i}\kappa_{i})=K+Q(r)-(Q(r)+{\rm diag}(\varepsilon_{i}\kappa_{i}))$. Theorem 3. There exists such normalized positive $r^{*}$ that $(K+Q(r^{*}))r^{*}=0$. This $r^{*}$ is an eigenvector of the perturbed network with the eigenvalue $\lambda=\sum_{i}r^{*}_{i}\varepsilon_{i}\kappa_{i}$, and, at the same time, it is a steady-state for the network with kinetic matrix $K+Q(r^{*})$. To prove existence it is sufficient to mention, that for any $r$ the network with kinetic matrix $K+Q(r)$ has unique positive normalized steady state $c^{*}(r)$, which depends continuously on $r$. The map $r\mapsto c^{*}(r)$ has a fixed point $r^{*}$ (the Brouwer fixed point theorem). $\square$ This representation allows us to produce useful estimates, for example, when the unperturbed system is a cycle, we find $|r^{*}_{i}-c^{*}_{i}|<3\varepsilon|c^{*}_{i}|$ under condition $\varepsilon<0.25$, where $\varepsilon=\sum\varepsilon_{i}$. Formula for the first correction gives ($r^{*}=c^{*}_{i}+\delta r_{i}$, $w=k_{i}c^{*}_{i}$): $\begin{split}\delta r_{i}=\frac{v_{i}}{k_{i}},\;v_{i}=v+w\sum_{j=1}^{i}(\varepsilon c^{*}_{j}-\varepsilon_{j}),\\\ v=\frac{w}{n}\sum_{i=1}^{n}i(\varepsilon c^{*}_{i}-\varepsilon_{i}).\end{split}$ (49) For more complex networks, the explicit formulas for corrections could be produced on the base of the network graphs, similar to the steady-state formulas, presented, for example, by Yablonskii, Bykov, Gorban, & Elokhin (1991). So, the asymptotic analysis gives good approximation of eigenvectors and eigenvalues for kinetic matrix. The condition number is big (unbounded) but these estimates work even better when the constants become more separated. Nevertheless, some caution is needed: the error is proven to be small, but the residuals (the values $\|Kr-\lambda r\|$ for approximations of $r$ and $\lambda$) may be not small (Gorban & Radulescu (2008)).
arxiv-papers
2009-03-29T17:21:31
2024-09-04T02:49:01.484884
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "A. N. Gorban, O. Radulescu, A. Y. Zinovyev", "submitter": "Alexander Gorban", "url": "https://arxiv.org/abs/0903.5072" }
0903.5082
# Quantum Darwinism Wojciech Hubert Zurek Theory Division, MS B213, LANL Los Alamos, NM, 87545, U.S.A. ###### Abstract Quantum Darwinism describes the proliferation, in the environment, of multiple records of selected states of a quantum system. It explains how the fragility of a state of a single quantum system can lead to the classical robustness of states of their correlated multitude; shows how effective ‘wave-packet collapse’ arises as a result of proliferation throughout the environment of imprints of the states of quantum system; and provides a framework for the derivation of Born’s rule, which relates probability of detecting states to their amplitude. Taken together, these three advances mark considerable progress towards settling the quantum measurement problem. The quantum principle of superposition implies that any combination of quantum states is also a legal state. This seems to be in conflict with everyday reality: States we encounter are localized. Classical objects can be either here or there, but never both here and there. Yet, the principle of superposition says that localization should be a rare exception and not a rule for quantum systems. Fragility of states is the second problem with quantum-classical correspondence: Upon measurement, a general preexisting quantum state is erased – it “collapses” into an eigenstate of the measured observable. How is it then possible that objects we deal with can be safely observed, even though their basic building blocks are quantum? To bypass these obstacles Bohr 11 followed Alexander the Great’s example: Rather than try disentangling the Gordian Knot at the beginning of his conquest, he cut it. The cut separates the quantum from the classical. Bohr’s Universe consists of two realms, each governed by its own laws. Fragile superpositions were banished from the classical realm deemed more fundamental and indispensable to interpret or even practice quantum theory. Thus, instead of trying to understand Universe (including “the classical”) in quantum terms one “quantized” this and that, always starting from the classical base. This was a brilliant tactical move: Physicists could conquer the quantum realm without getting distracted by interpretational worries. In those days only gedankenexperiments like the famous Schrödinger cat 47 were truly disturbing: Real experiments dealt with electrons, photons, atoms, or other microscopic systems. Bohr’s rule of thumb – that the macroscopic is classical – was enough. Moreover, many (including Einstein) believed that quantum physics is just a step on a way to a deeper theory that will solve or bypass interpretational conundrums. That did not happen. Instead, old gedankenexperiments were carried out. They confirmed validity of quantum laws on scales that have, of recent, begun to infringe on “the macroscopic”. Quantum theory is here to stay. It is also increasingly clear that its weirdest predictions – superpositions and entanglement – are experimental facts, in principle relevant also for macroscopic objects. Therefore, questions about the origin of “the classical”, with its restriction to localized states that are robust, unperturbed by measurements, can no longer be dismissed. ## I Decoherence and einselection Decoherence turns one of the two problems we noted above – fragility of quantum states – into a solution of the other. Environment-induced decoherence recognizes that if a measurement can put a state at risk and re-prepare it, so can accidental information transfers that happen whenever a system interacts with its environment. Decoherence is by now well understood 36 ; 75 ; 52 : Fragility of states makes quantum systems very difficult to isolate. Transfer of information (which has no effect on classical states) has dramatic consequences in the quantum realm. So, while fundamental problems of classical physics were always solved in isolation (it sufficed to prevent energy loss) this is not so in quantum physics (leaks of information are much harder to plug). When a quantum system gives up information, its own state becomes consistent with the information that was disseminated. “Collapse” in measurements is an extreme example, but any interaction that leads to a correlation can contribute to such re-preparation: Interactions that depend on a certain observable correlate it with the environment, so its eigenstates are singled out, and phase relations between such pointer states are lost 69 . Negative selection due to decoherence is the essence of environment-induced superselection, or einselection 70 : Under scrutiny of the environment, only pointer states remain unchanged. Other states decohere into mixtures of stable pointer states that can persist, and, in this sense, exist: They are einselected. These ideas can be made precise. The basic tool is the reduced density matrix $\rho_{{\mathcal{S}}}$. It represents the state of the system that obtains from the composite state ${\Psi_{{\mathcal{S}}{\mathcal{E}}}}$ of ${\mathcal{S}}$ and ${\mathcal{E}}$ by tracing out the environment ${\mathcal{E}}$: $\rho_{\mathcal{S}}=Tr_{{\mathcal{E}}}|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle\\!\langle\Psi_{{\mathcal{S}}{\mathcal{E}}}|\ .$ $None$ Evolution of $\rho_{\mathcal{S}}$ reveals preferred states: It is most predictable when the system starts in a pointer state. To quantify this one can use (von Neumann) entropy, $H_{{\mathcal{S}}}=H(\rho_{\mathcal{S}})=-Tr\rho_{\mathcal{S}}\lg\rho_{\mathcal{S}}$, as a function of time. Pointer states result in smallest entropy increase. By contrast, their superpositions produce entropy rapidly, at decoherence rates, especially when ${\mathcal{S}}$ is macroscopic. When pure states of the system are sorted by predictability, according to entropy of the evolved $\rho_{\mathcal{S}}$, pointer states are at the top. This criterion – the predictability sieve 75 ; 45 ; 80 – yields a short list of candidates for effectively classical states: A cat can persist in one of the two obvious stable states, but their superposition would deteriorate into a mixture of $|\tt dead\rangle$ and $|\tt alive\rangle$ when initiated in a way envisaged by Schrödinger 47 . The special role of position is traced to the nature of the ${\mathcal{S}}{\mathcal{E}}$ interactions: They tend to depend on distance. Hence, information about position is most readily passed on to the environment. This is why localized states survive while nonlocal superpositions decay into their mixtures. For example, in a weakly damped harmonic oscillator the minimum uncertainty wavepackets – familiar coherent states, best quantum approximation of classical points in phase space – are einselected 80 ; 30 ; 55 . ## II Environment as a witness Monitoring by the environment means that information about ${\mathcal{S}}$ is deposited in ${\mathcal{E}}$. What role does it play, and what is its fate? Decoherence theory ignores it. Environment is “traced out”. Information it contains is treated as inaccessible and irrelevant: ${\mathcal{E}}$ is a “rug to sweep under” the data that might endanger classicality. Quantum Darwinism recognizes that “tracing out” is not what we do: Observers eavesdrop on the environment. Vast majority of our data comes from fragments of ${\mathcal{E}}$. Environment is a witness to the state of the system. For example, this very moment you intercept a fraction of the photon environment emitted by a screen or scattered by a page. We never access all of ${\mathcal{E}}$. Tiny fractions suffice to reveal the state of various “systems of interest”. This insight captures the essence of Quantum Darwinism: Only states that produce multiple informational offspring – multiple imprints on the environment – can be found out from small fragments of ${\mathcal{E}}$. The origin of the emergent classicality is then not just survival of the fittest states (the idea already captured by einselection), but their ability to “procreate”, to deposit multiple records – copies of themselves – throughout ${\mathcal{E}}$. --- Figure 1: _Quantum Darwinism and the structure of the environment_. Decoherence theory distinguishes between a system ($\mathcal{S}$) and its environment ($\mathcal{E}$) as in (a), but makes no further recognition of the structure of ${\mathcal{E}}$; it could as well be monolithic. In Quantum Darwinism the focus is on redundancy. We recognize the subdivision of $\mathcal{E}$ into subsystems, as in (b). The only requirement for a subsystem is that it should be individually accessible to measurements; observables of different subsystems commute. To obtain information about ${\mathcal{S}}$ from ${\mathcal{E}}$ one can then measure _fragments_ ${\mathcal{F}}$ of the environment – non-overlapping collections of subsystems of ${\mathcal{E}}$, (c). ically, there are many copies of the information about ${\mathcal{S}}$ in ${\mathcal{E}}$ – “progeny” of the “fittest observable” that survived monitoring by ${\mathcal{E}}$ proliferates throughout ${\mathcal{E}}$. This proliferation of the multiple informational offspring defines Quantum Darwinism. The environment becomes a witness with redundant copies of information about the preferred observable. This leads to the objective existence of pointer states: Many can find out the state of the system independently, without prior information, and they can do it indirectly, without perturbing ${\mathcal{S}}$. Proliferation of records allows information about ${\mathcal{S}}$ to be extracted from many fragments of ${\mathcal{E}}$ (in the example above, photon ${\mathcal{E}}$). Thus, ${\mathcal{E}}$ acquires redundant records of ${\mathcal{S}}$. Now, many observers can find out the state of ${\mathcal{S}}$ independently, and without perturbing it. This is how preferred states of ${\mathcal{S}}$ become objective. Objective existence – hallmark of classicality – emerges from the quantum substrate as a consequence of redundancy. Decoherence theory was focused on the system. Its aim was to determine what states survive information leaks to ${\mathcal{E}}$. Now we ask: What information about the system can be found out from fragments of ${\mathcal{E}}$? This change of focus calls for a more realistic model of the environment (Fig. 1): Instead of a monolithic ${\mathcal{E}}$ we recognize that environments consist of subsystems that comprise fragments independently accessible to observers. The reduced density matrix $\rho_{\mathcal{S}}$ representing the state of the system was the basic tool of decoherence. To study Quantum Darwinism we focus on correlations between fragments of the environment and the system. The relevant reduced density matrix $\rho_{{\mathcal{S}}{\mathcal{F}}}$ is given by: $\rho_{{\mathcal{S}}{\mathcal{F}}}=Tr_{{\mathcal{E}}/{\mathcal{F}}}|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle\\!\langle\Psi_{{\mathcal{S}}{\mathcal{E}}}|\ .$ $None$ Above, trace is over “${\mathcal{E}}$ less ${\mathcal{F}}$”, or ${{\mathcal{E}}/{\mathcal{F}}}$ – all of ${\mathcal{E}}$ except for the fragment ${\mathcal{F}}$. How much ${\mathcal{F}}$ knows about ${\mathcal{S}}$ can be quantified using mutual information: $I({\mathcal{S}}:{\mathcal{F}})=H_{{\mathcal{S}}}+H_{{\mathcal{F}}}-H_{{\mathcal{S}},{\mathcal{F}}}\ ,$ $None$ defined as the difference between entropies of two systems (here ${\mathcal{S}}$ and ${\mathcal{F}}$) treated separately and jointly. For example, the mutual information between an original and a perfect copy (of, say, a book) is equal to the entropy of the original, as either contains the same text. So, every bit of information in the first copy reveals a bit of information in the original. However, having extra copies does not increase the information about the original. Yet, it determines how many can independently access this information. The number of copies defines redundancy. --- Figure 2: _Information about ${\mathcal{S}}$ stored in ${\mathcal{E}}$ and its redundancy_. Mutual information is monotonic in $f$. When global state of ${\mathcal{S}}{\mathcal{E}}$ is pure, $I({\mathcal{S}}:{\mathcal{F}}_{f})$ in a typical fraction $f$ of the environment is antisymmetric around $f=0.5$ 8 . For pure states picked out at random from the combined Hilbert space ${\mathcal{H}}_{{\mathcal{S}}{\mathcal{E}}}$, there is little mutual information between ${\mathcal{S}}$ and a typical ${\mathcal{F}}$ smaller than half of ${\mathcal{E}}$. However, once a threshold $f=\frac{1}{2}$ is attained, nearly all information is in principle at hand. Thus, such random states (green line) exhibit no redundancy. By contrast, states of ${\mathcal{S}}{\mathcal{E}}$ created by decoherence (where the environment monitors preferred observable of ${\mathcal{S}}$) contain almost all (all but $\delta$) of the information about ${\mathcal{S}}$ in small fractions $f_{\delta}$ of ${\mathcal{E}}$. The corresponding $I({\mathcal{S}}:{\mathcal{F}}_{f})$ (red line) quickly rises to $H_{\mathcal{S}}$ (entropy of ${\mathcal{S}}$ due to decoherence), which is all of the information about ${\mathcal{S}}$ available from either ${\mathcal{E}}$ or ${\mathcal{S}}$. (More, up to $2H_{\mathcal{S}}$, can be obtained only through global measurements on ${\mathcal{S}}$ and nearly all ${\mathcal{E}}$). $H_{\mathcal{S}}$ is therefore the _classically accessible information_. As $(1-\delta)H_{\mathcal{S}}$ of information is contained in $f_{\delta}=1/R_{\delta}$ of ${\mathcal{E}}$, there are $R_{\delta}$ such fragments in ${\mathcal{E}}$: $R_{\delta}$ is the redundancy of the information about ${\mathcal{S}}$. Large redundancy implies objectivity: The state of the system can be found out indirectly and independently by many observers, who will agree about their conclusions. Thus, _Quantum Darwinism accounts for the emergence of objective existence_. Similar ideas apply to the quantum case. Initially, every bit of information gained from a fraction $f\ll 1$ of ${\mathcal{E}}$ that was pure before it monitored (and decohered) the system is a bit about ${\mathcal{S}}$. The red plot in Fig. 2 starts with this steep “bit for bit” slope, but moderates as $I({\mathcal{S}}:{\mathcal{F}}_{f})$ approaches redundancy plateau at $H_{{\mathcal{S}}}$, where additional bits only confirm what is already known. Redundancy is the number of independent fragments of the environment that supply almost all classical information about ${\mathcal{S}}$, i.e., $(1-\delta)H_{\mathcal{S}}$. In other words; $R_{\delta}=1/f_{\delta}\ .$ $None$ $R_{\delta}$ is the number of times one can acquire $(1-\delta)$ of the information about ${\mathcal{S}}$ independently (from distinct ${\mathcal{F}}$’s) and indirectly – without perturbing ${\mathcal{S}}$. Rapid rise and gradual leveling of $I({\mathcal{S}}:{\mathcal{F}}_{f})$, Fig. 2, implies redundancy. The information in ${\mathcal{F}}_{f}$ allows one to determine the state of ${\mathcal{S}}$ as it reaches redundancy plateau. Observables of different ${\mathcal{F}}$’s commute – such measurements are independent. Yet, underlying correlations mean that their outcomes imply the same state of the system, as if ${\mathcal{S}}$ were classical: The redundancy plateau is a classical plateau. Its level $H_{{\mathcal{S}}}$ is the classical information accessible from a small fraction of ${\mathcal{E}}$. Redundancy allows for objective existence of the state of ${\mathcal{S}}$: It can be found out indirectly, so there is no danger of perturbing ${\mathcal{S}}$ with a measurement. Error correction allowed by redundancy is also important: Fragility of quantum states means that copies in ${\mathcal{F}}$’s are damaged by measurements (we destroy photons!), and may be measured in a “wrong” basis. One cannot access records in ${\mathcal{E}}$ without endangering their existence. But with many ($R_{\delta}$) copies, state of ${\mathcal{S}}$ can be found out by $\sim R_{\delta}$ observers who can get their information independently, and without prior knowledge about ${\mathcal{S}}$. Consensus between copies suggests objective existence of the state of ${\mathcal{S}}$. The mutual information $I({\mathcal{S}}:{\mathcal{F}}_{f})$ computed in models of decoherence exhibits behavior illustrated by the red plot of Fig. 2. In the family of models representing spin ${\mathcal{S}}$ surrounded by environments of many spins 42 ; 8 ; 9 the same number of spins suffices to reach the plateau: Adding more spins to ${\mathcal{E}}$ only extends length of the plateau measured in “absolute units” – in the number of the environment spins. In this model (that can be viewed as a simplified model of a photon environment) redundancy is then proportional to the number of the environment subsystems that interact with the system of interest. Quantum Brownian motion – harmonic oscillator surrounded by many environmental oscillators – is the other well known model of decoherence. It is exactly solvable, and the case of an underdamped oscillator yields surprisingly simple results 10 ; PR : (i) Mutual information is approximately given by $I({\mathcal{S}}:{\mathcal{F}})\approx H_{{\mathcal{S}}}+\frac{1}{2}\ln{\frac{f}{(1-f)}}$, and; (ii) Redundancy for an initially squeezed state of ${\mathcal{S}}$ reaches $R_{\delta}\approx s^{2\delta}$, where $s$, the squeeze factor, quantifies delocalization of the state. Similar equation should hold for more general “Schrödinger cat” states, with $s$ quantifying the separation of the two localized alternatives. These results confirm intuitions that originally motivated Quantum Darwinism 75 ; Z2000 : Monitoring of the system by the environment can deposit multiple records of preferred states of ${\mathcal{S}}$ in ${\mathcal{E}}$. States of ${\mathcal{S}}{\mathcal{E}}$ that arise from decoherence are special 8 ; 9 , as $I({\mathcal{S}}:{\mathcal{F}}_{f})$ for a typical pure state selected with Haar measure in the whole Hilbert space of ${\mathcal{S}}{\mathcal{E}}$ (green plot in Fig. 2) shows. In such random states small fragments reveal almost nothing about the rest of the state. Only when half of ${\mathcal{E}}$ is found out the whole state is suddenly revealed. States that arise from decoherence are then far from random. Roughly speaking, they have a branch structure. This is why the rest of such a branch including the state of the system – the “bud” from which this branch has originated – can be deduced from its fragment. We shall see how such branches grow in the next section. Plots of $I({\mathcal{S}}:{\mathcal{F}}_{f})$ for pure ${\mathcal{S}}{\mathcal{E}}$ are antisymmetric around the point $\\{H_{{\mathcal{S}}},f=\frac{1}{2}\\}$ for typical fragments of ${\mathcal{E}}$ 8 . Thus, rapid rise for small $f$ must be matched at the other end, for $f\sim 1$. This is a signature of entanglement that allows state to be known “as the whole”, while states of subsystems are unknown. The joint state of ${\mathcal{S}}{\mathcal{E}}$ is then pure, so that $H_{{\mathcal{S}},{\mathcal{F}}={\mathcal{E}}}=0$, and $I({\mathcal{S}}:{\mathcal{F}}_{f})$ must rise to $H_{{\mathcal{S}}}+H_{{\mathcal{E}}}=2H_{{\mathcal{S}}}$ when $f$ approaches 1. This is a very quantum aspect of information. In classical physics knowing a composite object implies knowing each of its subsystems. This is not so in quantum physics, where composite states are given by tensor (rather than Cartesian) products of their constituents. Thus, one can know perfectly quantum state of the whole, but know nothing about states of parts. We shall see in Section IV how this feature can be used to derive Born’s rule 12 that relates probabilities with wavefunctions. To reveal this latent quantumness one would have to measure the right global observable on all of ${\mathcal{S}}{\mathcal{E}}$. For example, when mutual information, Eq. (3), is defined using Shannon entropy with probabilities corresponding to optimal observables in ${\mathcal{S}}$ and in ${\mathcal{E}}$, the resulting Shannon $I({\mathcal{S}}:{\mathcal{F}}_{f})$ graph for small $f$ would look very similar to Fig. 2. However, using Shannon entropy involves local probabilities (precluding global observables), so such Shannon $I({\mathcal{S}}:{\mathcal{F}}_{f})$ never exceeds $H_{{\mathcal{S}}}$, antisymmetry is lost, and the plateau continues until the end at $f\sim 1$. Effective unattainability of the $f\sim 1$ part of the plot also shows why decoherence is so hard to undo: Correlations that reveal coherence can be usually detected only by such global measurements of whole ${\mathcal{S}}{\mathcal{E}}$. We intercept small fractions of ${\mathcal{E}}$, and never have the luxury of perfect global measurements needed to undo decoherence. Yet, because of redundancy, we get $\sim H_{{\mathcal{S}}}$ information with “sloppy” measurements of $f\ll 1$. Quantum Darwinism does not require pure ${\mathcal{E}}$. Mixed environment is a noisy communication channel: Its initial entropy of $h$ per bit can still increase after interaction with ${\mathcal{S}}$, reflecting mutual information buildup. However, now a bit gained from ${\mathcal{E}}$ yields only $1-h$ of a bit about ${\mathcal{S}}$. So, a completely mixed ${\mathcal{E}}$ ($h=1$) is useless (even though it can still induce decoherence!). For a partly mixed ${\mathcal{E}}$ mutual information will increase more slowly, pure case “bit per bit” rate tempered to $\sim 1-h$. Yet, it can still climb the same redundancy plateau at $H_{{\mathcal{S}}}$ QZZ . These conclusions apply when ${\mathcal{E}}$ is initially mixed, but are also relevant when this channel is noisy for other reasons (e.g., imperfect measurements). In all such cases one can still reach the same redundancy plateau, although now a proportionally larger fragment of the environment is needed to get the same information about ${\mathcal{S}}$. Suitability of the environment as a channel depends on whether it provides a direct and easy access to the records of the system. This depends on the structure and evolution of ${\mathcal{E}}$. Photons are ideal in this respect: They interact with various systems, but, in effect, do not interact with each other. This is why light delivers most of our information. Moreover, photons emitted by the usual sources (e.g., sun) are far from equilibrium with our surroundings. Thus, even when decoherence is dominated by other environments (e.g., air) photons are much better in passing on information they acquire while “monitoring the system of interest”: Air molecules scatter from one another, so that whatever record they may have gathered becomes effectively undecipherable. Stability of the level of the redundancy plateau at $H_{{\mathcal{S}}}$, even for mixed ${\mathcal{E}}$’s, is a compelling reason to think of it as “classical”. The question we shall now address concerns the nature of that information – what does the environment know about the system, and why? ## III From Copying to Quantum Jumps Quantum Darwinism leads to appearance, in the environment, of multiple copies of the state of the system. However, the no-cloning theorem 24 ; 65 prohibits copying of unknown quantum states. If cloning is outlawed, how can redundancy seen in Fig. 2 be possible? Figure 3: Quantum Darwinism in a simple model of decoherence 42 . The spin-$\frac{1}{2}$ ${\mathcal{S}}$ interacts with $N=50$ spin-$\frac{1}{2}$ subsystems of ${\mathcal{E}}$ with an Ising Hamiltonian ${\bf H_{{\mathcal{S}}{\mathcal{E}}}}=\sum_{k=1}^{N}g_{k}\sigma_{z}^{{\mathcal{S}}}\otimes\sigma_{y}^{{\mathcal{E}}_{k}}$. The initial state of $\mathcal{S}\otimes{\mathcal{E}}$ is $\frac{1}{\sqrt{2}}(|0\rangle+|1\rangle)\otimes|0\rangle^{{\mathcal{E}}_{1}}\otimes\ldots\otimes|0\rangle^{{\mathcal{E}}_{N}}$. Couplings $g_{k}$ are distributed randomly in the interval (0,1]. All the plotted quantities are a function of the observable $\sigma(\mu)=\cos(\mu)\sigma_{z}+\sin(\mu)\sigma_{x}$, where $\mu$ is the angle between its eigenstates and the pointer states of ${\mathcal{S}}$ – eigenstates of $\sigma_{z}^{\mathcal{S}}$. a) Information acquired by the optimal measurement on the whole environment, $\hat{I}_{N}(\sigma)$, as a function of the inferred observable $\sigma(\mu)$ and the average interaction action $\langle g_{k}t\rangle=a$. A lot of information is accessible in the whole ${\mathcal{E}}$ about any observable $\sigma(\mu)$ except when $a$ is so small that there was no decoherence. b) Redundancy of the information about ${\mathcal{S}}$ as a function of the inferred observable $\sigma(\mu)$ and the average action $\langle g_{k}t\rangle=a$. $R_{\delta=0.1}(\sigma)$ counts the number of times 90% of the total information can be “read off” independently by measuring distinct fragments of ${\mathcal{E}}$. It is sharply peaked around the pointer observable: Redundancy is a very selective criterion – the number of copies of relevant information is high only for the observables $\sigma(\mu)$ inside the theoretical bound (see Ref.42 ) indicated by the dashed line. c) Information about $\sigma(\mu)$ extracted by local random measurements on $m$ environmental subsystems. Because of redundancy, pointer states – and only pointer states – can be found out through this far-from- optimal strategy. Information about any other observable $\sigma(\mu)$ is restricted to what can be inferred from the pointer observable 42 . Quick answer is that cloning refers to (unknown) quantum states. So, copying of observables evades the theorem. Nevertheless, the tension between the prohibition on cloning and the need for copying is revealing: It leads to breaking of unitary symmetry implied by the superposition principle, accounts for quantum jumps, and suggests origin of the “wavepacket collapse”, setting stage for the study of quantum origins of probability in Section IV. Quantum physics is based on several “textbook” postulates 23 . The first two; (i) States are represented by vectors in Hilbert space, and; (ii) Evolutions are unitary – give complete account of mathematics of quantum theory, but make no connection with physics. For that one needs to relate calculations made possible by the superposition principle of (i) and unitarity of (ii) to experiments. Postulate (iii) Immediate repetition of a measurement yields the same outcome starts this task. This is the only uncontroversial measurement postulate (even if it is difficult to approximate in the laboratory): Such repeatability or predictability is behind the very idea of “a state”. In contrast to (i)-(iii), collapse postulate (iv) Outcomes correspond to eigenstates of the measured observable, and only one of them is detected in any given run of the experiment, is inconsistent with (i) and (ii). Conflict arises for two reasons: Restriction to a preferred set of outcome states seems at odds with with the egalitarian principle of superposition, embodied in (i). This restriction prevents one from finding out unknown quantum states, so it is responsible for their fragility. And a single outcome per run is at odds with unitarity (and, hence, linearity) of quantum dynamics that preserves superpositions. The last axiom; (v) Probability of an outcome is given by the square of the associated amplitude, $p_{k}=|\psi_{k}|^{2}$, is known as Born’s rule 12 . It completes the relation between mathematics of (i) and (ii) and the experiments. Bohr bypassed conflict of (i) and (ii) with (iv) by insisting that apparatus is classical, so unitarity and the principle of superposition need not apply to measurements. But this is an excuse, not an explanation. We are dealing with a quantum environment, and redundancy of previous section strengthened motivation for postulate (iii) – repeatability. Let us see where this demand takes us in a purely quantum setting of postulates (i), (ii), and (iii). Suppose there are states of ${\mathcal{S}}$ (say, $|u\rangle$ and $|v\rangle$) that produce an imprint in a subsystem of ${\mathcal{E}}$ (which plays a role of an apparatus), but remain unperturbed (so they can produce more imprints). This repeatability implies: $|u\rangle|e_{0}\rangle\Rightarrow|u\rangle|e_{u}\rangle$, $|v\rangle|e_{0}\rangle\Rightarrow|v\rangle|e_{v}\rangle$ in obvious notation. In a unitary process scalar product is preserved. Thus; $\langle u|v\rangle=\langle u|v\rangle\langle e_{u}|e_{v}\rangle\ ,$ $None$ where we have set $\langle e_{0}|e_{0}\rangle=1$. This simple equation can be satisfied only when; (a) either $\langle e_{u}|e_{v}\rangle=1$ (which means that copying was completely unsuccessful), or; (b) $\langle u|v\rangle=0$, i.e., they are orthogonal. In that case $\langle e_{u}|e_{v}\rangle$ is arbitrary – perfect record $\langle e_{u}|e_{v}\rangle=0$ is also possible. It follows that multiple (perfect or imperfect) copies of $|u\rangle$ and $|v\rangle$ can be imprinted in disjoint ${\mathcal{F}}$’s. As a consequence of unitarity, only sets of orthogonal states (that define Hermitean observables 23 ) can be so copied, explaining selection of a set of outcomes – terminal points of quantum jumps 79 . Before, they had to be postulated by the first part of axiom (iv). We emphasize that this result relies on just two values of the scalar product – 0 and 1 – and, thus, does not appeal to Born’s rule. This breaking of unitary symmetry (choice of preferred states in an egalitarian Hilbert space) is induced by repeatability of the information transfer. It is a “nonlinear demand”: As in cloning, one asks for “two (or more) of the same”. Its conflict with linearity of quantum theory can be resolved only by restricting states that can be copied. Such pointer states then act as “buds” of branches that grow by reproducing, in ${\mathcal{E}}$, multiple copies of the original in ${\mathcal{S}}$. Interaction Hamiltonians do not perturb observables that commute with them. So, buds of branches coincide with the einselected pointer states. Evidence of such symmetry breaking is seen in Fig. 3. Mutual information and redundancy shown there are obtained using Eq. (3), but with Shannon (rather than von Neumann) entropies of specific observables of ${\mathcal{S}}$ and ${\mathcal{F}}$, i.e., using probabilities of their eigenstates. While von Neumann-based $I({\mathcal{S}}:{\mathcal{F}}_{f})$ and $R_{\delta}$ characterized total information, Shannon-based counterparts are well suited to enquire: What observable is this information about? It turns out that the environment as a whole “knows” many observables of ${\mathcal{S}}$, as is seen in Fig. 3a. By contrast, in Fig. 3b symmetry breaking is evident: The ridge of redundancy appears abruptly only when test observable $\sigma(\mu)$ and the preferred pointer observable $\sigma_{z}$ (that remains unperturbed by the environment) nearly coincide. Why are pointer states favored? Commonsense says that, to be reproduced, state must survive copying. This leads to a theorem 42 ; 43 that only pointer states can be discovered from fractions of ${\mathcal{E}}$. Other observables (such as $\sigma(\mu)$ in Fig. 3) can be deduced only to the extent they are correlated with the pointer observable. So, fragments of the environment offer a very narrow, projective point of view. Redundant imprinting of some observables happens at the expense of their complements. Structure of branching state betrays its origin and foreshadows “collapse”. Starting from $|\psi_{{\mathcal{S}}}\rangle=\sum_{k}^{n}\psi_{k}|s_{k}\rangle$, $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle=\sum_{k}^{n}\psi_{k}|s_{k}\rangle|e^{(1)}_{k}\rangle\dots|e^{({\mathcal{N}})}_{k}\rangle=\sum_{k}^{n}\psi_{k}|s_{k}\rangle|\varepsilon_{k}\rangle\ \ (6)$ branches grow to include $\cal N$ subsystems of ${\mathcal{E}}$. Branch fragments can be nearly orthogonal; $\Pi_{j=1}^{J}\langle e_{k}^{(j)}|e_{k^{\prime}}^{(j)}\rangle\simeq\delta_{kk^{\prime}}$ for large enough $J$. This means that a pointer state $|s_{k}\rangle$ of ${\mathcal{S}}$ can be determined (along with the rest of the branch) from a sufficiently long fragment (which may still be short compared to the length of the branch, $J\ll\cal N$). In the huge Hilbert space ${\mathcal{H}}_{{\mathcal{S}}{\mathcal{E}}}$ branching state is a very atypical minimally entangled superposition of only $n$ product “branches” labelled by the pointer states of the system. This is tiny compared to the dimension of ${\mathcal{H}}_{{\mathcal{S}}{\mathcal{E}}}$ that exceeds $n$ by a factor exponential in ${\mathcal{N}}$. This is why the two plots in Fig. 2 are so different: Branching state is, to a good approximation, a multi-system Schmidt decomposition, with long branch fragments constituting “systems”. In a Schmidt decomposition, states of partners are in one-to-one correspondence. Thus, in Eq. (6), $|s_{k}\rangle$ implies $|\varepsilon_{k}\rangle$ (and, vice versa), and measuring a branch fragment ${\mathcal{F}}$ can reveal the whole branch. Initial part of $I({\mathcal{S}}:{\mathcal{F}}_{f})$, Fig. 2, represent buildup of this correlation: When $f=0$, observer is ignorant of what branch he will find out, but the structure of the correlations within $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle$ leaves no doubt of what these branches are. Using Born’s rule one could assign to them probabilities $p_{k}=|\psi_{k}|^{2}$ and the corresponding entropy $H_{{\mathcal{S}}}$. Next section shows how one can deduce these probabilities without axiom (v) – how symmetries of entanglement imply Born’s rule. When observer measures enough of ${\mathcal{E}}$, he finds out the branch (and what the state of ${\mathcal{S}}$ is). Additional data are redundant. They only confirm what is already known. Probabilities associated with $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle$ are replaced with certainty of a branch. This transition from uncertainty (initial presence of many branches – potential for multiple outcomes) to certainty (once a sufficiently long branch fragment becomes known) accounts for perception of “collapse”. The initial, steeply rising, part of $I({\mathcal{S}}:{\mathcal{F}}_{f})$ “resolves” it: Collapse is brief compared to the ensuing period of certainty about the outcome, as $f_{\delta}\ll 1$, but, nevertheless, not instantaneous. Assumptions that lead from copying to preferred states can be relaxed. Thus, ${\mathcal{E}}$ need not be initially pure 79 . Moreover, it suffices that the records (e.g., in the apparatus ${\cal A}$) are “repeatably accessible”. Transfer of responsibility for repeatability from a quantum ${\mathcal{S}}$ to a (still quantum) ${\cal A}$ allows one to model non-orthogonal measurement outcomes (POVM’s): ${\cal A}$ entangles with the system, and then acts as ancilla. Its orthogonal pointer states $|A_{k}\rangle$ correlate with non- orthogonal $|\varsigma_{k}\rangle$ of ${{\mathcal{S}}}$, $\sum_{k}\tilde{\psi}_{k}|\varsigma_{k}\rangle|A_{k}\rangle$. Interaction of $\cal A$ with the environment results in multiple copies of $|A_{k}\rangle$. The usual projective measurement implementation of POVM’s (see e.g. NC ) is now straightforward. Branches are labelled by $|A_{k}\rangle$. Indeed, we usually experience “quantum jumps” via an apparatus pointer. Selection of the set of outcomes by the proliferation of information essential for Quantum Darwinism parallels Bohr’s insistence 11 that a “classical apparatus” should determine the outcomes. However, it follows from purely quantum Eq. (5), and is caused by a unitary evolution responsible for the information transfer. Nevertheless, as classical apparatus would, preferred pointer states designate possible future outcomes, precluding measurements of complementary observables or determining preexisting state of the system. Thus, information acquisition – a copying process – results in preferred states. Consensus between records deposited in fragments of ${\mathcal{E}}$ looks like “collapse”. In this sense we have accounted for postulate (iv) using only very quantum postulates (i)-(iii). In particular, in deriving and analyzing Eq. (5) we have not employed Born’s rule, axiom (v). We shall be therefore able to use our results as a starting point for such a derivation in the next section. There was nothing nonunitary above – unitarity was the crux of our argument, and orthogonality of branch seeds our main result. Relative states of Everett 25 ; 26 ; 22 come to mind. One could speculate about reality of branches with other outcomes. We abstain from this – our discussion is interpretation-free, and this is a virtue. Indeed, “reality” or “existence” of universal state vector seems problematic. Quantum states acquire objective existence when reproduced in many copies. Individual states – one might say with Bohr – are mostly information, too fragile for objective existence. And there is only one copy of the Universe. Treating its state as if it really existed 25 ; 26 ; 22 seems unwarranted and “classical”. ## IV Probabilities from Entanglement --- Figure 4: Probabilities and symmetry: (a) Laplace used subjective ignorance to define probability. Player who does not know face values of the cards, but knows that one of them is a spade will infer probability $p_{\spadesuit}={\frac{1}{2}}$ for the top card. (b) The real physical state of the system is however altered by the swap, illustrating subjective nature of Laplace’s approach, and demonstrating its unsuitability for physics. (c) Perfectly known entangled states have objective symmetries that allow one to rigorously deduce probabilities. When two systems are maximally entangled as above, probabilities of Schmidt partners are equal, $p_{\heartsuit}=p_{\diamondsuit}$, and $p_{\spadesuit}=p_{\clubsuit}$. After a swap $u_{{\mathcal{S}}}=|\spadesuit\rangle\langle\heartsuit|+|\heartsuit\rangle\langle\spadesuit|$ in ${\mathcal{S}}$, the resulting state $|\spadesuit\rangle|\diamondsuit\rangle+|\heartsuit\rangle|\clubsuit\rangle$ must have $p^{\prime}_{\spadesuit}=p_{\diamondsuit}$, and $p^{\prime}_{\heartsuit}=p_{\clubsuit}$. (We ‘primed’ probabilities in ${\mathcal{S}}$, as it was acted upon by a swap, so they might have changed.) A counterswap $u_{{\mathcal{E}}}=|\diamondsuit\rangle\\!\langle\clubsuit|+|\clubsuit\rangle\\!\langle\diamondsuit|$ in ${\mathcal{E}}$ restores the original entangled state, proving that $p^{\prime}_{\heartsuit}=p_{\heartsuit}$ and $p^{\prime}_{\spadesuit}=p_{\spadesuit}$, after all (as counterswap $u_{{\mathcal{E}}}$ leaves ${\mathcal{S}}$ untouched). This sequence of equalities implies $p_{\spadesuit}=p_{\diamondsuit}=p_{\heartsuit}$, so that $p_{\spadesuit}=p_{\heartsuit}=\frac{1}{2}$, as probabilities in ${\mathcal{S}}$ must add up to 1. Observer prepared ${\mathcal{S}}$ in a state $|{\psi}_{{\mathcal{S}}}\rangle$, but wants to measure observable with eigenstates $\\{|s_{k}\rangle\\}$. This will lead to entangled $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle$ with branch structure, Eq. (6). Pointer states $\\{|s_{k}\rangle\\}$ define the outcomes, but, as yet, observer has not measured ${\mathcal{E}}$, and does not know the result. Given $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle$, what is the probability of, say, $|s_{17}\rangle$? To derive it we cannot use reduced density matrices, Eqs. (1,2). Tracing out is averaging Landau ; 59 ; NC – it relies on $p_{k}=|\psi_{k}|^{2}$, Born’s rule we want to derive. We have imposed that ban while deriving and analyzing Eq. (5), but relaxed it to plot Fig. 3. Now we reimpose it again. So, Born’s rule and standard tools of decoherence are off limits – using them courts circularity. Our derivation will rest instead on certainty and symmetry, cornerstones that mark two extremal cases of probability. The case of certainty was just settled without Born’s rule using Eq. (5). When one re-measures an observable, the same outcome will be seen again. Thus, when $\\{|s_{k}\rangle\\}$ includes $|{\psi}_{{\mathcal{S}}}\rangle$ (e.g., $|{\psi}_{{\mathcal{S}}}\rangle=|s_{17}\rangle$), newly added copies just extend the branch already correlated with observer’s state, and the outcome is certain; $p_{17}=1$. Certainty of correlations between partners in Schmidt decomposition, Eq. (6) is another important example. Certainty seems trivial but is important. Confirmation that a state “is what it is” – postulate (iii) – is a part of standard quantum lore 23 . We re- affirmed it, but with a key insight: Redundancy allows observers to discover (and not just confirm) that ${\mathcal{S}}$ is in a certain pointer state. We now turn to the opposite case of complete indeterminacy. Its connection with symmetry was noted by Laplace. He wrote: “The theory of chance consists in reducing all the events … to a certain number of cases that are equally possible… The ratio of this number to that of all the cases possible is the measure of probability ” 40 . Figure 4 illustrates how this classical intuition yields – far more convincingly — quantum probabilities. Symmetry is probed by invariance. Transformations that respect it take system between states that exhibit no measurable differences. For example, change of phase in the coefficients in the Schmidt decomposition $|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle=\sum_{k}^{n}\psi_{k}|s_{k}\rangle|\varepsilon_{k}\rangle$ cannot influence the state of ${\mathcal{S}}$: It is induced by $u_{{\mathcal{S}}}=e^{i\phi_{k}}|s_{k}\rangle\\!\langle s_{k}|$, local unitary on ${\mathcal{S}}$, that can be “undone” by $u_{{\mathcal{E}}}=e^{-i\phi_{k}}|\varepsilon_{k}\rangle\\!\langle\varepsilon_{k}|$ on ${\mathcal{E}}$, or; $u_{{\mathcal{S}}}\otimes{\bf 1}_{{\mathcal{E}}}|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle=|\Phi_{{\mathcal{S}}{\mathcal{E}}}\rangle;\ {\bf 1}_{{\mathcal{S}}}\otimes u_{{\mathcal{E}}}|\Phi_{{\mathcal{S}}{\mathcal{E}}}\rangle=|\Psi_{{\mathcal{S}}{\mathcal{E}}}\rangle$ $None$ So, phases of $\psi_{k}$ cannot matter for a local state or influence probabilities in ${\mathcal{S}}$. This symmetry, Eq. (7), is the entanglement- assisted invariance or envariance 76 ; 78 . Such loss of phase significance for ${\mathcal{S}}$ entangled with ${\mathcal{E}}$ implies decoherence 78 . We arrived at its essence using envariance, without reduced density matrices, trace, etc. We now use phase envariance to show that equal absolute values of the coefficients $\psi_{k}$ imply equal probabilities. For equal $|\psi_{k}|$ any orthogonal basis of ${\mathcal{S}}$ is “Schmidt” (i.e., has an orthogonal partner in ${\mathcal{E}}$). Thus, $|\bar{\varphi}_{{\mathcal{S}}{\mathcal{E}}}\rangle=\frac{{|0\rangle}_{{\mathcal{S}}}{|0\rangle}_{{\mathcal{E}}}+{|1\rangle}_{{\mathcal{S}}}{|1\rangle}_{{\mathcal{E}}}}{\sqrt{2}}=\frac{{|+\rangle}_{{\mathcal{S}}}{|+\rangle}_{{\mathcal{E}}}+{|-\rangle}_{{\mathcal{S}}}{|-\rangle}_{{\mathcal{E}}}}{\sqrt{2}}$, where $|\pm\rangle=\frac{|0\rangle\pm|1\rangle}{\sqrt{2}}$. Sign change induced by $e^{i\pi}|-\rangle\\!\langle-|$ acting on ${\mathcal{S}}$ produces $|\bar{\eta}_{{\mathcal{S}}{\mathcal{E}}}\rangle=\frac{{|+\rangle}_{{\mathcal{S}}}{|+\rangle}_{{\mathcal{E}}}-{|-\rangle}_{{\mathcal{S}}}{|-\rangle}_{{\mathcal{E}}}}{\sqrt{2}}=\frac{{|1\rangle}_{{\mathcal{S}}}{|0\rangle}_{{\mathcal{E}}}+{|0\rangle}_{{\mathcal{S}}}{|1\rangle}_{{\mathcal{E}}}}{\sqrt{2}}$. In other words, one can swap ${|0\rangle}_{{\mathcal{S}}}$ with ${|1\rangle}_{{\mathcal{S}}}$ by rotating phase in a $|\pm\rangle$ basis by $\pi$. Yet, we just saw that phases of Schmidt coefficients do not matter for the state of ${\mathcal{S}}$, so probabilities of 0 and 1 in ${\mathcal{S}}$ must have remained the same. Moreover, probabilities of paired up Schmidt states are equal, so that $p_{{\mathcal{S}}}(0)=p_{{\mathcal{E}}}(0)$ in $|\bar{\varphi}_{{\mathcal{S}}{\mathcal{E}}}\rangle$ and $p_{{\mathcal{S}}}(1)=p_{{\mathcal{E}}}(0)$ in $|\bar{\eta}_{{\mathcal{S}}{\mathcal{E}}}\rangle$. Hence, $p_{{\mathcal{S}}}(0)=p_{{\mathcal{S}}}(1)=\frac{1}{2}$, where we assumed that probabilities add up to 1. In contrast to Laplace’s subjective “ignorance-based” approach, we obtained objective probabilities for a completely known entangled state. Phase envariance implied equiprobability in ${\mathcal{S}}$. To paraphrase Beatles, “All you need is phase…”. We rotated phases of the coefficients to induce a swap in a complementary basis. Another proof (that implements swap more directly) is given in Fig. 4. This equiprobability case is the difficult part of the proof. Instead of subjectivity (that undermined applicability of Laplace’s approach to physics) we relied on objective symmetries of entangled quantum states. This was made possible by the nature of quantum states of composite systems. Classically, pure states have structure of a Cartesian product – knowing the whole implies knowledge of each subsystem. In quantum theory they are tensor products – one can know state of the whole, and thus know nothing about parts, as envariance shows. This was the basis of our proof of equiprobability. We assumed unitarity. Moreover, we assumed; (1) When a system is not acted upon by a unitary transformation, its state remains unaffected. This state is a property of ${\mathcal{S}}$ alone, so; (2) Predictions regarding measurement outcomes on ${\mathcal{S}}$ (including their probabilities) can be inferred from the state of ${\mathcal{S}}$. Last not least; (3) When ${\mathcal{S}}$ is entangled with other systems (e.g., the environment) the state of ${\mathcal{S}}$ alone is determined by the state of the whole ${\mathcal{S}}{\mathcal{E}}$. These “facts of life” are accepted properties of systems and states, but given the fundamental nature of our discussion it seems a good idea to make them explicit 78 . For instance, to establish independence from phases of the coefficients $\psi_{k}$ we noted that the state of ${\mathcal{S}}$ is unaffected by the unitaries $u_{{\mathcal{S}}}$ diagonal in Schmidt basis acting on ${\mathcal{S}}$ (like changes of Schmidt coefficient phases) that would normally affect isolated ${\mathcal{S}}$: The global state $\Psi_{{\mathcal{S}}{\mathcal{E}}}$ is restored by $u_{{\mathcal{E}}}$. Thus, by fact (3), so is local state of ${\mathcal{S}}$. However, this is done by a unitary “countertransformation” acting solely on ${\mathcal{E}}$. Hence, by fact (1), state of ${\mathcal{S}}$ must have been unaffected by $u_{{\mathcal{S}}}$ in the first place. So, by fact (2), phases of $\psi_{k}$ cannot change outcomes of any measurement on ${\mathcal{S}}$. Equiprobability follows. One can now derive Born’s rule, $p_{k}=|\psi_{k}|^{2}$, with straightforward algebra from the above two simple cases of complete certainty ($p_{k}=1$) and equiprobability ($p_{k}=\frac{1}{n}$): The general case can be always reduced to the case case of equal coefficients by “finegraining” (see Box). The origin of probability is a fascinating problem that is older than quantum measurement problem, and is forgotten primarily because it is so old. We have seen how quantum physics sheds a new, very fundamental, light on probability. We cannot do justice to the history of this subject here, but Ref. Aul provides a basic overview and exhaustive set of references. In particular, envariant derivation is very different from the classic proof of Gleason Gle in that it sheds light on the physical significance of the resulting measure. Moreover, it does not assume probabilities are additive (except to posit that probability of an event and its complement are certain, i.e., to establish normalization; see Box and Ref. 78 ; Z07 ). Bypassing additivity of probabilities is essential when dealing with a theory with another principle of additivity – the quantum superposition principle – which trumps additivity of probabilities or at least classical intuitiions about it (e.g., in the double-slit experiment). Discussion of the implications of envariance has already started, with SF ; Bar , and 52 providing insightful commentary. BOX We show here how “finegraining” reduces the case of arbitrary $\psi_{k}$ to equiprobability. To illustrate general strategy consider state in a 2D Hilbert space ${\cal H}_{{\mathcal{S}}}$ of ${\mathcal{S}}$ spanned by orthonormal $\\{|0\rangle,|2\rangle\\}$ and (at least) 3D ${\cal H}_{{\mathcal{E}}}$: $\ \ \ \ \ \ |\psi_{\cal SE}\rangle\ \propto\ \sqrt{\frac{2}{3}}~{}|0\rangle_{{\mathcal{S}}}|+\rangle_{{\mathcal{E}}}\ \ +\ \ \sqrt{\frac{1}{3}}~{}|2\rangle_{{\mathcal{S}}}|2\rangle_{{\mathcal{E}}}\ .$ The state $|+\rangle_{{\mathcal{E}}}=\frac{|0\rangle_{{\mathcal{E}}}+|1\rangle_{{\mathcal{E}}}}{\sqrt{2}}$ exists in (at least 2D) subspace of ${\cal E}$ orthogonal to $|2\rangle_{{\mathcal{E}}}$, i.e., $\langle 0|1\rangle=\langle 0|2\rangle=\langle 1|2\rangle=\langle+|2\rangle=0$. We know we can ignore phases. To reduce $|\psi_{\cal SE}\rangle$ to equal coefficients case we “extend it” to a state $|\bar{\Psi}_{\cal SEC}\rangle$ by letting ${\mathcal{E}}$ act on an ancilla ${\cal C}$. (${\mathcal{S}}$ is not acted upon, so, by fact (1), probabilities for ${\mathcal{S}}$ cannot change.) This can be done by a generalization of controlled-not acting between ${\cal E}$ (control) and ${\cal C}$ (target), so that (in obvious notation) $|k\rangle|0^{\prime}\rangle\Rightarrow|k\rangle|k^{\prime}\rangle$, leading to $\sqrt{2}|0\rangle|+\rangle|0^{\prime}\rangle+|2\rangle|2\rangle|0^{\prime}\rangle\Rightarrow\sqrt{2}|0\rangle{{|0\rangle|0^{\prime}\rangle+|1\rangle|1^{\prime}\rangle}\over\sqrt{2}}+|2\rangle|2\rangle|2^{\prime}\rangle.$ Above, and from now on we skip subscripts: The state of ${\cal S}$ will be listed first, and the state of ${\cal C}$ will be primed. The cancellation of $\sqrt{2}$ yields an equal coefficient state: $|\bar{\Psi}_{\cal SCE}\rangle\propto|0,0^{\prime}\rangle|0\rangle+|0,1^{\prime}\rangle|1\rangle+|2,2^{\prime}\rangle|2\rangle\ .$ We have combined ${\mathcal{S}}$ and ${\cal C}$ in a single ket and (below) we shall swap states of ${\cal SC}$ as if it was a single system. Clearly, this is a Schmidt decomposition of (${\mathcal{S}}\cal C){\cal E}$. Three orthonormal product states have coefficients with the same absolute value. Therefore, they can be envariantly swapped. Thus, the probabilities of states $|0\rangle|0^{\prime}\rangle,\ |0\rangle|1^{\prime}\rangle,$ and $|2\rangle|2^{\prime}\rangle$ are all equal. By normalization they are $\frac{1}{3}$. So, probability of detecting state $|2\rangle$ of ${\mathcal{S}}$ is $\frac{1}{3}$. Moreover, $|0\rangle$ and $|2\rangle$ are the only two outcome states for ${\mathcal{S}}$. It follows that probability of $|0\rangle$ must be $\frac{2}{3}$; $\ \ \ \ \ \ \ \ \ \ \ \ \ \ \ \ \ \ \ p_{0}=\frac{2}{3};\ \ p_{2}=\frac{1}{3}\ .$ This is Born’s rule. We have just seen why the amplitudes in the initial $|\psi_{\cal SE}\rangle$ “get squared” to yield probabilities. Note that we have avoided assuming additivity of probabilities: $p_{0}=\frac{2}{3}$ not because it is a sum of two fine-grained alternatives for ${\mathcal{S}}{\mathcal{E}}$, each with probability of $\frac{1}{3}$, but rather because there are only two (mutually exclusive and exhaustive) alternatives for ${\mathcal{S}}$; $|0\rangle$ and $|2\rangle$, and $p_{2}=\frac{1}{3}$. Therefore, by normalization, $p_{0}=1-\frac{1}{3}$. Probabilities of Schmidt states can be added because of the loss of phase coherence that follows directly from phase envariance established earlier (see also Ref. 76 ; 78 ). Extension of this proof to the case where probabilities are commensurate is conceptually straightforward but notationally cumbersome. The case of non- commensurate probabilities is settled with an appeal to continuity. Frequency of the outcomes can be also deduced, allowing one to establish connection with the familiar relative frequency approach to probabilities 76 ; 78 ; Z07 , but in a quantum setting probability arises as a consequence of symmetries of a single entangled state. We end by noting that the finegraining discussed above does not need to be carried out experimentally each time probabilities are discussed: Rather, it is a way to deduce a measure that is consistent with the geometry of the Hilbert spaces using entanglement as a tool. Still, given fundamental implications of envariance experimental tests would be most useful. ## V Discussion We derived the two controversial quantum postulates from the first three. We have thus seen how classical domain of the Universe arises from the superposition principle (postulate (i)) and unitarity (postulate (ii)) as well as rudimentary assumptions about information flows (postulate (iii)), and a few basic facts about states of composite quantum systems (including their tensor nature, often cited as additional “axiom (0)”). The essence of the measurement problem – accounting for axioms (iv) and (v) – has been largely settled. It is of course likely one may be able to clarify assumptions and simplify proofs. Much work remains to be done on Quantum Darwinism and envariance. Nevertheless, nature of the quantum-classical correspondence has been clarified. Physicists take it for granted that even hard problems are solved by a single good idea. Therefore, when a single idea does not do the whole job, often our first instinct is to dismiss it. Measurement problem does not fall into this “single idea” category. Several ideas, applied in the right order, led to advances described here. Logically, we may well have started with the derivation of Eq. (5) and the analysis of quantum jumps. Their randomness leads to probabilities. And symmetries of entangled states (that arise in decoherence and Quantum Darwinism) allow one to derive Born’s rule. As we have seen, phase envariance is (nearly) “all you need”. With probabilities at hand one has then every right to use reduced density matrices to analyze Quantum Darwinism and decoherence. Our presentation was “historical”. We started with decoherence, and used it to introduce Quantum Darwinism. Analysis of copying essential to information flows in both of these phenomena led to quantum jumps. This in turn motivated entangelment-based derivation of Born’s rule. Quantum Darwinism – upgrade of ${\mathcal{E}}$ to a communication channel from a mundane role it played in decoherence – tied together all of the other developments. This order had the advantage of making motivations clear, but it is different from more logical presentation where postulates (i)-(iii) are the starting point (strategy followed in Z07 ). The collection of ideas discussed here allows one to understand how “the classical” emerges from the quantum substrate staring from more basic assumptions than decoherence. We have bypassed a related question of why is our Universe quantum to the core. The nature of quantum state vectors is a part of this larger mystery. Our focus was not on what quantum states are, but on what they do. Our results encourage a view one might describe (with apologies to Bohr) as “complementary”. Thus, $|\psi\rangle$ is in part information (as, indeed, Bohr thought), but also the obvious quantum object to explain “existence”. We have seen how Quantum Darwinism accounts for the transition from quantum fragility (of information) to the effectively classical robustness. One can think of this transition as “It from bit” of John Wheeler JAW . In the end one might ask: “How Darwinian is Quantum Darwinism?”. Clearly, there is survival of the fittest, and fitness is defined as in natural selection – through the ability to procreate. The no-cloning theorem implies competition for resources – space in ${\mathcal{E}}$ – so that only pointer states can multiply (at the expense of their complementary competition). There is also another aspect of this competition: Huge memory available in the Universe as a whole is nevertheless limited. So the question arises: What systems get to be “of interest”, and imprint their state on their obliging environments, and what are the environments? Moreover, as the Universe has a finite memory, old events will be eventually “overwritten” by new ones, so that some of the past will gradually cease to be reflected in the present record. And if there is no record of an event, has it really happened? These questions seem far more interesting than deciding closeness of the analogy with natural selection Darwin . They suggest one more question: Is Quantum Darwinism (a process of multiplication of information about certain favored states that seems to be a “fact of quantum life”) in some way behind the familiar natural selection? I cannot answer this question, but neither can I resist raising it. ## References * (1) Bohr, N. The quantum Postulate and the recent development of atomic theory Nature 121, 580-590 (1928). * (2) Schrödinger, E. Die gegenwärtige Situation in der Quantenmechanik. Naturwissenschaften 807-812; 823-828; 844-849 (1935). * (3) Joos, E., Zeh, H. D., Kiefer, C., Giulini, D., Kupsch, J., and Stamatescu, I.-O., Decoherence and the Appearancs of a Classical World in Quantum Theory, (Springer, Berlin, 2003). * (4) Zurek, W. H. Decoherence, einselection, and the quantum origins of the classical Rev. Mod. Phys. 75, 715-775 (2003). * (5) Schlosshauer, M. Decoherence and the Quantum - to - Classical Transition (Springer, Berlin, 2007). * (6) Zurek, W. H. Pointer basis of a quantum apparatus: Into what mixture does the wavepacket collapse? Phys. Rev. D24, 1516-1525 (1981). * (7) Zurek, W. H. Environment-induced superselection rules. Phys. Rev. D26, 1862-1880 (1982). * (8) Paz, J.-P., and Zurek, W. H., Environment-induced decoherence and the transition from quantum to classical. pp. 533-614 in Coherent Atomic Matter Waves, Les Houches Lectures, R. Kaiser, C. Westbrook, and F. David, eds. (Springer, Berlin, 2001). * (9) Zurek, W. H., Habib, S., and Paz, J.-P., Coherent states via decoherence Phys. Rev. Lett. 70, 1187-1190 (1993). * (10) Tegmark, M., and Shapiro, H. S., Decoherence produces coherent states: An explicit proof for harmonic chains. Phys. Rev. E50, 2538-2547 (1994). * (11) Gallis, M. R., The emergence of classicality via decoherence described by Lindblad operators. Phys. Rev. A53, 655 (1996). * (12) Ollivier, H., Poulin, D, and Zurek, W. H., Objective properties from subjective quantum states: Environment as a witness. Phys. Rev. Lett. 93, 220401 (2004). * (13) Blume-Kohout, R., and Zurek, W. H., A simple example of “Quantum Darwinism”: Redundant information storage in many-spin environments Found. Phys. 35, 1857 (2005). * (14) Blume-Kohout, R., and Zurek, W. H., Quantum Darwinism: Entanglement, branches, and the emergent classicality of redundantly stored quantum information. Phys. Rev. A73, 062310 (2006). * (15) Blume-Kohout, R., and Zurek, W. H., Quantum Darwinism in quantum Brownian motion. Phys. Rev. Lett., 101, 240405 (2008). * (16) J. P. Paz and A. Roncaglia, in preparation. * (17) Zurek, W. H., Einselection and decoherence from an information theory perspective. Ann. Physik (Leipzig), 9, 822 (2000). * (18) Born, M., Zur Quantenmechanik der Stossvorgänge Zeits. Phys. 37, 863-867 (1926). * (19) M. Zwolak, H. T. Quan, and W. H. Zurek, in preparation. * (20) Wootters, W. K., and Zurek, W. H., A single quantum cannot be cloned. Nature 299, 802-803 (1982). * (21) Dieks, D., Communication by EPR devices. Phys. Lett. 92A, 271 (1982). * (22) Dirac, P. A. M., Quantum Mechanics (Clarendon Press, Oxford, 1958). * (23) Zurek, W. H., Quantum origin of quantum jumps: Breaking of unitary symmetry induced by information transfer and the transition from quantum to classical. Phys. Rev. A 76, 052110 (2007). * (24) Ollivier, H., Poulin, D., and Zurek, W. H., Environment as a Witness: Selective Proliferation of Information and Emergence of Objectivity in a Quantum Universe Phys. Rev. A72, 423113 (2005). * (25) Nielsen, M. A., and I. L. Chuang, Quantum Computation and Quantum Information, (Cambridge University Press, 2000). * (26) Everett III, H., Relative state formulation of quantum theory. Rev. Mod. Phys. 29, 454-462 (1957). * (27) Everett III, H., 1957b, Ph. D. Dissertation, Princeton University. * (28) DeWitt, B. S., and Graham, N., eds., The Many - Worlds Interpretation of Quantum Mechanics (Princeton University Press, Princeton, 1973). * (29) Landau. L., Das Dämpfungsproblem in der Wellenmechanik. Zeits. Phys. 45, 430-441 (1927). * (30) von Neumann, J. 1932, Mathematical Foundations of Quantum Theory, translated from German original by R. T. Beyer (Princeton University Press, Princeton, 1955). * (31) Laplace, P. S,. 1820, A Philosophical Essay on Probabilities, English translation of the French original by F. W. Truscott and F. L. Emory (Dover, New York, 1951). * (32) Zurek, W. H., Environment-assisted invariance, causality, and probabilities in quantum physics. Phys. Rev. Lett. 90, 120404 (2003). * (33) Zurek, W. H., Probabilities from entanglement, Born’s rule from envariance. Phys. Rev. A71, 052105 (2005). * (34) Auletta, G., Foundations and Interpretation of Quantum Theory (World Scientific, Singapore, 2000). * (35) Gleason, A. M., Measures on closed subspaces of Hilbert space, J. Math. Mech. 6, 855-893 (1957). * (36) Schlosshauer, M, and Fine, A., On Zurek’s derivation of the Born rule. Found. Phys. 35(2), 197-213 (2005) * (37) Barnum, H., No-signalling-based version of Zurek’s derivation of quantum probabilities: A note on “Environment-assisted invariance, entanglement, and probabilities in quantum physics”, arXiv:quant-ph/0312150 (2003). * (38) Zurek, W. H., Relative States and the Environment: Einselection, Envariance, Quantum Darwinism, and the Existential Interpretation, arXiv:0707.2832 (2007). * (39) Wheeler, J. A., It from Bit. p. 3 in Complexity, Entropy, and the Physics of Information, Zurek, W. H., ed. (Addison Wesley, Redwood City, 1990). * (40) Darwin, C., The Origin of the Species. (1859). Acknowledgments: I am grateful to Robin Blume-Kohout, Fernando Cucchietti, Juan Pablo Paz, David Poulin, Hai-Tao Quan, Michael Zwolak for stimulating discussions. This research was supported by an LDRD grant at Los Alamos and, in part, by FQXi.
arxiv-papers
2009-03-29T19:08:30
2024-09-04T02:49:01.500354
{ "license": "Public Domain", "authors": "Wojciech Hubert Zurek", "submitter": "W. H. Zurek", "url": "https://arxiv.org/abs/0903.5082" }
0903.5115
# The average value inequality in sequential effect algebras††thanks: This project is supported by Natural Science Found of China (10771191 and 10471124). Shen Jun1,2, Wu Junde1 E-mail: wjd@zju.edu.cn ###### Abstract A sequential effect algebra $(E,0,1,\oplus,\circ)$ is an effect algebra on which a sequential product $\circ$ with certain physics properties is defined, in particular, sequential effect algebra is an important model for studying quantum measurement theory. In 2005, Gudder asked the following problem: If $a,b\in(E,0,1,\oplus,\circ)$ and $a\bot b$ and $a\circ b\bot a\circ b$, is it the case that $2(a\circ b)\leq a^{2}\oplus b^{2}$ ? In this paper, we construct an example to answer the problem negatively. 1Department of Mathematics, Zhejiang University, Hangzhou 310027, P. R. China 2Department of Mathematics, Anhui Normal University, Wuhu 241003, P. R. China Key Words. Effect algebras, Sequential effect algebras, Average value inequality. MR(2000) Subject Classification. 81P15 Effect algebra was introduced in 1994 to model the quantum logic which may be fuzzy or unsharp, to be precise, an effect algebra is a system $(E,0,1,\oplus)$, where 0 and 1 are distinct elements of $E$ and $\oplus$ is a partial binary operation on $E$ satisfying [1]: (EA1) If $a\oplus b$ is defined, then $b\oplus a$ is defined and $b\oplus a=a\oplus b$. (EA2) If $a\oplus(b\oplus c)$ is defined, then $(a\oplus b)\oplus c$ is defined and $(a\oplus b)\oplus c=a\oplus(b\oplus c).$ (EA3) For each $a\in E$, there exists a unique element $b\in E$ such that $a\oplus b=1$. (EA4) If $a\oplus 1$ is defined, then $a=0$. In an effect algebra $(E,0,1,\oplus)$, if $a\oplus b$ is defined, we write $a\bot b$. If $a\bot a$, we denote $a\oplus a$ by $2a$. For each $a\in(E,0,1,\oplus)$, it follows from (EA3) that there exists a unique element $b\in E$ such that $a\oplus b=1$, we denote $b$ by $a^{\prime}$. If $a\wedge a^{\prime}=0$, we say that $a$ is a sharp element of $(E,0,1,\oplus)$ (see [2]). Let $a,b\in(E,0,1,\oplus)$, if there exists a $c\in E$ such that $a\bot c$ and $a\oplus c=b$, then we say that $a\leq b$. It follows from [1] that $\leq$ is a partial order of $(E,0,1,\oplus)$ and satisfies that for each $a\in E$, $0\leq a\leq 1$, $a\bot b$ iff $a\leq b^{\prime}$. In 2001, in order to study quantum measurement theory, Gudder began to consider the sequential product of two measurements $A$ and $B$ (see [3]). In 2002, Professors Gudder and Greechie introduced the abstract sequential effect algebra structure, that is: A sequential effect algebra is an effect algebra $(E,0,1,\oplus)$ and another binary operation $\circ$ defined on $(E,0,1,\oplus)$ satisfying [4]: (SEA1) The map $b\mapsto a\circ b$ is additive for each $a\in E$, that is, if $b\bot c$, then $a\circ b\bot a\circ c$ and $a\circ(b\oplus c)=a\circ b\oplus a\circ c$. (SEA2) $1\circ a=a$ for each $a\in E$. (SEA3) If $a\circ b=0$, then $a\circ b=b\circ a$. (SEA4) If $a\circ b=b\circ a$, then $a\circ b^{\prime}=b^{\prime}\circ a$ and $a\circ(b\circ c)=(a\circ b)\circ c$ for each $c\in E$. (SEA5) If $c\circ a=a\circ c$ and $c\circ b=b\circ c$, then $c\circ(a\circ b)=(a\circ b)\circ c$ and $c\circ(a\oplus b)=(a\oplus b)\circ c$ whenever $a\bot b$. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra. Then the operation $\circ$ is said to be a sequential product on $(E,0,1,\oplus,\circ)$. If $a,b\in(E,0,1,\oplus,\circ)$ and $a\circ b=b\circ a$, then we say that $a$ and $b$ is sequentially independent and denoted by $a|b$ (see [4]). If $a\in(E,0,1,\oplus,\circ)$, we denote $a\circ a$ by $a^{2}$, it follows from ([4, Lemma 3.2]) that $a$ is a sharp element of $(E,0,1,\oplus,\circ)$ iff $a^{2}=a$. We denote the set of all sharp elements in $(E,0,1,\oplus,\circ)$ by $E_{s}$. In 2005, in order to motivate the study of sequential effect algebra theory, Professor Gudder presented 25 important and interesting problems, the 23th problem asked ([5]): If $a,b\in(E,0,1,\oplus,\circ)$ and $a\bot b$ and $a\circ b\bot a\circ b$, is it the case that $2(a\circ b)\leq a^{2}\oplus b^{2}$ ? In this paper, we construct an example to answer the problem negatively. At first, we show that the above average value inequality does hold in the underlying sequential effect algebras under some additional conditions. That is: Proposition 1. If $(E,0,1,\oplus,\circ)$ is a sequential effect algebra, $a,b\in E$, $a^{2}\perp b^{2}$(a sufficient condition for this is $a\perp b$), $a\leq b$(or $b\leq a$) and $a|b$, then $(a\circ b)\perp(a\circ b)$ and $2(a\circ b)\leq a^{2}\oplus b^{2}$. Proof. Since $a\leq b$, there exists a $c\in E$ such that $a\oplus c=b$. Since $a|b$, it follows that $c|b$ (see [4] Lemma 3.1(v)). $c\circ b=c\circ(a\oplus c)=(c\circ a)\oplus c^{2}$. $b^{2}=b\circ(a\oplus c)=(b\circ a)\oplus(b\circ c)=(a\circ b)\oplus(c\circ b)=(a\circ b)\oplus(c\circ a)\oplus c^{2}$. Since $a^{2}\perp b^{2}$, $a^{2}\oplus b^{2}=a^{2}\oplus(a\circ b)\oplus(c\circ a)\oplus c^{2}$. While $a\circ b=a\circ(a\oplus c)=a^{2}\oplus(a\circ c)=a^{2}\oplus(c\circ a)$, so $a^{2}\oplus b^{2}=(a\circ b)\oplus(a\circ b)\oplus c^{2}$. It follows that $(a\circ b)\perp(a\circ b)$ and $2(a\circ b)\leq a^{2}\oplus b^{2}$. Finally, if $a\perp b$, it follows from $a^{2}\leq a$ and $b^{2}\leq b$ that $a^{2}\perp b^{2}$. The proposition is proved. Proposition 2. If $(E,0,1,\oplus,\circ)$ is a sequential effect algebra, $a,b\in E$, $a\perp b$, $a\in E_{s}$(or $b\in E_{s}$), then $(a\circ b)\perp(a\circ b)$ and $2(a\circ b)\leq a^{2}\oplus b^{2}$. Proof. Since $a\perp b$ and $a\in E_{s}$, it follows that $a\circ b=0$ (see [4] Lemma 3.3(ii)), so $2(a\circ b)\leq a^{2}\oplus b^{2}$. Now, we construct a sequential effect algebra to show that the above average value inequality does not always hold. In this paper, we denote ${\mathbf{Z}}$ the integer set, ${\mathbf{N}}$ the nonnegative integer set and ${\mathbf{N}}^{+}$ the positive integer set. Let $E_{0}=\\{0,1,a_{n},b_{n},c_{i,k,m},d_{i,k,m}|\ n\in{\mathbf{N}}^{+},i,k\in{\mathbf{N}}\ and\ i^{2}+k^{2}\neq 0,m\in{\mathbf{Z}}\\}$. For simplicity, in the sequel, unless specified, the subindex of respective elements will always take values in the corresponding default sets. To be accurately, when we write $a_{n},b_{n}$, $n$ always take values in ${\mathbf{N}}^{+}$, when we write $c_{i,k,m},d_{i,k,m}$, $i,k$ always take values in ${\mathbf{N}}$ and $i^{2}+k^{2}\neq 0$ and $m$ always take values in ${\mathbf{Z}}$. We define a partial binary operation $\oplus$ on $E_{0}$ as follows(when we write $x\oplus y=z$, we always mean $x\oplus y=z=y\oplus x$): For each $x\in E_{0}$, $0\oplus x=x$, $a_{n}\oplus a_{m}=a_{n+m}$, $a_{n}\oplus c_{i,k,m}=c_{i,k,n+m}$, $a_{n}\oplus d_{i,k,m}=d_{i,k,m-n}$, $c_{i,k,m}\oplus c_{r,s,t}=c_{i+r,k+s,m+t}$. For $n<m$, $a_{n}\oplus b_{m}=b_{m-n}$, $a_{n}\oplus b_{n}=1$. For $i\leq r\ and\ k\leq s\ and\ (r-i)^{2}+(s-k)^{2}\neq 0$. $c_{i,k,m}\oplus d_{r,s,t}=d_{r-i,s-k,t-m}$. For $i=r\ and\ k=s\ and\ m<t$, $c_{i,k,m}\oplus d_{r,s,t}=b_{t-m}$. For $i=r\ and\ k=s\ and\ m=t$, $c_{i,k,m}\oplus d_{r,s,t}=1$. No other $\oplus$ operation is defined. Next, we define a binary operation $\circ$ on $E_{0}$ as follows(when we write $x\circ y=z$, we always mean $x\circ y=z=y\circ x$): For each $x\in E_{0}$, $0\circ x=0$, $1\circ x=x$, $a_{n}\circ a_{m}=0$, $a_{n}\circ b_{m}=a_{n}$, $b_{n}\circ b_{m}=b_{m+n}$, $a_{n}\circ c_{i,k,m}=0$, $c_{i,k,m}\circ b_{n}=c_{i,k,m}$, $a_{n}\circ d_{i,k,m}=a_{n}$, $b_{n}\circ d_{i,k,m}=d_{i,k,m+n}$, $d_{i,k,m}\circ d_{r,s,t}=d_{i+r,k+s,m+t-is-kr}$, $c_{i,k,m}\circ d_{r,s,t}=c_{i,k,m-is-kr}$, $c_{i,k,m}\circ c_{r,s,t}=a_{is+kr}(when\ is+kr\neq 0)\ or\ 0(when\ is+kr=0)$. Proposition 3. $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. Proof. First we verify that $(E_{0},0,1,\oplus)$ is an effect algebra. (EA1) and (EA4) are trivial. We verify (EA2), we omit the trivial cases about 0,1: $a_{n}\oplus(a_{m}\oplus a_{k})=(a_{n}\oplus a_{m})\oplus a_{k}=a_{k+m+n}$. $a_{n}\oplus(a_{m}\oplus c_{i,j,k})=(a_{n}\oplus a_{m})\oplus c_{i,j,k}=c_{i,j,k+m+n}$. $a_{n}\oplus(a_{m}\oplus d_{i,j,k})=(a_{n}\oplus a_{m})\oplus d_{i,j,k}=d_{i,j,k-m-n}$. $a_{n}\oplus(c_{r,s,t}\oplus c_{i,j,k})=(a_{n}\oplus c_{r,s,t})\oplus c_{i,j,k}=c_{i+r,s+j,k+t+n}$. $c_{l,m,n}\oplus(c_{r,s,t}\oplus c_{i,j,k})=(c_{l,m,n}\oplus c_{i,j,k})\oplus c_{r,s,t}=c_{i+l+r,j+m+s,k+n+t}$. Each $a_{n}\oplus(a_{m}\oplus b_{k})$ or $(a_{n}\oplus a_{m})\oplus b_{k}$ is defined iff $n+m\leq k$, at this case, $a_{n}\oplus(a_{m}\oplus b_{k})=(a_{n}\oplus a_{m})\oplus b_{k}=b_{k-m-n}(when\ m+n<k)\ or\ 1(when\ m+n=k)$. Each $a_{n}\oplus(c_{r,s,t}\oplus d_{i,j,k})$ or $(a_{n}\oplus c_{r,s,t})\oplus d_{i,j,k}$ or $(a_{n}\oplus d_{i,j,k})\oplus c_{r,s,t}$ is defined iff one of the following two conditions is satisfied: (1) $r\leq i\ and\ s\leq j\ and\ (i-r)^{2}+(j-s)^{2}\neq 0$, at this case, $a_{n}\oplus(c_{r,s,t}\oplus d_{i,j,k})=(a_{n}\oplus c_{r,s,t})\oplus d_{i,j,k}=(a_{n}\oplus d_{i,j,k})\oplus c_{r,s,t}=d_{i-r,j-s,k-t-n}$; (2) $r=i\ and\ s=j\ and\ n+t\leq k$, at this case, $a_{n}\oplus(c_{r,s,t}\oplus d_{i,j,k})=(a_{n}\oplus c_{r,s,t})\oplus d_{i,j,k}=(a_{n}\oplus d_{i,j,k})\oplus c_{r,s,t}=b_{k-t-n}(when\ n+t<k)\ or\ 1(when\ n+t=k)$. Each $c_{l,m,n}\oplus(c_{r,s,t}\oplus d_{i,j,k})$ or $(c_{l,m,n}\oplus c_{r,s,t})\oplus d_{i,j,k}$ is defined iff one of the following two conditions is satisfied: (1) $l+r\leq i\ and\ m+s\leq j\ and\ (i-l-r)^{2}+(j-m-s)^{2}\neq 0$, at this case, $c_{l,m,n}\oplus(c_{r,s,t}\oplus d_{i,j,k})=(c_{l,m,n}\oplus c_{r,s,t})\oplus d_{i,j,k}=d_{i-l-r,j-m-s,k-t-n}$; (2) $l+r=i\ and\ m+s=j\ and\ n+t\leq k$, at this case, $c_{l,m,n}\oplus(c_{r,s,t}\oplus d_{i,j,k})=(c_{l,m,n}\oplus c_{r,s,t})\oplus d_{i,j,k}=b_{k-t-n}(when\ n+t<k)\ or\ 1(when\ n+t=k)$. We verify (EA3): $a_{n}\oplus b_{n}=1$, $c_{i,k,m}\oplus d_{i,k,m}=1$. So $(E_{0},0,1,\oplus)$ is an effect algebra. We now verify that $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. (SEA2) and (SEA3) and (SEA5) are trivial. We verify (SEA1), we omit the trivial cases about 0,1: $a_{n}\circ(a_{m}\oplus a_{k})=a_{n}\circ a_{m}\oplus a_{n}\circ a_{k}=0$, $b_{n}\circ(a_{m}\oplus a_{k})=b_{n}\circ a_{m}\oplus b_{n}\circ a_{k}=a_{m+k}$, $c_{r,s,t}\circ(a_{m}\oplus a_{k})=c_{r,s,t}\circ a_{m}\oplus c_{r,s,t}\circ a_{k}=0$, $d_{r,s,t}\circ(a_{m}\oplus a_{k})=d_{r,s,t}\circ a_{m}\oplus d_{r,s,t}\circ a_{k}=a_{m+k}$. $a_{n}\circ(a_{m}\oplus c_{r,s,t})=a_{n}\circ a_{m}\oplus a_{n}\circ c_{r,s,t}=0$, $b_{n}\circ(a_{m}\oplus c_{r,s,t})=b_{n}\circ a_{m}\oplus b_{n}\circ c_{r,s,t}=c_{r,s,m+t}$, $c_{x,y,z}\circ(a_{m}\oplus c_{r,s,t})=c_{x,y,z}\circ a_{m}\oplus c_{x,y,z}\circ c_{r,s,t}=a_{xs+yr}(when\ xs+yr\neq\ 0)\ or\ 0(when\ xs+yr=0)$, $d_{x,y,z}\circ(a_{m}\oplus c_{r,s,t})=d_{x,y,z}\circ a_{m}\oplus d_{x,y,z}\circ c_{r,s,t}=c_{r,s,m+t-xs-yr}$. $a_{n}\circ(a_{m}\oplus d_{r,s,t})=a_{n}\circ a_{m}\oplus a_{n}\circ d_{r,s,t}=a_{n}$, $b_{n}\circ(a_{m}\oplus d_{r,s,t})=b_{n}\circ a_{m}\oplus b_{n}\circ d_{r,s,t}=d_{r,s,n+t-m}$, $c_{x,y,z}\circ(a_{m}\oplus d_{r,s,t})=c_{x,y,z}\circ a_{m}\oplus c_{x,y,z}\circ d_{r,s,t}=c_{x,y,z-xs-yr}$, $d_{x,y,z}\circ(a_{m}\oplus d_{r,s,t})=d_{x,y,z}\circ a_{m}\oplus d_{x,y,z}\circ d_{r,s,t}=d_{x+r,y+s,z+t-m-xs-yr}$. $a_{n}\circ(c_{x,y,z}\oplus c_{r,s,t})=a_{n}\circ c_{x,y,z}\oplus a_{n}\circ c_{r,s,t}=0$, $b_{n}\circ(c_{x,y,z}\oplus c_{r,s,t})=b_{n}\circ c_{x,y,z}\oplus b_{n}\circ c_{r,s,t}=c_{x+r,y+s,z+t}$, $c_{i,k,m}\circ(c_{x,y,z}\oplus c_{r,s,t})=c_{i,k,m}\circ c_{x,y,z}\oplus c_{i,k,m}\circ c_{r,s,t}=a_{i(y+s)+k(x+r)}(when\ i(y+s)+k(x+r)\neq 0)\ or\ 0(when\ i(y+s)+k(x+r)=0)$, $d_{i,k,m}\circ(c_{x,y,z}\oplus c_{r,s,t})=d_{i,k,m}\circ c_{x,y,z}\oplus d_{i,k,m}\circ c_{r,s,t}=c_{x+r,y+s,z+t-i(y+s)-k(x+r)}$. For $m\leq k$, $a_{n}\circ(a_{m}\oplus b_{k})=a_{n}\circ a_{m}\oplus a_{n}\circ b_{k}=a_{n}$, $b_{n}\circ(a_{m}\oplus b_{k})=b_{n}\circ a_{m}\oplus b_{n}\circ b_{k}=b_{n+k-m}$, $c_{x,y,z}\circ(a_{m}\oplus b_{k})=c_{x,y,z}\circ a_{m}\oplus c_{x,y,z}\circ b_{k}=c_{x,y,z}$, $d_{x,y,z}\circ(a_{m}\oplus b_{k})=d_{x,y,z}\circ a_{m}\oplus d_{x,y,z}\circ b_{k}=d_{x,y,z+k-m}$. For $i\leq r\ and\ k\leq s\ and\ (r-i)^{2}+(s-k)^{2}\neq 0$, $a_{n}\circ(c_{i,k,m}\oplus d_{r,s,t})=a_{n}\circ c_{i,k,m}\oplus a_{n}\circ d_{r,s,t}=a_{n}$, $b_{n}\circ(c_{i,k,m}\oplus d_{r,s,t})=b_{n}\circ c_{i,k,m}\oplus b_{n}\circ d_{r,s,t}=d_{r-i,s-k,n+t-m}$, $c_{x,y,z}\circ(c_{i,k,m}\oplus d_{r,s,t})=c_{x,y,z}\circ c_{i,k,m}\oplus c_{x,y,z}\circ d_{r,s,t}=c_{x,y,z-x(s-k)-y(r-i)}$, $d_{x,y,z}\circ(c_{i,k,m}\oplus d_{r,s,t})=d_{x,y,z}\circ c_{i,k,m}\oplus d_{x,y,z}\circ d_{r,s,t}=d_{x+r-i,y+s-k,z+t-m-x(s-k)-y(r-i)}$. For $i=r\ and\ k=s\ and\ m\leq t$, $a_{n}\circ(c_{i,k,m}\oplus d_{r,s,t})=a_{n}\circ c_{i,k,m}\oplus a_{n}\circ d_{r,s,t}=a_{n}$, $b_{n}\circ(c_{i,k,m}\oplus d_{r,s,t})=b_{n}\circ c_{i,k,m}\oplus b_{n}\circ d_{r,s,t}=b_{n+t-m}$, $c_{x,y,z}\circ(c_{i,k,m}\oplus d_{r,s,t})=c_{x,y,z}\circ c_{i,k,m}\oplus c_{x,y,z}\circ d_{r,s,t}=c_{x,y,z}$, $d_{x,y,z}\circ(c_{i,k,m}\oplus d_{r,s,t})=d_{x,y,z}\circ c_{i,k,m}\oplus d_{x,y,z}\circ d_{r,s,t}=d_{x,y,z+t-m}$. We verify (SEA4), we omit the trivial cases about 0,1: $a_{n}\circ(a_{m}\circ a_{k})=(a_{n}\circ a_{m})\circ a_{k}=0$, $a_{n}\circ(a_{m}\circ b_{k})=b_{k}\circ(a_{n}\circ a_{m})=a_{m}\circ(a_{n}\circ b_{k})=0$, $a_{n}\circ(a_{m}\circ c_{r,s,t})=c_{r,s,t}\circ(a_{n}\circ a_{m})=a_{m}\circ(a_{n}\circ c_{r,s,t})=0$, $a_{n}\circ(a_{m}\circ d_{r,s,t})=d_{r,s,t}\circ(a_{n}\circ a_{m})=a_{m}\circ(a_{n}\circ d_{r,s,t})=0$, $a_{n}\circ(b_{m}\circ b_{k})=b_{k}\circ(a_{n}\circ b_{m})=b_{m}\circ(a_{n}\circ b_{k})=a_{n}$, $a_{n}\circ(b_{m}\circ c_{r,s,t})=c_{r,s,t}\circ(a_{n}\circ b_{m})=b_{m}\circ(a_{n}\circ c_{r,s,t})=0$, $a_{n}\circ(b_{m}\circ d_{r,s,t})=d_{r,s,t}\circ(a_{n}\circ b_{m})=b_{m}\circ(a_{n}\circ d_{r,s,t})=a_{n}$, $a_{n}\circ(c_{i,k,m}\circ c_{r,s,t})=c_{r,s,t}\circ(a_{n}\circ c_{i,k,m})=c_{i,k,m}\circ(a_{n}\circ c_{r,s,t})=0$, $a_{n}\circ(c_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(a_{n}\circ c_{i,k,m})=c_{i,k,m}\circ(a_{n}\circ d_{r,s,t})=0$, $a_{n}\circ(d_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(a_{n}\circ d_{i,k,m})=d_{i,k,m}\circ(a_{n}\circ d_{r,s,t})=a_{n}$, $b_{n}\circ(b_{m}\circ b_{k})=b_{k}\circ(b_{n}\circ b_{m})=b_{m+n+k}$, $b_{n}\circ(b_{m}\circ c_{r,s,t})=c_{r,s,t}\circ(b_{n}\circ b_{m})=b_{m}\circ(b_{n}\circ c_{r,s,t})=c_{r,s,t}$, $b_{n}\circ(b_{m}\circ d_{r,s,t})=d_{r,s,t}\circ(b_{n}\circ b_{m})=b_{m}\circ(b_{n}\circ d_{r,s,t})=d_{r,s,n+m+t}$, $b_{n}\circ(c_{i,k,m}\circ c_{r,s,t})=c_{r,s,t}\circ(b_{n}\circ c_{i,k,m})=c_{i,k,m}\circ(b_{n}\circ c_{r,s,t})=a_{is+kr}(when\ is+kr\neq 0)\ or\ 0(when\ is+kr=0)$, $b_{n}\circ(c_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(b_{n}\circ c_{i,k,m})=c_{i,k,m}\circ(b_{n}\circ d_{r,s,t})=c_{i,k,m-is-kr}$, $b_{n}\circ(d_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(b_{n}\circ d_{i,k,m})=d_{i,k,m}\circ(b_{n}\circ d_{r,s,t})=d_{i+r,k+s,n+m-t-is-kr}$, $c_{x,y,z}\circ(c_{i,k,m}\circ c_{r,s,t})=c_{r,s,t}\circ(c_{x,y,z}\circ c_{i,k,m})=0$, $c_{x,y,z}\circ(c_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(c_{x,y,z}\circ c_{i,k,m})=c_{i,k,m}\circ(c_{x,y,z}\circ d_{r,s,t})=a_{xk+yi}(when\ xk+yi\neq 0)\ or\ 0(when\ xk+yi=0)$, $c_{x,y,z}\circ(d_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(c_{x,y,z}\circ d_{i,k,m})=d_{i,k,m}\circ(c_{x,y,z}\circ d_{r,s,t})=c_{x,y,z-x(k+s)-y(i+r)}$, $d_{x,y,z}\circ(d_{i,k,m}\circ d_{r,s,t})=d_{r,s,t}\circ(d_{x,y,z}\circ d_{i,k,m})$$=d_{x+i+r,y+k+s,z+m+t-(is+kr+xk+xs+yi+yr)}$. So $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. Our main result is: Theorem 1. The average value inequality does not always hold in sequential effect algebras. Proof. In fact, in $(E_{0},0,1,\oplus,\circ)$, $c_{1,0,0}\perp c_{0,1,0}$, $c_{1,0,0}\oplus c_{0,1,0}=c_{1,1,0}$. $c_{1,0,0}\circ c_{0,1,0}=a_{1}$, $a_{1}\perp a_{1}$, $a_{1}\oplus a_{1}=a_{2}$. But $2(c_{1,0,0}\circ c_{0,1,0})=2a_{1}=a_{1}\oplus a_{1}=a_{2}$, $(c_{1,0,0})^{2}=c_{1,0,0}\circ c_{1,0,0}=0$, $(c_{0,1,0})^{2}=c_{0,1,0}\circ c_{0,1,0}=0$, so $2(c_{1,0,0}\circ c_{0,1,0})\not\leq(c_{1,0,0})^{2}\oplus(c_{0,1,0})^{2}$. Remarks. Recently, the 2th problem, the 3th problem, the 17th problem and the 20th problem of Gudder have also been answered ([6-9]). References [1]. Foulis, D J, Bennett, M K. Effect algebras and unsharp quantum logics. Found Phys 24 (1994), 1331-1352. [2]. Gudder, S. Sharply dominating effect algebras. Tatra Mt. Math. Publ., 15(1998), 23-30. [3]. Gudder, S, Nagy, G. Sequential quantum measurements. J. Math. Phys. 42(2001), 5212-5222. [4]. Gudder, S, Greechie, R. Sequential products on effect algebras. Rep. Math. Phys. 49(2002), 87-111. [5]. Gudder, S. Open problems for sequential effect algebras. Inter. J. Theory. Phys. 44 (2005), 2219-2230. [6]. Weihua Liu, Junde Wu. The Uniqueness Problem of Sequence Product on Operator Effect Algebra ${\cal E}(H)$. J. Physi. A (Accepted to appear). [7]. Jun Shen, Junde Wu. Not each sequential effect algebra is sharply dominating. Physics Letter A (Accepted to appear). [8]. Jun Shen, Junde Wu. Remarks on the sequential effect algebras. Report Math. Physi. (Accepted to appear). [9]. Jun Shen, Junde Wu. The square root is not unique in sequential effect algebras. (To appear).
arxiv-papers
2009-03-30T02:46:40
2024-09-04T02:49:01.510454
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Shen Jun and Wu Junde", "submitter": "Junde Wu", "url": "https://arxiv.org/abs/0903.5115" }
0903.5116
# Remarks on the sequential effect algebras††thanks: This project is supported by Natural Science Found of China (10771191 and 10471124). Shen Jun1,2, Wu Junde1 Corresponding author: wjd@zju.edu.cn ###### Abstract In this paper, first, we answer affirmatively an open problem which was presented in 2005 by professor Gudder on the sub-sequential effect algebras. That is, we prove that if $(E,0,1,\oplus,\circ)$ is a sequential effect algebra and $A$ is a commutative subset of $E$, then the sub-sequential effect algebra $\overline{A}$ generated by $A$ is also commutative. Next, we also study the following uniqueness problem: If $na=nb=c$ for some positive integer $n\geq 2$, then under what conditions $a=b$ hold? We prove that if $c$ is a sharp element of $E$ and $a|b$, then $a=b$. We give also two examples to show that neither of the above two conditions can be discarded. 1Department of Mathematics, Zhejiang University, Hangzhou 310027, P. R. China 2Department of Mathematics, Anhui Normal University, Wuhu 241003, P. R. China Key Words. Sub-sequential effect algebras, commutative, uniqueness. 1\. Introduction Effect algebra is an important logic model for studying quantum effects or observations which may be fuzzy or unsharp (see [1]), to be precise, an effect algebra is a system $(E,0,1,\oplus)$, where 0 and 1 are distinct elements of $E$ and $\oplus$ is a partial binary operation on $E$ satisfying: (EA1) If $a\oplus b$ is defined, then $b\oplus a$ is defined and $b\oplus a=a\oplus b$. (EA2) If $a\oplus(b\oplus c)$ is defined, then $(a\oplus b)\oplus c$ is defined and $(a\oplus b)\oplus c=a\oplus(b\oplus c).$ (EA3) For each $a\in E$, there exists a unique element $b\in E$ such that $a\oplus b=1$. (EA4) If $a\oplus 1$ is defined, then $a=0$. In an effect algebra $(E,0,1,\oplus)$, if $a\oplus b$ is defined, we write $a\bot b$. For each $a\in E$, it follows from (EA3) that there exists a unique element $b\in E$ such that $a\oplus b=1$, we denote $b$ by $a^{\prime}$. Let $a,b\in E$, if there exists an element $c\in E$ such that $a\bot c$ and $a\oplus c=b$, then we say that $a\leq b$ and write $c=b\ominus a$. It follows from [1] that $\leq$ is a partial order of $(E,0,1,\oplus)$ and satisfies that for each $a\in E$, $0\leq a\leq 1$, $a\bot b$ if and only if $a\leq b^{\prime}$. Let $(E,0,1,\oplus)$ be an effect algebra and $a\in E$. If $a\wedge a^{\prime}=0$, then $a$ is said to be a sharp element of $E$. The set $E_{s}=\\{x\in E|\ x\wedge x^{\prime}=0\\}$ is called the set of all sharp elements of $E$ (see [2-3]). As we knew, two measurements $a$ and $b$ cannot be performed simultaneously in general, so they are frequently executed sequentially ([4]). We denote by $a\circ b$ a sequential measurement in which $a$ is performed first and $b$ second and call $a\circ b$ a sequential product of $a$ and $b$. Thus, it is an important and interesting project to study effect algebras which have a sequential product $\circ$ with some nature properties. To be precise: A sequential effect algebra (SEA) is an effect algebra $(E,0,1,\oplus)$ and another binary operation $\circ$ defined on $(E,0,1,\oplus)$ satisfying [5]: (SEA1) The map $b\mapsto a\circ b$ is additive for each $a\in E$, that is, if $b\bot c$, then $a\circ b\bot a\circ c$ and $a\circ(b\oplus c)=a\circ b\oplus a\circ c$. (SEA2) $1\circ a=a$ for each $a\in E$. (SEA3) If $a\circ b=0$, then $a\circ b=b\circ a$. (SEA4) If $a\circ b=b\circ a$, then $a\circ b^{\prime}=b^{\prime}\circ a$ and for each $c\in E$, $a\circ(b\circ c)=(a\circ b)\circ c$. (SEA5) If $c\circ a=a\circ c$ and $c\circ b=b\circ c$, then $c\circ(a\circ b)=(a\circ b)\circ c$ and $c\circ(a\oplus b)=(a\oplus b)\circ c$ whenever $a\bot b$. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra. If $a,b\in E$ and $a\circ b=b\circ a$, then we say $a$ and $b$ is sequentially independent and denoted by $a|b$. Lemma 1 ([1, 5]). If $(E,0,1,\oplus,\circ)$ is a sequential effect algebra and $a,b,c\in E$, then (1) $a\perp b$, $a\perp c$ and $a\oplus b=a\oplus c$ implies that $b=c$. (2) $a\in E_{s}$ if and only if $a\circ a=a$. (3) If $c\in E_{s}$, then $a\leq c$ if and only if $a=a\circ c=c\circ a$. 2\. Sub-sequential effect algebra generated by a subset Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra and $F$ a nonempty subset of $E$. We call $F$ a sub-sequential effect algebra of $(E,0,1,\oplus,\circ)$ if $0,1\in F$ and $(F,0,1,\oplus,\circ)$ itself is a sequential effect algebra. From the definition of sub-sequential effect algebra, it is easy to see that a nonempty subset $F$ of $(E,0,1,\oplus,\circ)$ is a sub-sequential effect algebra if and only if $F$ is closed under all the three operations $\oplus$, $\circ$ and ′. Moreover, if $A$ is a nonempty subset of $E$, it is easy to see that there exists a smallest sub-sequential effect algebra $\overline{A}$ of $E$ which contains $A$ (That is, the intersection of all sub-sequential effect algebras containing $A$). We call $\overline{A}$ the sub-sequential effect algebra generated by $A$. In 2005, Professor Gudder presented the following open problem (see [6, Problem 17]): Problem 1. If $(E,0,1,\oplus,\circ)$ is a sequential effect algebra and $A$ a commutative subset of $E$ (That is, $a|b$ for all $a,b\in A$), is $\overline{A}$ commutative ? In this paper, we answer the problem affirmatively. That is: Theorem 1. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra and $A$ a commutative subset of $(E,0,1,\oplus,\circ)$. Then $\overline{A}$ is also commutative. Proof. Let $\bigwedge=\\{F|\ F\ be\ a$ commutative subset of $E$ containing $A$}. We order $\bigwedge$ by including. Using Zorn’s Lemma, it is easy to see that there exists a maximal element $F_{0}$ in $\bigwedge$. That is, $F_{0}$ is a maximal commutative subset of $E$ containing $A$. We now prove that $F_{0}$ is a sub-sequential effect algebra of $E$: If $a\in F_{0}$, then for each $c\in F_{0}$, $c|a$, so $c|a^{\prime}$ by (SEA4). By maximality, we have $a^{\prime}\in F_{0}$. If $a,b\in F_{0}$, then for each $c\in F_{0}$, $c|a$, $c|b$, so $c|(a\circ b)$ by (SEA5). By maximality, we have $(a\circ b)\in F_{0}$. If $a,b\in F_{0}$ and $a\perp b$, then for each $c\in F_{0}$, $c|a$, $c|b$, so $c|(a\oplus b)$ by (SEA5). By maximality, we have $(a\oplus b)\in F_{0}$. So $F_{0}$ is closed under all the three operations $\oplus$, $\circ$ and ′. Thus, $F_{0}$ is a sub-sequential effect algebra of $(E,0,1,\oplus,\circ)$ containing $A$. Since $\overline{A}$ is the smallest sub-sequential effect algebra of $(E,0,1,\oplus,\circ)$ containing $A$, we have $\overline{A}\subseteq F_{0}$ and $\overline{A}$ is also commutative. Moreover, for general subset $A$ of $E$, we can describe the structure of $\overline{A}$, that is Theorem 2. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra and $A$ a subset of $E$. If we denote $A_{1}=A\bigcup(\bigcup\limits_{a\in A}a^{\prime})\bigcup(\bigcup\limits_{a,b\in A}a\circ b)\bigcup(\bigcup\limits_{a,b\in A\ and\ a\perp b}a\oplus b)$, $A_{2}=A_{1}\bigcup(\bigcup\limits_{a\in A_{1}}a^{\prime})\bigcup(\bigcup\limits_{a,b\in A_{1}}a\circ b)\bigcup(\bigcup\limits_{a,b\in A_{1}\ and\ a\perp b}a\oplus b)$, $\cdots$ $A_{n}=A_{n-1}\bigcup(\bigcup\limits_{a\in A_{n-1}}a^{\prime})\bigcup(\bigcup\limits_{a,b\in A_{n-1}}a\circ b)\bigcup(\bigcup\limits_{a,b\in A_{n-1}\ and\ a\perp b}a\oplus b)$, $\cdots$ $\Gamma=\bigcup\limits_{n=1}\limits^{\infty}A_{n}$. Then $\overline{A}=\Gamma$. Proof. First we prove that $\Gamma$ is a sub-sequential effect algebra of $(E,0,1,\oplus,\circ)$. If $a\in\Gamma$, then $a\in A_{n}$ for some $n$, so $a^{\prime}\in A_{n+1}\subseteq\Gamma$. If $a,b\in\Gamma$, then $a,b\in A_{n}$ for some $n$, so $(a\circ b)\in A_{n+1}\subseteq\Gamma$. If $a,b\in\Gamma$ and $a\perp b$, then $a,b\in A_{n}$ for some $n$, so $(a\oplus b)\in A_{n+1}\subseteq\Gamma$. Thus, $\Gamma$ is closed under all the three operations $\oplus$, $\circ$ and ′. So $\Gamma$ is a sub-sequential effect algebra of $(E,0,1,\oplus,\circ)$. Of course $A\subseteq\Gamma$. Since $\overline{A}$ is the smallest sub- sequential effect algebra of $(E,0,1,\oplus,\circ)$ containing $A$, we have $\overline{A}\subseteq\Gamma$. On the other hand, by induction, it is easy to see that $A_{n}\subseteq\overline{A}$ for all $n$. Thus $\Gamma\subseteq\overline{A}$. So $\Gamma=\overline{A}$. Note that by using Theorem 2 we can also answer professor Gudder’s problem by a constructive way, we omit the process. 3\. An addition property of sequential effect algebras Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra, $a,b\in E$. If $\underbrace{a\oplus a\cdots\oplus a}\limits_{the\ number\ is\ n}$ is defined, we denote it by $na$. Now, we are interested in the following uniqueness problem: If for some positive integer $n_{0}\geq 2$, $n_{0}a=n_{0}b$, then under what conditions $a=b$ hold? We have Theorem 3. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra, $a,b\in E$ and for some positive integer $n_{0}\geq 2$, $n_{0}a=n_{0}b=c$. If $c\in E_{s}$ and $a|b$, then $a=b$. Proof. Since $a\leq c$, by Lemma 1, $a=a\circ c$, similarly $b=b\circ c$. By (SEA1), we have $a\circ c=a\circ(n_{0}b)=n_{0}(a\circ b)$, $b\circ c=b\circ(n_{0}a)=n_{0}(b\circ a)$. Note that $a|b$, so $a\circ b=b\circ a$ and $a\circ c=b\circ c$. Thus $a=b$. Now, we show that neither of the two conditions in Theorem 3 can be discarded. Example 1. Let $I_{1}=[0,1]$, $I_{2}=[0,1]$, $E=HS(I_{1},I_{2})$ be the horizontal sum of $I_{1},I_{2}$ (see [5, Section 8, the Example in $P_{109}$]). For each $t\in[0,1]$, if it is in $I_{1}$, we denote it by $\hat{t}$; if it is in $I_{2}$, we denote it by $\check{t}$. Let $a=\hat{\frac{1}{n_{0}}}$, $b=\check{\frac{1}{n_{0}}}$. Then $n_{0}a=1=n_{0}b$, $1\in E_{s}$, $a\neq b$, $a\circ b\neq b\circ a$. So the condition $a|b$ in Theorem 3 can not be discarded. Example 2. Let ${\mathbf{N}}$ be the nonnegative integer set, $n_{0}$ be a positive integer and $n_{0}\geq 2$, $E_{0}=\\{0,1,a_{n,m},b_{n,m}|\ n,m\in{\mathbf{N}},\ n_{0}-1\geq m,\ n^{2}+m^{2}\neq 0\\}$. First, we define a partial binary operation $\oplus$ on $E_{0}$ as follows (when we write $x\oplus y=z$, we always mean $x\oplus y=z=y\oplus x$): For each $x\in E_{0}$, $0\oplus x=x$, $a_{n,m}\oplus a_{r,s}=\left\\{\begin{array}[]{ll}a_{n+r,m+s}\ ,&\hbox{$if\ m+s<n_{0}$;}\\\ a_{n+r+n_{0},m+s-n_{0}}\ ,&\hbox{$if\ m+s\geq n_{0}$.}\end{array}\right.$ $a_{n,m}\oplus b_{r,s}=\left\\{\begin{array}[]{ll}b_{r-n,s-m}\ ,&\hbox{$if\ n\leq r,\ m\leq s,\ (r-n)^{2}+(s-m)^{2}\neq 0$;}\\\ 1\ ,&\hbox{$if\ n=r,\ m=s$;}\\\ b_{r-n-n_{0},s-m+n_{0}}\ ,&\hbox{$if\ n+n_{0}\leq r,\ m>s$.}\end{array}\right.$ No other $\oplus$ operation is defined. Next, we define a binary operation $\circ$ on $E_{0}$ as follows (when we write $x\circ y=z$, we always mean $x\circ y=z=y\circ x$): For each $x\in E_{0}$, $0\circ x=0$, $1\circ x=x$, $a_{n,m}\circ a_{r,s}=0$, $a_{n,m}\circ b_{r,s}=a_{n,m}$, $b_{n,m}\circ b_{r,s}=\left\\{\begin{array}[]{ll}b_{n+r,m+s}\ ,&\hbox{$if\ m+s<n_{0}$;}\\\ b_{n+r+n_{0},m+s-n_{0}}\ ,&\hbox{$if\ m+s\geq n_{0}$.}\end{array}\right.$ Now, we prove that $E_{0}$ is a sequential effect algebra. In fact, (EA1) and (EA4) are trivial. We verify (EA2), for simplicity, we omit the trivial cases about 0,1: $a_{k,j}\oplus(a_{n,m}\oplus a_{r,s})=(a_{k,j}\oplus a_{n,m})\oplus a_{r,s}$ $=\left\\{\begin{array}[]{ll}a_{k+r+n,s+j+m}\ ,&\hbox{$if\ s+j+m<n_{0}$;}\\\ a_{k+r+n+n_{0},s+j+m-n_{0}}\ ,&\hbox{$if\ n_{0}\leq s+j+m<2n_{0}$;}\\\ a_{k+r+n+2n_{0},s+j+m-2n_{0}}\ ,&\hbox{$if\ s+j+m\geq 2n_{0}$.}\end{array}\right.$ Each $a_{k,j}\oplus(a_{n,m}\oplus b_{r,s})$ or $(a_{k,j}\oplus a_{n,m})\oplus b_{r,s}$ is defined if and only if one of the following four conditions is satisfied, at this case, $a_{k,j}\oplus(a_{n,m}\oplus b_{r,s})=(a_{k,j}\oplus a_{n,m})\oplus b_{r,s}$ $=\left\\{\begin{array}[]{ll}b_{r-k-n,s-j-m}\ ,&\hbox{$if\ k+n\leq r,\ j+m\leq s,\ (r-k-n)^{2}+(s-j-m)^{2}\neq 0$;}\\\ b_{r-k-n-n_{0},s-j-m+n_{0}}\ ,&\hbox{$if\ k+n+n_{0}\leq r,\ s<j+m\leq n_{0}+s,$}\\\ &\hbox{~{}~{}~{}~{}~{}~{}~{}~{}$(r-k-n-n_{0})^{2}+(s-j-m+n_{0})^{2}\neq 0$;}\\\ b_{r-k-n-2n_{0},s-j-m+2n_{0}}\ ,&\hbox{$if\ k+n+2n_{0}\leq r,\ n_{0}+s<j+m$;}\\\ 1\ ,&\hbox{$if\ (r-k-n)^{2}+(s-j-m)^{2}=0\ or$}\\\ &\hbox{~{}~{}~{}~{}~{}~{}~{}~{}$(r-k-n- n_{0})^{2}+(s-j-m+n_{0})^{2}=0$.}\end{array}\right.$ Thus, (EA2) is hold. (EA3) is clear since $a_{n,m}\oplus b_{n,m}=1$. Thus, $(E_{0},0,1,\oplus)$ is an effect algebra. Moreover, we verify that $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. (SEA2) and (SEA3) and (SEA5) are trivial. We verify (SEA1), for simplicity, we omit the trivial cases about 0,1: $a_{k,j}\circ(a_{n,m}\oplus a_{r,s})=a_{k,j}\circ a_{n,m}\oplus a_{k,j}\circ a_{r,s}=0$. $b_{k,j}\circ(a_{n,m}\oplus a_{r,s})=b_{k,j}\circ a_{n,m}\oplus b_{k,j}\circ a_{r,s}=\left\\{\begin{array}[]{ll}a_{n+r,m+s}\ ,&\hbox{$if\ m+s<n_{0}$;}\\\ a_{n+r+n_{0},m+s-n_{0}}\ ,&\hbox{$if\ m+s\geq n_{0}$.}\end{array}\right.$ When $a_{n,m}\oplus b_{r,s}$ is defined, $a_{k,j}\circ(a_{n,m}\oplus b_{r,s})=a_{k,j}\circ a_{n,m}\oplus a_{k,j}\circ b_{r,s}=a_{k,j}$, $b_{k,j}\circ(a_{n,m}\oplus b_{r,s})=b_{k,j}\circ a_{n,m}\oplus b_{k,j}\circ b_{r,s}$ $=\left\\{\begin{array}[]{ll}b_{r+k-n,s+j-m}\ ,&\hbox{$if\ n\leq r,\ m\leq s,\ j+s<n_{0}+m$;}\\\ b_{r+k-n,s+j-m}\ ,&\hbox{$if\ n+n_{0}\leq r,\ s<m\leq j+s$;}\\\ b_{r+k-n+n_{0},s+j-m-n_{0}}\ ,&\hbox{$if\ n\leq r,\ n_{0}+m\leq j+s$;}\\\ b_{r+k-n-n_{0},s+j-m+n_{0}}\ ,&\hbox{$if\ n+n_{0}\leq r,\ j+s<m$.}\end{array}\right.$ Thus, (SEA1) is true. We verify (SEA4), for simplicity, we omit also the trivial cases about 0,1: $a_{k,j}\circ(a_{n,m}\circ a_{r,s})=(a_{k,j}\circ a_{n,m})\circ a_{r,s}=0$. $a_{k,j}\circ(a_{n,m}\circ b_{r,s})=(a_{k,j}\circ a_{n,m})\circ b_{r,s}=0$. $a_{k,j}\circ(b_{n,m}\circ b_{r,s})=(a_{k,j}\circ b_{n,m})\circ b_{r,s}=a_{k,j}$. $b_{k,j}\circ(b_{n,m}\circ b_{r,s})=(b_{k,j}\circ b_{n,m})\circ b_{r,s}$ $=\left\\{\begin{array}[]{ll}b_{k+r+n,s+j+m}\ ,&\hbox{$if\ s+j+m<n_{0}$;}\\\ b_{k+r+n+n_{0},s+j+m-n_{0}}\ ,&\hbox{$if\ n_{0}\leq s+j+m<2n_{0}$;}\\\ b_{k+r+n+2n_{0},s+j+m-2n_{0}}\ ,&\hbox{$if\ s+j+m\geq 2n_{0}$.}\end{array}\right.$ Thus (SEA4) is hold and $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. Finally, we show that the condition $c\in E_{s}$ in Theorem 3 can not be discarded. Indeed, since $a_{n,0}\oplus a_{r,0}=a_{n+r,0}$, so $n_{0}a_{1,0}=a_{n_{0},0}$. Note that $a_{0,m}\oplus a_{0,s}=\left\\{\begin{array}[]{ll}a_{0,m+s}\ ,&\hbox{$if\ m+s<n_{0}$;}\\\ a_{n_{0},m+s-n_{0}}\ ,&\hbox{$if\ m+s\geq n_{0}$.}\end{array}\right.$ Thus, $(n_{0}-1)a_{0,1}=a_{0,n_{0}-1}$, $n_{0}a_{0,1}=(n_{0}-1)a_{0,1}\oplus a_{0,1}=a_{0,n_{0}-1}\oplus a_{0,1}=a_{n_{0},0}$, that is, $n_{0}a_{1,0}=a_{n_{0},0}=n_{0}a_{0,1}$. Note that $a_{n_{0},0}\circ a_{n_{0},0}=0$, so $a_{n_{0},0}\not\in(E_{0})_{s}$. References [1]. D. J. Foulis and M. K. Bennett: Effect algebras and unsharp quantum logics. Found. Phys. 24, 1331(1994). [2]. S. Gudder: Sharply dominating effect algebras. Tatra Mt. Math. Publ. 15, 23(1998). [3]. Z. Riecanova and J. D. Wu: States on sharply dominating effect algebras. Sci. in China A: Math. 51, 907(2008). [4]. S. Gudder and G. Nagy: Sequential quantum measurements. J. Math. Phys. 42, 5212(2001). [5]. S. Gudder and R. Greechie: Sequential products on effect algebras. Rep. Math. Phys. 49, 87(2002). [6]. S. Gudder: Open problems for sequential effect algebras. Inter. J. Theory. Phys. 44, 2219(2005).
arxiv-papers
2009-03-30T02:55:59
2024-09-04T02:49:01.515545
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Shen Jun and Wu Junde", "submitter": "Junde Wu", "url": "https://arxiv.org/abs/0903.5116" }
0903.5120
# The n-th root of sequential effect algebras††thanks: This project is supported by Natural Science Foundation of China (10771191 and 10471124) and Natural Science Foundation of Zhejiang Province of China (Y6090105). Shen Jun1,2, Wu Junde1 Tel: 86-571-87951609-8111, E-mail: wjd@zju.edu.cn ###### Abstract In 2005, Professor Gudder presented 25 open problems of sequential effect algebras, the 20th problem asked: In a sequential effect algebra, if the square root of some element exists, is it unique ? We can strengthen the problem as following: For each given positive integer $n>1$, is there a sequential effect algebra such that the n-th root of its some element $c$ is not unique and the n-th root of $c$ is not the k-th root of $c$ ($k<n$) ? In this paper, we answer the strengthened problem affirmatively. 1Department of Mathematics, Zhejiang University, Hangzhou 310027, P. R. China 2Department of Mathematics, Anhui Normal University, Wuhu 241003, P. R. China Keywords. Effect algebra, sequential effect algebra, root. PACS numbers: 02.10-v, 02.30.Tb, 03.65.Ta. Let $H$ be a complex Hilbert space and ${\cal D}(H)$ the set of density operators on $H$, i.e., the trace class positive operators on $H$ of unit trace, which represent the states of quantum system. A self-adjoint operator $A$ on $H$ such that $0\leq A\leq I$ is called a quantum effect ([1, 2]), the set of quantum effects on $H$ is denoted by ${\cal E}(H)$. The set of orthogonal projection operators on $H$ is denoted by ${\cal P}(H)$. For each $P\in{\cal P}(H)$ is associated a so-called Lüders transformation $\Phi_{L}^{P}:{\cal D}(H)\rightarrow{\cal D}(H)$ such that for each $T\in{\cal D}(H)$, $\Phi_{L}^{P}(T)=PTP$. Moreover, each quantum effect $B\in{\cal E}(H)$ gives also to a general Lüders transformation $\Phi_{L}^{B}$ such that for each $T\in{\cal D}(H)$, $\Phi_{L}^{B}(T)=B^{\frac{1}{2}}TB^{\frac{1}{2}}$ ([3-4]). Let $B,C\in{\cal E}(H)$ be two quantum effects. It is easy to prove that the composition $\Phi_{L}^{B}\circ\Phi_{L}^{C}$ satisfies that for each $T\in{\cal D}(H)$, ($\Phi_{L}^{B}\circ\Phi_{L}^{C})(T)=(B^{\frac{1}{2}}CB^{\frac{1}{2}})^{\frac{1}{2}}T(B^{\frac{1}{2}}CB^{\frac{1}{2}})^{\frac{1}{2}}$ ([4]). Professor Gudder called $B^{\frac{1}{2}}CB^{\frac{1}{2}}$ the sequential product of $B$ and $C$, and denoted it by $B\circ C$ ([5-7]). This sequential product has been generalized to an algebraic structure called a sequential effect algebra ([8]). Now, we state the basic definitions and results of sequential effect algebras. An effect algebra is a system $(E,0,1,\oplus)$, where 0 and 1 are distinct elements of $E$ and $\oplus$ is a partial binary operation on $E$ satisfying that [9]: (EA1). If $a\oplus b$ is defined, then $b\oplus a$ is defined and $b\oplus a=a\oplus b$. (EA2). If $a\oplus(b\oplus c)$ is defined, then $(a\oplus b)\oplus c$ is defined and $(a\oplus b)\oplus c=a\oplus(b\oplus c).$ (EA3). For each $a\in E$, there exists a unique element $b\in E$ such that $a\oplus b=1$. (EA4). If $a\oplus 1$ is defined, then $a=0$. In an effect algebra $(E,0,1,\oplus)$, if $a\oplus b$ is defined, we write $a\bot b$. For each $a\in(E,0,1,\oplus)$, it follows from (EA3) that there exists a unique element $b\in E$ such that $a\oplus b=1$, we denote $b$ by $a^{\prime}$. Let $a,b\in(E,0,1,\oplus)$, if there exists a $c\in E$ such that $a\bot c$ and $a\oplus c=b$, then we say that $a\leq b$, if in addition, $a\neq b$, then we write $a<b$. It follows from [9] that $\leq$ is a partial order of $(E,0,1,\oplus)$ and satisfies that for each $a\in E$, $0\leq a\leq 1$, $a\bot b$ if and only if $a\leq b^{\prime}$. A sequential effect algebra is an effect algebra $(E,0,1,\oplus)$ and another binary operation $\circ$ defined on $(E,0,1,\oplus)$ satisfying that [8]: (SEA1). The map $b\mapsto a\circ b$ is additive for each $a\in E$, that is, if $b\bot c$, then $a\circ b\bot a\circ c$ and $a\circ(b\oplus c)=a\circ b\oplus a\circ c$. (SEA2). $1\circ a=a$ for each $a\in E$. (SEA3). If $a\circ b=0$, then $a\circ b=b\circ a$. (SEA4). If $a\circ b=b\circ a$, then $a\circ b^{\prime}=b^{\prime}\circ a$ and $a\circ(b\circ c)=(a\circ b)\circ c$ for each $c\in E$. (SEA5). If $c\circ a=a\circ c$ and $c\circ b=b\circ c$, then $c\circ(a\circ b)=(a\circ b)\circ c$ and $c\circ(a\oplus b)=(a\oplus b)\circ c$ whenever $a\bot b$. Let $(E,0,1,\oplus,\circ)$ be a sequential effect algebra. Then the operation $\circ$ is said to be a sequential product on $(E,0,1,\oplus,\circ)$. If $a,b\in(E,0,1,\oplus,\circ)$ and $a\circ b=b\circ a$, then $a$ and $b$ is said to be sequentially independent and write $a|b$ ([8]). Let $a\in(E,0,1,\oplus,\circ)$. If there exists an element $b\in(E,0,1,\oplus,\circ)$ such that $\underbrace{b\circ b\circ\cdots\circ b}\limits_{the\ number\ is\ n}=a$, then we write $b^{n}=a$ and $b$ is said to be a n-th root of $a$. Note that $b$ is a n-th root of $a$ implies that $a$ can be obtained by measuring $b$ n-times repeatedly. The sequential effect algebra is an important and interesting mathematical model for studying the quantum measurement theory [5-8]. In [10], Professor Gudder presented 25 open problems to motivate the study of sequential effect algebra theory. The 20th problem asked: Problem 1 ([10]). In a sequential effect algebra $(E,0,1,\oplus,\circ)$, if the square root of some element exists, is it unique ? Now, we can strengthen Problem 1 as following: Problem 2. For each given positive integer $n>1$, is there a sequential effect algebra $(E,0,1,\oplus,\circ)$ such that the n-th root of its some element $c$ is not unique and the n-th root of $c$ is not the k-th root of $c$ ($k<n$) ? i.e., are there $a,b\in E$, such that $a\neq b$, $a^{n}=c=b^{n}$ and $a^{k}\neq c$, $b^{k}\neq c$ for $k<n$ ? In this paper, we present an example to answer Problem 2 affirmatively. Actually, we will construct a sequential effect algebra $E_{0}$, such that there are elements $a,b,c\in E_{0}$ having the relations $a>a^{2}>\cdots>a^{n},$ $b>b^{2}>\cdots>b^{n},$ $a^{k}\neq b^{k}\ for\ k<n\ ,\ a^{n}=b^{n}=c\neq 0.$ In order to construct our example, we need some preliminary steps: Suppose $Z$ be the integer set, $n>1$ be a given positive integer. Let $p(x)=\sum\limits_{i=1}^{n-1}k_{i}x^{i}$, where $k_{i}\in Z$, $k_{i}\equiv 0$ or the first nonzero $k_{i}>0$, we denote all the polynomials characterized above by $I_{0}$ . Suppose $p_{1},p_{2}\in I_{0}$ and $p_{1}(x)=\sum\limits_{i=1}^{n-1}k_{1,i}x^{i}$ , $p_{2}(x)=\sum\limits_{i=1}^{n-1}k_{2,i}x^{i}$ , let $F(p_{1},p_{2})(x)=\sum\limits_{i+j\leq n-1}k_{1,i}k_{2,j}x^{i+j}$ , $G(p_{1},p_{2})=\sum\limits_{i+j=n}k_{1,i}k_{2,j}$ . Then it is easy to see that $F(p_{1},p_{2})\in I_{0}$ and $G(p_{1},p_{2})\in Z$ . Thus we defined mappings $F:I_{0}\times I_{0}\longrightarrow I_{0}$ and $G:I_{0}\times I_{0}\longrightarrow Z$ . Moreover, suppose $p_{1},p_{2},p_{3}\in I_{0}$ and $p_{1}(x)=\sum\limits_{i=1}^{n-1}k_{1,i}x^{i}$ , $p_{2}(x)=\sum\limits_{i=1}^{n-1}k_{2,i}x^{i}$ , $p_{3}(x)=\sum\limits_{i=1}^{n-1}k_{3,i}x^{i}$ , let $\overline{F}(p_{1},p_{2},p_{3})(x)=\sum\limits_{i+j+m\leq n-1}k_{1,i}k_{2,j}k_{3,m}x^{i+j+m}$ , $\overline{G}(p_{1},p_{2},p_{3})=\sum\limits_{i+j+m=n}k_{1,i}k_{2,j}k_{3,m}$ . Then it is also easy to see that $\overline{F}(p_{1},p_{2},p_{3})\in I_{0}$ and $\overline{G}(p_{1},p_{2},p_{3})\in Z$ . Thus we defined mappings $\overline{F}:I_{0}\times I_{0}\times I_{0}\longrightarrow I_{0}$ and $\overline{G}:I_{0}\times I_{0}\times I_{0}\longrightarrow Z$ . Lemma 1. Suppose $p,p_{1},p_{2},p_{3}\in I_{0}$, we have (1). $F(p_{1},p_{2})=F(p_{2},p_{1})$, $G(p_{1},p_{2})=G(p_{2},p_{1})$; (2). $F(p_{1},p_{2}+p_{3})=F(p_{1},p_{2})+F(p_{1},p_{3})$, $G(p_{1},p_{2}+p_{3})=G(p_{1},p_{2})+G(p_{1},p_{3})$; (3). $F(0,p)=0$, $G(0,p)=0$; (4). if $F(p_{1},p_{2})=0$, then $G(p_{1},p_{2})\geq 0$; (5). $p_{1}-F(p_{1},p_{2})\in I_{0}$, and $p_{1}=F(p_{1},p_{2})\Longleftrightarrow p_{1}=0$; (6). $F(F(p_{1},p_{2}),p_{3})=\overline{F}(p_{1},p_{2},p_{3})$, $G(F(p_{1},p_{2}),p_{3})=\overline{G}(p_{1},p_{2},p_{3})$; (7). $p_{1}+p_{2}\in I_{0}$, and $p_{1}+p_{2}=0\Longleftrightarrow p_{1}=p_{2}=0$. Proof. (1),(2),(3),(6) and (7) are trivial. (4). Except for the trivial cases, we may suppose $p_{1}(x)=\sum\limits_{i=n_{1}}^{n-1}k_{1,i}x^{i}$, $p_{2}(x)=\sum\limits_{i=n_{2}}^{n-1}k_{2,i}x^{i}$, with $k_{1,n_{1}}>0$ and $k_{2,n_{2}}>0$. Then from $F(p_{1},p_{2})=0$ we have $n_{1}+n_{2}\geq n$. If $n_{1}+n_{2}=n$, then $G(p_{1},p_{2})=k_{1,n_{1}}k_{2,n_{2}}>0$; otherwise $n_{1}+n_{2}>n$ and $G(p_{1},p_{2})=0$. (5). Except for the trivial cases, we may suppose $p_{1}(x)=\sum\limits_{i=n_{1}}^{n-1}k_{1,i}x^{i}$, $p_{2}(x)=\sum\limits_{i=n_{2}}^{n-1}k_{2,i}x^{i}$, with $k_{1,n_{1}}>0$ and $k_{2,n_{2}}>0$. Then the first item of $p_{1}-F(p_{1},p_{2})$ is $k_{1,n_{1}}x^{n_{1}}$, so $p_{1}-F(p_{1},p_{2})\in I_{0}$. If $p_{1}\neq 0$, then from the above reason we know that $p_{1}-F(p_{1},p_{2})\neq 0$. Thus, the lemma is proved. Now, we take two infinite sets $U$ and $V$ such that $U\cap V=\emptyset$. Let $f:I_{0}\times I_{0}\times Z\rightarrow U$ and $g:I_{0}\times I_{0}\times Z\rightarrow V$ be two one to one maps. Then, we construct our example as following: Let $E_{0}=\\{f(p,q,m),g(p,q,m)|p,q\in I_{0},m\in Z\ and\ satisfy\ that\ m\geq 0\ whenever\ p=q=0\\}$. First, we define a partial binary operation $\oplus$ on $E_{0}$ as follows (when we write $x\oplus y=z$, we always mean that $x\oplus y=z=y\oplus x$): (i). $f(p_{1},q_{1},m_{1})\oplus f(p_{2},q_{2},m_{2})=f(p_{1}+p_{2},q_{1}+q_{2},m_{1}+m_{2})$ (the right side is well-defined, see Lemma 1(7)); (ii). for $p_{2}-p_{1}\in I_{0}$, $q_{2}-q_{1}\in I_{0}$, and satisfy that $m_{2}\geq m_{1}$ when $p_{2}=p_{1}$ and $q_{2}=q_{1}$, $f(p_{1},q_{1},m_{1})\oplus g(p_{2},q_{2},m_{2})=g(p_{2}-p_{1},q_{2}-q_{1},m_{2}-m_{1})$ . No other $\oplus$ operation is defined. Next, we define a binary operation $\circ$ on $E_{0}$ as follows (when we write $x\circ y=z$, we always mean that $x\circ y=z=y\circ x$): (i). $f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})=f\Big{(}F(p_{1},p_{2}),F(q_{1},q_{2}),G(p_{1},p_{2})+G(q_{1},q_{2})\Big{)}$ (the right side is well-defined, see Lemma 1(4)); (ii). $f(p_{1},q_{1},m_{1})\circ g(p_{2},q_{2},m_{2})=f\Big{(}p_{1}-F(p_{1},p_{2}),q_{1}-F(q_{1},q_{2}),m_{1}-G(p_{1},p_{2})-G(q_{1},q_{2})\Big{)}$ (the right side is well-defined, see Lemma 1(3), (5)); (iii). $g(p_{1},q_{1},m_{1})\circ g(p_{2},q_{2},m_{2})=g\Big{(}p_{1}+p_{2}-F(p_{1},p_{2}),q_{1}+q_{2}-F(q_{1},q_{2}),m_{1}+m_{2}-G(p_{1},p_{2})-G(q_{1},q_{2})\Big{)}$ (the right side is well-defined, see Lemma 1(3), (5), (7)). We denote $f(0,0,0)$ by $0$, $g(0,0,0)$ by $1$. Proposition 1. $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. Proof. In the proof below, we will use Lemma 1 frequently without annotation. First, we verify that $(E_{0},0,1,\oplus)$ is an effect algebra. (EA1) is obvious. We verify (EA2) as follows: (i). $f(p_{1},q_{1},m_{1})\oplus\Big{(}f(p_{2},q_{2},m_{2})\oplus f(p_{3},q_{3},m_{3})\Big{)}=\Big{(}f(p_{1},q_{1},m_{1})\oplus f(p_{2},q_{2},m_{2})\Big{)}\oplus f(p_{3},q_{3},m_{3})=f(p_{1}+p_{2}+p_{3},q_{1}+q_{2}+q_{3},m_{1}+m_{2}+m_{3})$; (ii). $f(p_{1},q_{1},m_{1})\oplus\Big{(}f(p_{2},q_{2},m_{2})\oplus g(p_{3},q_{3},m_{3})\Big{)}$ or $\Big{(}f(p_{1},q_{1},m_{1})\oplus f(p_{2},q_{2},m_{2})\Big{)}\oplus g(p_{3},q_{3},m_{3})$ is defined iff $p_{3}-p_{1}-p_{2}\in I_{0}$, $q_{3}-q_{1}-q_{2}\in I_{0}$ and satisfy that $m_{3}\geq m_{1}+m_{2}$ when $p_{3}=p_{1}+p_{2}$ and $q_{3}=q_{1}+q_{2}$, at this point, they all equal to $g(p_{3}-p_{1}-p_{2},q_{3}-q_{1}-q_{2},m_{3}-m_{1}-m_{2})$. Note that $f(p,q,m)\oplus g(p,q,m)=g(0,0,0)=1$, we verified (EA3). For (EA4), we note from our construction that the unique element orthogonal to $g(0,0,0)(=1)$ is $f(0,0,0)(=0)$, that is, $f(0,0,0)\bot g(0,0,0)$ and $f(0,0,0)\oplus g(0,0,0)=g(0,0,0)$. So far, we have proved that $(E_{0},0,1,\oplus)$ is an effect algebra. Next, we verify that $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra. (SEA3) and (SEA5) are obvious. We verify (SEA1) as follows: (i). $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\oplus f(p_{3},q_{3},m_{3})\Big{)}=f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\oplus f(p_{1},q_{1},m_{1})\circ f(p_{3},q_{3},m_{3})=f\Big{(}F(p_{1},p_{2}+p_{3}),F(q_{1},q_{2}+q_{3}),G(p_{1},p_{2}+p_{3})+G(q_{1},q_{2}+q_{3})\Big{)}$, $g(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\oplus f(p_{3},q_{3},m_{3})\Big{)}=g(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\oplus g(p_{1},q_{1},m_{1})\circ f(p_{3},q_{3},m_{3})=f\Big{(}p_{2}+p_{3}-F(p_{1},p_{2}+p_{3}),q_{2}+q_{3}-F(q_{1},q_{2}+q_{3}),m_{2}+m_{3}-G(p_{1},p_{2}+p_{3})-G(q_{1},q_{2}+q_{3})\Big{)}$; (ii). when $f(p_{2},q_{2},m_{2})\oplus g(p_{3},q_{3},m_{3})$ is defined, i.e., when $p_{3}-p_{2}\in I_{0}$, $q_{3}-q_{2}\in I_{0}$, and satisfy that $m_{3}\geq m_{2}$ if $p_{3}=p_{2}$ and $q_{3}=q_{2}$ , $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\oplus g(p_{3},q_{3},m_{3})\Big{)}=f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\oplus f(p_{1},q_{1},m_{1})\circ g(p_{3},q_{3},m_{3})=f\Big{(}p_{1}-F(p_{1},p_{3}-p_{2}),q_{1}-F(q_{1},q_{3}-q_{2}),m_{1}-G(p_{1},p_{3}-p_{2})-G(q_{1},q_{3}-q_{2})\Big{)}$, $g(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\oplus g(p_{3},q_{3},m_{3})\Big{)}=g(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\oplus g(p_{1},q_{1},m_{1})\circ g(p_{3},q_{3},m_{3})=g\Big{(}p_{1}+p_{3}-p_{2}-F(p_{1},p_{3}-p_{2}),q_{1}+q_{3}-q_{2}-F(q_{1},q_{3}-q_{2}),m_{1}+m_{3}-m_{2}-G(p_{1},p_{3}-p_{2})-G(q_{1},q_{3}-q_{2})\Big{)}$. We verify (SEA2) as follows: $1\circ f(p,q,m)=g(0,0,0)\circ f(p,q,m)=f(p,q,m);$ $1\circ g(p,q,m)=g(0,0,0)\circ g(p,q,m)=g(p,q,m).$ We verify (SEA4) as follows: (i). $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\circ f(p_{3},q_{3},m_{3})\Big{)}$ $=f(p_{1},q_{1},m_{1})\circ f\Big{(}F(p_{2},p_{3}),F(q_{2},q_{3}),G(p_{2},p_{3})+G(q_{2},q_{3})\Big{)}$ $=f\Big{(}F(p_{1},F(p_{2},p_{3})),F(q_{1},F(q_{2},q_{3})),G(p_{1},F(p_{2},p_{3}))+G(q_{1},F(q_{2},q_{3}))\Big{)}$ $=f\Big{(}\overline{F}(p_{1},p_{2},p_{3}),\overline{F}(q_{1},q_{2},q_{3}),\overline{G}(p_{1},p_{2},p_{3})+\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, by symmetry, $\Big{(}f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\Big{)}\circ f(p_{3},q_{3},m_{3})$ $=f(p_{3},q_{3},m_{3})\circ\Big{(}f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\Big{)}$ $=f\Big{(}\overline{F}(p_{1},p_{2},p_{3}),\overline{F}(q_{1},q_{2},q_{3}),\overline{G}(p_{1},p_{2},p_{3})+\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, so we have $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\circ f(p_{3},q_{3},m_{3})\Big{)}=\Big{(}f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\Big{)}\circ f(p_{3},q_{3},m_{3})$. (ii). $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}$ $=f(p_{1},q_{1},m_{1})\circ f\Big{(}p_{2}-F(p_{2},p_{3}),q_{2}-F(q_{2},q_{3}),m_{2}-G(p_{2},p_{3})-G(q_{2},q_{3})\Big{)}$ $=f\Big{(}F(p_{1},p_{2}-F(p_{2},p_{3})),F(q_{1},q_{2}-F(q_{2},q_{3})),G(p_{1},p_{2}-F(p_{2},p_{3}))+G(q_{1},q_{2}-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}F(q_{2},q_{3}))\Big{)}$ $=f\Big{(}F(p_{1},p_{2})-F(p_{1},F(p_{2},p_{3})),F(q_{1},q_{2})-F(q_{1},F(q_{2},q_{3})),G(p_{1},p_{2})-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(p_{1},F(p_{2},p_{3}))+G(q_{1},q_{2})-G(q_{1},F(q_{2},q_{3}))\Big{)}$ $=f\Big{(}F(p_{1},p_{2})-\overline{F}(p_{1},p_{2},p_{3}),F(q_{1},q_{2})-\overline{F}(q_{1},q_{2},q_{3}),G(p_{1},p_{2})-\overline{G}(p_{1},p_{2},p_{3})+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(q_{1},q_{2})-\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, $\Big{(}f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$ $=f\Big{(}F(p_{1},p_{2}),F(q_{1},q_{2}),G(p_{1},p_{2})+G(q_{1},q_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$ $=f\Big{(}F(p_{1},p_{2})-F(F(p_{1},p_{2}),p_{3}),F(q_{1},q_{2})-F(F(q_{1},q_{2}),q_{3}),G(p_{1},p_{2})+G(q_{1},q_{2})-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(F(p_{1},p_{2}),p_{3})-G(F(q_{1},q_{2}),q_{3})\Big{)}$ $=f\Big{(}F(p_{1},p_{2})-\overline{F}(p_{1},p_{2},p_{3}),F(q_{1},q_{2})-\overline{F}(q_{1},q_{2},q_{3}),G(p_{1},p_{2})-\overline{G}(p_{1},p_{2},p_{3})+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(q_{1},q_{2})-\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, so we have $f(p_{1},q_{1},m_{1})\circ\Big{(}f(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}=\Big{(}f(p_{1},q_{1},m_{1})\circ f(p_{2},q_{2},m_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$ . (iii). $f(p_{1},q_{1},m_{1})\circ\Big{(}g(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}$ $=f(p_{1},q_{1},m_{1})\circ g\Big{(}p_{2}+p_{3}-F(p_{2},p_{3}),q_{2}+q_{3}-F(q_{2},q_{3}),m_{2}+m_{3}-G(p_{2},p_{3})-G(q_{2},q_{3})\Big{)}$ $=f\Big{(}p_{1}-F(p_{1},p_{2}+p_{3}-F(p_{2},p_{3})),q_{1}-F(q_{1},q_{2}+q_{3}-F(q_{2},q_{3})),m_{1}-G(p_{1},p_{2}+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}p_{3}-F(p_{2},p_{3}))-G(q_{1},q_{2}+q_{3}-F(q_{2},q_{3}))\Big{)}$ $=f\Big{(}p_{1}-F(p_{1},p_{2}+p_{3})+\overline{F}(p_{1},p_{2},p_{3}),q_{1}-F(q_{1},q_{2}+q_{3})+\overline{F}(q_{1},q_{2},q_{3}),m_{1}-G(p_{1},p_{2}+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}p_{3})+\overline{G}(p_{1},p_{2},p_{3})-G(q_{1},q_{2}+q_{3})+\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, $\Big{(}f(p_{1},q_{1},m_{1})\circ g(p_{2},q_{2},m_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$ $=f\Big{(}p_{1}-F(p_{1},p_{2}),q_{1}-F(q_{1},q_{2}),m_{1}-G(p_{1},p_{2})-G(q_{1},q_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$ $=f\Big{(}p_{1}-F(p_{1},p_{2})-F(p_{1}-F(p_{1},p_{2}),p_{3}),q_{1}-F(q_{1},q_{2})-F(q_{1}-F(q_{1},q_{2}),q_{3}),m_{1}-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(p_{1},p_{2})-G(q_{1},q_{2})-G(p_{1}-F(p_{1},p_{2}),p_{3})-G(q_{1}-F(q_{1},q_{2}),q_{3})\Big{)}$ $=f\Big{(}p_{1}-F(p_{1},p_{2}+p_{3})+\overline{F}(p_{1},p_{2},p_{3}),q_{1}-F(q_{1},q_{2}+q_{3})+\overline{F}(q_{1},q_{2},q_{3}),m_{1}-G(p_{1},p_{2}+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}p_{3})+\overline{G}(p_{1},p_{2},p_{3})-G(q_{1},q_{2}+q_{3})+\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, so we have $f(p_{1},q_{1},m_{1})\circ\Big{(}g(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}=\Big{(}f(p_{1},q_{1},m_{1})\circ g(p_{2},q_{2},m_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$. (iv). $g(p_{1},q_{1},m_{1})\circ\Big{(}g(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}$ $=g(p_{1},q_{1},m_{1})\circ g\Big{(}p_{2}+p_{3}-F(p_{2},p_{3}),q_{2}+q_{3}-F(q_{2},q_{3}),m_{2}+m_{3}-G(p_{2},p_{3})-G(q_{2},q_{3})\Big{)}$ $=g\Big{(}p_{1}+p_{2}+p_{3}-F(p_{2},p_{3})-F(p_{1},p_{2}+p_{3}-F(p_{2},p_{3})),q_{1}+q_{2}+q_{3}-F(q_{2},q_{3})-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}F(q_{1},q_{2}+q_{3}-F(q_{2},q_{3})),m_{1}+m_{2}+m_{3}-G(p_{2},p_{3})-G(q_{2},q_{3})-G(p_{1},p_{2}+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}p_{3}-F(p_{2},p_{3}))-G(q_{1},q_{2}+q_{3}-F(q_{2},q_{3}))\Big{)}$ $=g\Big{(}p_{1}+p_{2}+p_{3}-F(p_{2},p_{3})-F(p_{1},p_{2})-F(p_{1},p_{3})+\overline{F}(p_{1},p_{2},p_{3}),q_{1}+q_{2}+q_{3}-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}F(q_{2},q_{3})-F(q_{1},q_{2})-F(q_{1},q_{3})+\overline{F}(q_{1},q_{2},q_{3}),m_{1}+m_{2}+m_{3}-G(p_{2},p_{3})-\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}G(p_{1},p_{2})-G(p_{1},p_{3})+\overline{G}(p_{1},p_{2},p_{3})-G(q_{2},q_{3})-G(q_{1},q_{2})-G(q_{1},q_{3})+\linebreak~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}\overline{G}(q_{1},q_{2},q_{3})\Big{)}$, by symmetry, we have $g(p_{1},q_{1},m_{1})\circ\Big{(}g(p_{2},q_{2},m_{2})\circ g(p_{3},q_{3},m_{3})\Big{)}=\Big{(}g(p_{1},q_{1},m_{1})\circ g(p_{2},q_{2},m_{2})\Big{)}\circ g(p_{3},q_{3},m_{3})$. Thus, we proved that $(E_{0},0,1,\oplus,\circ)$ is a sequential effect algebra and the theorem is proved. Now, let $P_{i}(x)=x^{i}$. Then it is easy to see that $F(P_{1},P_{j})=\left\\{\begin{array}[]{ll}P_{1+j}\ ,&\hbox{$if\ j<n-1$;}\\\ 0\ ,&\hbox{$if\ j=n-1$.}\end{array}\right.~{}and~{}~{}G(P_{1},P_{j})=\left\\{\begin{array}[]{ll}0\ ,&\hbox{$if\ j<n-1$;}\\\ 1\ ,&\hbox{$if\ j=n-1$.}\end{array}\right.$ Thus we have $[f(P_{1},0,0)]^{k}=f(P_{1},0,0)\circ f(P_{k-1},0,0)=f(P_{k},0,0)$ for $k<n$, $[f(P_{1},0,0)]^{n}=f(P_{1},0,0)\circ f(P_{n-1},0,0)=f(0,0,1)$, $[f(P_{1},0,0)]^{n+1}=f(P_{1},0,0)\circ f(0,0,1)=0$, and $[f(0,P_{1},0)]^{k}=f(0,P_{1},0)\circ f(0,P_{k-1},0)=f(0,P_{k},0)$ for $k<n$, $[f(0,P_{1},0)]^{n}=f(0,P_{1},0)\circ f(0,P_{n-1},0)=f(0,0,1)$, $[f(0,P_{1},0)]^{n+1}=f(0,P_{1},0)\circ f(0,0,1)=0$. If we denote $f(P_{1},0,0)$ by $a$, $f(0,P_{1},0)$ by $b$, $f(0,0,1)$ by $c$, then it is easy to get the relations $a>a^{2}>\cdots>a^{n}>a^{n+1},$ $b>b^{2}>\cdots>b^{n}>b^{n+1},$ $a^{k}\neq b^{k}\ for\ k<n\ ,\ a^{n}=b^{n}=c\neq 0\ and\ a^{n+1}=b^{n+1}=0.$ That is, $a,b$ are the n-th root of $c$, but $a,b$ are not the k-th root of $c$, where $k=2,3,\cdots,n-1$, moreover, $a,b$ are also the n+1-th root of $0$, so, the Problem 2 is answered affirmatively. Finally, we would like to point out that for the advances of sequential effect algebras, see [11-16]. Acknowledgement The authors wish to express their thanks to the referee for his valuable comments and suggestions. References [1]. Ludwig, G. Foundations of Quantum Mechanics (I-II), Springer, New York, 1983. [2]. Ludwig, G. An Axiomatic Basis for Quantum Mechanics (II), Springer, New York, 1986. [3]. Davies, E. B. Quantum Theory of Open Systems, Academic Press, London, 1976. [4]. Busch, P, Grabowski, M and Lahti P. J, Operational Quantum Physics, Springer-Verlag, Beijing Word Publishing Corporation, 1999. [5]. Gudder, S, Nagy, G. Sequential quantum measurements. J. Math. Phys. 42(2001), 5212-5222. [6]. Gheondea, A, Gudder, S. Sequential product of quantum effects. Proc. Amer. Math. Soc. 132 (2004), 503-512. [7]. Gudder, S, Latr moli re, F. Characterization of the sequential product on quantum effects. J. Math. Phys. 49 (2008), 052106-052112. [8]. Gudder, S, Greechie, R. Sequential products on effect algebras. Rep. Math. Phys. 49(2002), 87-111. [9]. Foulis, D J, Bennett, M K. Effect algebras and unsharp quantum logics. Found Phys 24 (1994), 1331-1352. [10]. Gudder, S. Open problems for sequential effect algebras. Inter. J. Theory. Physi. 44 (2005), 2219-2230. [11] Shen Jun and Wu Junde. Not each sequential effect algebra is sharply dominating. Phys. Letter A. 373, 1708-1712, (2009) [12] Shen Jun and Wu Junde. Remarks on the sequential effect algebras. Report. Math. Phys. 63, 441-446, (2009) [13] Shen Jun and Wu Junde. Sequential product on standard effect algebra ${\cal E}(H)$. J. Phys. A: Math. Theor. 44, 345203-345214, (2009) [14] Shen Jun and Wu Junde. The Average Value Inequality in Sequential Effect Algebras. Acta Math. Sinica, English Series. 25, 1330-1336, (2009) [15] Liu Weihua and Wu Junde. A uniqueness problem of the sequence product on operator effect algebra ${\cal E}(H)$. J. Phys. A: Math. Theor. 42, 185206-185215, (2009) [16] Liu Weihua and Wu Junde. On fixed points of Lüders operation. J. Math. Phys. 50, 103531-103532, (2009)
arxiv-papers
2009-03-30T03:40:45
2024-09-04T02:49:01.520375
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Shen Jun and Wu Junde", "submitter": "Junde Wu", "url": "https://arxiv.org/abs/0903.5120" }
0903.5376
# Lifshitz tails for the Interband Light Absorption Coefficient W Kirsch Facultät für Mathematik und Informatik Fern Universität in Hagen 58084 Hagen, Germany and M Krishna Institute of Mathematical Sciences Taramani, Chennai 600113, India (31 March 2009) ###### Abstract In this paper we consider the Interband Light Absorption Coefficient for various models. We show that at the lower and upper edges of the spectrum the Lifshitz tails behaviour of the density of states implies similar behaviour for the ILAC at appropriate energies. The Lifshitz tails property is also exhibited at some points corresponding to the internal band edges of the density of states. ## 1 Introduction In this work we look for Lifshitz tails behaviour of the Interband Light Absorption Coefficient (ILAC) defined in equation (eqnl4). The standard definition of the ILAC involves considering a pair of operators of the form $H_{\omega}^{\pm}=\Delta\pm V^{\omega}$, with $\Delta$ the Laplacian on either $\ell^{2}(\mathbb{Z}^{d})$, in the discrete case or on $L^{2}(\mathbb{R}^{d})$ in the continuous case, and taking a random potential $V^{\omega}$. Restricting these operators $H_{\omega}^{\pm}$ to boxes $\Lambda$ gives operators with discrete spectra so that in any finite region of energy these operators have only finitely many eigenvalues. Using this fact one can define the quantity $\frac{1}{Vol(\Lambda)}\sum_{\lambda_{\omega}^{-}+\lambda_{\omega}^{+}\leq E}|\langle\phi_{\omega,\lambda_{\omega}^{-}},\psi_{\omega,\lambda_{\omega}^{+}}\rangle|^{2}$ where $\phi_{\omega,\lambda_{\omega}^{-}},\psi_{\omega,\lambda_{\omega}^{+}}$ are the eigen functions of the operators $H_{\omega}^{\mp}$ restricted to the box $\Lambda$, corresponding to the eigenvalues $\lambda_{\omega}^{-},\lambda_{\omega}^{+}$ respectively. The limit of the above quantity, when it exits, gives the ILAC. We consider a correlation measure (mentioned also in [12]) $\rho$ and identify the ILAC as the distribution function of a marginal of the measure $\rho$ in a diagonal direction. This identification enables us to prove theorems on the Lifshitz tails behaviour of the ILAC more easily since it involves only comparing the marginal of $\rho$ with the density of states of either of the operators $H_{\omega}^{\pm}$. We also do not need to approximate to define the ILAC, but can obtain the function directly. In the next section, we present an abstract version of the correlation measure $\rho$ and the density of states $n$ for a pair of random covariant operators and obtain relations between the two. ## 2 General Covariant Operators We start with a definition of a random family of self adjoint operators which are covariant under a group action. ###### Hypotheses 1. 1. 1. $\mathcal{H}$ is a (separable, complex) Hilbert space, $(\Omega,\mathcal{F},\mathbb{P})$ a probability space. 2. 2. There is a locally compact abelian group $G$ and $\\{U_{x}\\}_{x\in G}$ is a group of unitary operators on $\mathcal{H}$, i.e. the $U_{x}$ are unitary and $U_{x+y}=U_{x}\,U_{y}$, $U_{0}=\textnormal{Id}$, $U_{-x}=U_{x}^{-1}=U_{x}^{*}$ 3. 3. There is a discrete subgroup $L$ of $G$ and an orthogonal projection $P$ on $\mathcal{H}$ such that $\\{U_{n}^{*}PU_{n}\\}_{n\in L}$, $\\{U_{n}PU_{n}^{*}\\}_{n\in L}$ are orthogonal partitions of unity on $\mathcal{H}$. We set $P_{n}=U_{n}^{*}PU_{n},\tilde{P}_{n}=U_{n}PU_{n}^{*}.$ 4. 4. $\\{T_{n}\\}_{n\in L}$ is a group of probability preserving transformations on $\Omega$. ###### Definition 1. A family $\\{A_{\omega}\\}_{\omega\in\Omega}$ of self-adjoint operators on $\mathcal{H}$ is called measurable if the family $\\{(A_{\omega}+i)^{-1}\\}_{\omega\in\Omega}$ is measurable It is known (see [3], [2] and section 2.4 of [25]) that a family of _bounded_ self-adjoint operators is measurable iff it’s weakly measurable. Moreover, if $\\{A_{\omega}\\}$ is a measurable family of self-adjoint operators then for any bounded measurable function $f$ the operator family $f(A_{\omega})$ is weakly measurable. (also in [3], [2], section 2.4 [25]). Finally, the product of weakly measurable families is weakly measurable (see [2]). ###### Definition 2. A weakly measurable family $A_{\omega}$ of bounded operators is called _covariant_ (with respect to $U_{x},T_{x}$) if $A_{T_{x}\omega}=U_{x}^{*}\,A_{\omega}\,U_{x}\qquad\textnormal{for all $x\in G$}$ Also, a measurable family $A_{\omega}$ of self adjoint operators is called _covariant_ (with respect to $U_{x},T_{x}$) if $A_{T_{x}\omega}=U_{x}^{*}\,A_{\omega}\,U_{x}\qquad\textnormal{for all $x\in G$}$ If $A_{\omega}$ is a covariant family of self-adjoint operators and $f$ is a bounded measurable function, then the family $f(A_{\omega})$ is covariant (also in [3], [2]). Moreover, if both $A_{\omega}$ and $B_{\omega}$ are covariant families of bounded operators, then $A_{\omega}\,B_{\omega}$ is a covariant family. We denote by $\|B\|_{1}$ the trace norm of a trace class operator $B$. ###### Proposition 1. Let $A_{\omega}$ and $B_{\omega}$ be covariant families of bounded operators and assume that $A_{\omega}P$ and $B_{\omega}P$ are trace class and $\mathbb{E}(\|A_{\omega}P\|_{1})<\infty\leavevmode\nobreak\ \mathrm{and}\leavevmode\nobreak\ \mathbb{E}(\|B_{\omega}P\|_{1})<\infty.$ (1) Then: $\mathbb{E}(Tr(PA_{\omega}B_{\omega}P))\leavevmode\nobreak\ =\leavevmode\nobreak\ \mathbb{E}(Tr(PB_{\omega}A_{\omega}P))$ (2) ###### Proof. $\displaystyle Tr(PA_{\omega}B_{\omega}P)\leavevmode\nobreak\ $ $\displaystyle=\leavevmode\nobreak\ Tr(PA_{\omega}B_{\omega}P)$ (3) $\displaystyle=\leavevmode\nobreak\ \sum_{n}\;Tr(PA_{\omega}P_{n}B_{\omega}P)$ (4) since $P_{n}$ is a partition of unity of orthogonal projections. $\displaystyle=\leavevmode\nobreak\ \sum_{n}\;Tr(P_{n}B_{\omega}PA_{\omega}P_{n})$ (5) using the $Tr(AB)=Tr(BA)$ and the invariance of trace $Tr(U^{*}CU)=Tr(C)$, $\displaystyle=\leavevmode\nobreak\ \sum_{n}\;Tr(PA_{T_{n}^{-1}\omega}\tilde{P}_{n}B_{T_{n}^{-1}\omega}P)$ (6) from the covariance of $A_{\omega}$ and $B_{\omega}$ $\displaystyle=\leavevmode\nobreak\ Tr(PB_{T_{n}^{-1}\omega}A_{T_{n}^{-1}\omega}P)\rangle$ (7) In the last step we used the fact that $\tilde{P}_{n}$ is a partition of unity also. Now we take expectations of either side of the above equation and obtain $\displaystyle\mathbb{E}(Tr(PA_{\omega}B_{\omega}P)\leavevmode\nobreak\ $ $\displaystyle=\leavevmode\nobreak\ \mathbb{E}(\sum_{n}\;Tr(PB_{T_{n}^{-1}\omega}\tilde{P}_{n}A_{T_{n}^{-1}\omega}P))$ (8) $\displaystyle=\leavevmode\nobreak\ \sum_{n}\;\mathbb{E}(Tr(PB_{T_{n}^{-1}\omega}\tilde{P}_{n}A_{T_{n}^{-1}\omega}P))$ (9) We have used Fubini’s theorem to interchange expectation and sum, allowed because of (2) $\displaystyle=\leavevmode\nobreak\ \sum_{n}\;\mathbb{E}(Tr(PB_{\omega}\tilde{P}_{n}A_{\omega}P))$ (10) since $T_{n}^{-1}$ is probability preserving $\displaystyle=\leavevmode\nobreak\ \mathbb{E}(\sum_{n}\;Tr(PB_{\omega}\tilde{P}_{n}A_{\omega}P))$ (11) $\tilde{P}_{n}$ is a partition of unity. $\displaystyle=\leavevmode\nobreak\ \mathbb{E}(Tr(B_{\omega}A_{\omega}P))\leavevmode\nobreak\ =\leavevmode\nobreak\ \mathbb{E}(Tr(PB_{\omega}A_{\omega}P))$ (12) ∎ ###### Corollary 2. 1. 1. If $A_{\omega},B_{\omega},C_{\omega}$ are covariant families of bounded operators satisfying the condition (1) then: $\mathbb{E}(Tr(PA_{\omega}B_{\omega}C_{\omega}P))\leavevmode\nobreak\ =\leavevmode\nobreak\ \mathbb{E}(Tr(PC_{\omega}A_{\omega}B_{\omega}P))$ (13) 2. 2. If $A_{\omega},B_{\omega}$ are covariant families of bounded, positive (i.e. $\geq 0$) operators satisfying the conditions (1) then $\mathbb{E}(TrPA_{\omega}B_{\omega}P))\leavevmode\nobreak\ \geq\leavevmode\nobreak\ 0$ (14) ###### Proof. The first assertion is clear as we can apply the proposition to the covariant families $A_{\omega}B_{\omega}$ and $C_{\omega}$. For the second claim we observe that $B_{\omega}=C_{\omega}C_{\omega}$ with a $C_{\omega}=\sqrt{B_{\omega}}$. $C_{\omega}$ as a function of the covariant family $B_{\omega}$ is covariant as well. Moreover, since $A_{\omega}$ is positive (and the Hilbert space is complex), $A_{\omega}$ is self-adjoint and so is $C_{\omega}$. By part (i) of the corollary we have: $\displaystyle\mathbb{E}(Tr(PA_{\omega}B_{\omega}P))\leavevmode\nobreak\ $ $\displaystyle=\leavevmode\nobreak\ \mathbb{E}(PA_{\omega}C_{\omega}C_{\omega}P))$ (15) $\displaystyle=\leavevmode\nobreak\ \mathbb{E}(Tr(PC_{\omega}A_{\omega}C_{\omega}P))$ (16) $\displaystyle\geq\leavevmode\nobreak\ 0\qquad\textnormal{since $A_{\omega}$ is positive}$ (17) ∎ ###### Hypotheses 2. Let $H_{\omega}$ be family of self-adjoint operators, which are bounded below, on a Hilbert space $\mathcal{H}$. Let $E_{{}_{H_{\omega}}}(\cdot)$ be the (projection-valued) spectral measure of $H_{\omega}$ such that for any bounded borel set $A$, the operators $PE_{{}_{H_{\omega}}}(A),E_{{}_{H_{\omega}}}(A)P$ are trace class for a.e. $\omega$ and form a covariant family of operators. For operators $H_{\omega}$ satisfying the above hypothesis, it is clear that for any finite $x$, the spectral measure $E_{{}_{H_{\omega}}}((-\infty,x])=E_{{}_{H_{\omega}}}([c,x])$, with $c$ finite and smaller than the infimum of the spectrum of $H_{\omega}$. Therefore the hypothesis implies that for any finite $x$, the operators $PE_{{}_{H_{\omega}}}((-\infty,x]),E_{{}_{H_{\omega}}}((-\infty,x])P$ are trace class. Therefore we can now define the density of states for such operators. ###### Definition 3. Let $H_{\omega}$ be a family of self adjoint operators satisfying Hypothesis 2. Then the _density of states_ of this family is defined to be the unique $\sigma$-finite measure $n$ associated with the monotone right continuous function $F$, $F(x)=\mathbb{E}\left(Tr(PE_{{}_{H_{\omega}}}((-\infty,x])P)\right),$ via $n((a,b])=F(b)-F(a),\leavevmode\nobreak\ a,b\in\mathbb{R}.$ Thus for any bounded borel set $A$, $n(A)$ agrees with the right hand side of the above relation with $A$ replacing $(-\infty,x]$. In the above framework we define another measure that is used to define the Interband Light Absorption Coefficient (ILAC). To do this we need a pair $H_{\omega}^{\pm}$ of self-adjoint operators as in the Hypothesis 2 and consider the associated projection valued measures $E_{H_{\omega}^{\pm}}(\cdot)$. We then define the density of states of these operators by, $n_{\pm}(A)=\mathbb{E}\left(Tr(PE_{H_{\omega}^{\pm}}(A)P)\right).$ (18) Consider the semi algebra $\mathcal{I}\times\mathcal{I}$ of subsets of $\mathbb{R}^{2}$ where $\mathcal{I}=\mathbb{R}\cup\\{(a,b]:a,b\in\mathbb{R}\\}\cup\\{(a,\infty):a\in\mathbb{R}\\}\cup\\{(-\infty,a]:a\in\mathbb{R}\\}.$ We define the correlation measure $\rho$ on $\mathcal{I}\times\mathcal{I}$ as $\rho(A\times B)=\mathbb{E}\left(Tr(PE_{H_{\omega}^{+}}(A)E_{H_{\omega}^{-}}(B)P)\right),$ (19) where $\rho$ is set to be $\infty$ if either $A$ or $B$ is an unbounded element of $\mathcal{I}$. This set function takes values in $[0,1]$ if $P$ is trace class and in $[0,\infty]$, if $PE_{H_{\omega}^{\pm}((a,b])}$ are trace class only for bounded intervals $(a,b]$, in view of Proposition 3. We set $\rho(A)=\sum_{i=1}^{\infty}\rho(A_{i}\times B_{i}),\leavevmode\nobreak\ \mathrm{if}\leavevmode\nobreak\ A=\sqcup_{i=1}^{\infty}A_{i},A_{i}\in\mathcal{I}.$ It is a simple exercise to see that this $\rho$ is well defined on $\mathcal{I}\times\mathcal{I}$ and via standard measure theory extends as a $\sigma$-finite measure to the whole borel $\sigma$-algebra of $\mathbb{R}^{2}$.. Using the Hypothesis 2, and Proposition 1 we see that the following is valid. ###### Proposition 3. Consider the operators $H_{\omega}^{\pm}$ satisfying Hypothesis 2 and let $n_{\pm}$ and $\rho$ be as in equation (19). Then for any $B,C\in\mathcal{I}$ bounded, 1. 1. $\rho(B\times C)=\mathbb{E}\left(Tr(PE_{H_{\omega}^{-}}(C)E_{H_{\omega}^{+}}(B)E_{H_{\omega}^{-}}(C)P)\right)$ 2. 2. $\rho(B\times C)=\mathbb{E}\left(Tr(PE_{H_{\omega}^{+}}(B)E_{H_{\omega}^{-}}(C)E_{H_{\omega}^{+}}(B)P)\right)$ 3. 3. The following inequalities are valid $\rho(B\times C)\leq n_{+}(B),\leavevmode\nobreak\ \rho(B\times C)\leq n_{-}(C).$ Proof: Since the subsets $B,C$ are bounded the operators $PE_{H_{\omega}^{-}}(C),PE_{H_{\omega}^{+}}(B)$ are covariant trace class operators satisfying the inequality (1). Therefore the result follows by an application of Proposition 1 and Corollary 2. ∎ We collect the arguments about $\rho$ in a proposition. ###### Proposition 4. Consider a pair of covariant operators $H_{\omega}^{\pm}$ satisfying the Hypothesis 2 and consider the correlation measures $\rho$ extended to the borel $\sigma$-algebra on $\mathbb{R}^{2}$ from that given by equation (19). Then the following are valid. 1. 1. If $P$ is trace class, then $\rho$ is a probability measure on $\mathbb{R}^{2}$, with support in the closure of $\cup_{\omega}\sigma(H_{\omega}^{+})\times\sigma(H_{\omega}^{-})$. 2. 2. If $P$ is not trace class but, $PE_{H_{\omega}^{\pm}}((a,b])P$ is trace class, for bounded intervals $(a,b]$, then $\rho$ is a positive $\sigma$-finite measure on $\mathbb{R}^{2}$, with support in the closure of $\cup_{\omega}\sigma(H_{\omega}^{+})\times\sigma(H_{\omega}^{-})$. ###### Remark 5. Typically the first case occurs for operators on $\ell^{2}(\mathbb{Z}^{d})$ and the second case occurs in $L^{2}(\mathbb{R}^{d})$. We take the transformation $T$ on $\mathbb{R}^{2}$ given by $T\left(\begin{matrix}\lambda_{1}\\\ \lambda_{2}\end{matrix}\right)=\left(\begin{matrix}\frac{\lambda_{1}+\lambda_{2}}{\sqrt{2}}\\\ \frac{\lambda_{1}-\lambda_{2}}{\sqrt{2}}\end{matrix}\right).$ Using this $T$ we define the Interband Light Absorption Coefficient (ILAC) $A$ as the distribution function, $A(\lambda)-A(\lambda^{\prime})=\nu\left(\frac{1}{\sqrt{2}}(\lambda^{\prime},\lambda]\right),\leavevmode\nobreak\ \mathrm{where}\leavevmode\nobreak\ \nu(B)=\rho\circ T^{-1}(B\times\mathbb{R})$ (20) In the above equation the factor $\frac{1}{\sqrt{2}}$ is because of the normalisation we used for $T$, so that this definition of ILAC agrees with the standard one in the case of finite box operators. We also note that since the operators $H_{\omega}^{\pm}$ are assumed to be bounded below $A(-\infty)=0$. In the case when $\mathbb{P}$ in Hypothesis 1 is ergodic with respect to the action of $G$ on $\Omega$, then, the spectra $\sigma(H_{\omega}^{\pm})$ of covariant families of operators $H_{\omega}^{\pm}$ are almost everywhere constant sets. In such a case we can talk about the infimum of spectra of $H_{\omega}^{\pm}$ without reference to $\omega$. In this context we have the following theorem. ###### Theorem 2.1. Suppose $H_{\omega}^{\pm}$ are a pair of random families of self-adjoint operators satisfying Hypothesis 1. Assume further that $\mathbb{P}$ is ergodic with respect to the action of $G$ on $\Omega$. 1. 1. Let $E_{\pm}=\inf\sigma(H_{\omega}^{\pm})$. Then $A(E_{+}+E_{-}+a)-A(E_{+}+E_{-}-a)\leq n_{\pm}((E_{\pm}-2a,E_{\pm}+2a)),\leavevmode\nobreak\ a>0$. 2. 2. Let $E_{\pm}^{\prime}=\sup\sigma(H_{\omega}^{\pm})$. Then $A(E_{+}^{\prime}+E_{-}^{\prime}+a)-A(E_{+}^{\prime}+E_{-}^{\prime}-a)\leq n_{\pm}((E_{\pm}^{\prime}-2a,E_{\pm}^{\prime}+2a)),\leavevmode\nobreak\ a>0$. Proof: We shall prove the first case, the other proof is similar (where one has to use the fact that $\lambda_{1}\leq E_{+}^{\prime},\lambda_{2}\leq E_{-}^{\prime}$ respectively for the other case and work it out). Let $E_{+},E_{-}$ to be the infima of the spectra $\sigma(H_{\omega}^{+}),\sigma(H_{\omega}^{-})$ of $H_{\omega}^{+},H_{\omega}^{-}$. We consider the closure of the Cartesian product $\Sigma=\sigma(H_{\omega}^{+})\times\sigma(H_{\omega}^{-})$ of the spectra of $H_{\omega}^{\pm}$, which is the support of the measure $\rho$. Therefore if we denotes points of $\Sigma$ by $(\lambda_{1},\lambda_{2})$, so that $\lambda_{1}\geq E_{+},\lambda_{2}\geq E_{-}$, then the possible values of $\lambda_{1}+\lambda_{2}$ have a lower bound $E_{-}+E_{+}$, so $\lambda_{1}+\lambda_{2}\in(E_{-}+E_{+},E_{-}+E_{+}+a)$ implies $\lambda_{1}\in(E_{+}-2a,E_{+}+2a)\leavevmode\nobreak\ \mathrm{and}\leavevmode\nobreak\ \lambda_{2}\in(E_{-}-2a,E_{-}+2a)$, (see Figure 2). This immediately implies the inclusions (the first inclusion is clear and the second one uses the above): $\displaystyle\\{(\lambda_{1},\lambda_{2}):\lambda_{2}\in(E_{-},E_{-}+(a/2))\leavevmode\nobreak\ and\leavevmode\nobreak\ \lambda_{1}\in(E_{+},E_{+}+(a/2))\\}$ $\displaystyle\subset\\{(\lambda_{1},\lambda_{2}):\lambda_{1}+\lambda_{2}\in(E_{-}+E_{+}-a,E_{-}+E_{+}+a)\\}$ $\displaystyle\subset\\{(\lambda_{1},\lambda_{2}):\lambda_{2}\in(E_{-},E_{-}+2a)\leavevmode\nobreak\ and\leavevmode\nobreak\ \lambda_{1}\in(E_{+},E_{+}+2a)\\}.$ This then would lead to the inequalities that $\displaystyle A(E_{+}+E_{-}+a)-A(E_{+}+E_{-})$ $\displaystyle=\rho\circ T^{-1}(\frac{1}{\sqrt{2}}(E_{+}+E_{-},E_{+}+E_{-}+a]\times\mathbb{R})$ $\displaystyle=\rho\left(\\{(\lambda_{1},\lambda_{2}):E_{-}+E_{+}\leq\lambda_{1}+\lambda_{2}\leq E_{-}+E_{+}+a\\}\right)$ $\displaystyle\leq\rho\left((E_{-},E_{-}+2a)\times(E_{+},E_{+}+2a)\right)$ $\displaystyle\leq min\\{\rho\left((E_{-},E_{-}+2a)\times\mathbb{R}\right),\rho\left((E_{+},E_{+}+2a)\times\mathbb{R}\right)\\}$ $\displaystyle\leq min\\{n_{-}\left((E_{-}-2a,E_{-}+2a)\right),n_{+}\left((E_{+}-2a,E_{+}+2a)\right)\\},$ where the last inequality comes from Proposition 3(3) and enlarging the intervals slightly, which only increases the bound since $n_{\pm}$ are measures. ∎ ###### Remark 6. If the density of states $n_{\pm}$ have Lifshitz tails behaviour $n_{\pm}((E_{\pm}-a,E_{\pm}+a))\approx e^{-Ca^{\alpha}}$ as $a$ goes to zero, for an appropriate $\alpha$, at $E_{\pm}$ respectively, then we have $\limsup_{a>0}\frac{1}{h(2a)}n_{\pm}\left((E_{-}-2a,E_{-}+2a)\right)<\infty,$ for $h(a)=e^{-Ca^{\alpha}}$ for some $\alpha$, so, using the above inequalities, $\displaystyle\displaystyle{\limsup_{a>0}}\frac{1}{h(2a)}(A(E_{-}+E_{+}+a)-A(E_{-}+E_{+}-a))$ $\displaystyle\leq\displaystyle{\limsup_{a>0}}\frac{1}{h(2a)}n_{+}\left((E_{+}-a,E_{+}+2a)\right)<\infty.$ In the case when the density of states $n_{\pm}$ have Lifshitz tails behaviour at other internal band edges, the same behaviour is valid for ILAC under some conditions. Suppose the spectra of $H_{\omega}^{\pm}$ consist of bands $\cup_{i=1}^{N}[a_{i}^{\pm},b_{i}^{\pm}]$. Then the product of the spectra is $\cup_{i=1,j}^{N}[a_{i}^{+},b_{i}^{+}]\times[a_{j}^{-},b_{j}^{-}]$. Let us denote $R_{ij}=[a_{i}^{+},b_{i}^{+}]\times[a_{j}^{-},b_{j}^{-}]$. Then, the measure $\rho$ is supported on the set $\cup_{i=1,j}^{N}R_{ij}$. We index the pairs $(ij)$ by $\beta$ and use $R_{\beta}$ to denote a rectangle forming part of $\Sigma$ henceforth. So we have $\Sigma=\cup_{\beta}R_{\beta}$. The central point in the proof of Theorem 2.1 is that if $(c,d)$ is a corner of the rectangle formed by the lowest bands of the spectra of $H_{\omega}^{\pm}$, then the strip $\\{(\lambda_{1},\lambda_{2}):c+d\leq\lambda_{1}+\lambda_{2}\leq c+d+a\\}$ intersected with the support of $\rho$ is a triangle of side length $\sqrt{2}a$, (see Figure 2 ), hence its $\rho$ measure is smaller than that of the square with the corner $(c,d)$ and side length $2a$, as can be seen in the Figure 2. As we see in Figure 1, there may be some rectangles in the support of $\rho$, with this property. Those rectangles in Figure 1, where this is not true are marked by $X$ and the solid lines are those lines $\lambda_{1}+\lambda_{2}=const$ for which this feature is valid and the dashed lines are those for which this is not true. In the definition below the sets $R_{\beta}\subset\mathbb{R}^{2}$ and we denote the coordinates of $\mathbb{R}^{2}$ by $(\lambda_{1},\lambda_{2})$. ###### Definition 4. Let the support of $\rho$ be $\Sigma=\cup_{\beta}R_{\beta}$, with $R_{\beta}=[a_{i}^{+},b_{i}^{+}]\times[a_{j}^{-},b_{j}^{-}],\leavevmode\nobreak\ \beta=(ij)$. Then we call a corner $(c,d)$ of a rectangle $R_{\beta}$ good, if the intersection of the line $\lambda_{1}+\lambda_{2}=c+d$ with $\Sigma$ consists of finitely many points and all of them are corners of rectangles forming $\Sigma$. Given a corner $(c,d)$ in $\Sigma$ we shall denote by $K_{c,d}$ the set of corners that lie on the line $\lambda_{1}+\lambda_{2}=c+d$. ###### Theorem 2.2. Let spectra of $H_{\omega}^{\pm}$ be as in theorem 2.1 and let $\Sigma$ be the support of the measure $\rho$ given in equation 19. Let $A$, as given in equation (20) be the corresponding ILAC. If $(c,d)$ is a good corner in $\Sigma$. Denote the elements of $K_{c,d}$ by $\\{(c_{\gamma},d_{\gamma})\\}$. Then we have $\displaystyle A(c+d+a)-A(c+d-a)$ $\displaystyle\leq\sum_{(c_{\gamma},d_{\gamma})\in K_{c,d}}\mathrm{min}\left\\{n_{+}((c_{\gamma}-2a,c_{\gamma}+2a)),n_{-}((d_{\gamma}-2a,d_{\gamma}+2a))\right\\}.$ Proof: Firstly we note that if we take a rectangle, $R_{\beta}$, then only the lower-left and the top-right corners are candidates of being _good_ corners, since for the other two corners, the line $\lambda_{1}+\lambda_{2}=const$ that contains the said corner will pass through the rectangle and hence has infinitely many points. We will prove the theorem for a good corner $(c,d)$ which is a lower left corner of a rectangle, the proof for the case of a top-right good corner is similar. In this case we see immediately that if $(c,d)$ is a good corner in $\Sigma$, then the intersection of the strip $S_{a}\left((c,d)\right)=\\{(\lambda_{1},\lambda_{2}):c+d\leq\lambda_{1}+\lambda_{2}\leq c+d+a\\}$ with $\Sigma$ is contained in finitely many rectangles $R_{\beta}$ forming $\Sigma$. Further $S_{a}\left((c,d)\right)\cap R_{\beta}$ is contained in a square of side length $2a$ contained in $R_{\beta}$ and having one corner common with a corner of $R_{\beta}$. Given a good corner $(c,d)$ and the associated strip $S_{a}\left((c,d)\right)$, let $(c_{\gamma},d_{\gamma})\in K_{c,d}$ denote the corner of rectangle $R_{\gamma}$ that has nonempty intersection with it. (Note that this corner satisfies $c_{\gamma}+d_{\gamma}=c+d$). Then whenever $(c,d)$ is a good corner we have the inequality, with $\gamma$ ranging over a finite set, $\displaystyle S_{a}\left((c,d)\right)\cap\Sigma\subset\cup_{(c_{\gamma},d_{\gamma})\in K_{c,d}}[c_{\gamma},c_{\gamma}+2a]\times[d_{\gamma},d_{\gamma}+2a].$ (21) This inequality implies immediately that: $\displaystyle A(c+d+a)-A(c+d-a)$ $\displaystyle\leq A(c+d+a)-A(c+d)=\rho(S_{a}\left((c,d)\right)\cap\Sigma)$ $\displaystyle\leq\sum_{(c_{\gamma},d_{\gamma})\in K_{c,d}}\rho\left([c_{\gamma},c_{\gamma}+2a)\times[d_{\gamma},d_{\gamma}+2a)\right)$ $\displaystyle\leq\sum_{(c_{\gamma},d_{\gamma})\in K_{c,d}}\mathrm{min}\left\\{n_{+}\left((c_{\gamma}-2a,c_{\gamma}+2a)\right),n_{-}\left((d_{\gamma}-2a,d_{\gamma}+2a)\right)\right\\},$ (22) where in the last inequality we enlarged the sets using the fact that $n_{\pm}$ are measures. This shows that at ILAC has the same continuity property as the density of states at the band edges. ∎ In the theorem below we identify good corners for a simple case of spectra having two bands. ###### Theorem 2.3. Consider a pair of self adjoint operators $H_{\omega}^{\pm}$ as in Theorem 2.1. Suppose a.e. $\omega$, the spectra of $H_{\omega}^{+},H_{\omega}^{-}$ are given by $\cup_{i=1}^{2}[a_{i}^{+},b_{i}^{+}]$ and $\cup_{i=1}^{2}[a_{i}^{-},b_{i}^{-}]$, respectively, where $a_{i}^{\pm},b_{j}^{\pm}$ are listed in the increasing order. Then the corners $\\{(a_{1}^{+},a_{1}^{-}),(b_{1}^{+},b_{1}^{-}),(a_{2}^{+},a_{2}^{-}),(b_{2}^{+},b_{2}^{-})\\}$ are _good_ whenever $a_{i}^{\pm},b_{i}^{\pm}$ satisfy, $\displaystyle a_{1}^{+}+a_{1}^{-}<b_{1}^{+}+b_{1}^{-}<max(a_{2}^{+}+a_{1}^{-},a_{1}^{+}+a_{2}^{-})$ $\displaystyle<max(b_{2}^{+}+b_{1}^{-},b_{1}^{+}+b_{2}^{-})<a_{2}^{+}+a_{2}^{-}<b_{2}^{+}+b_{2}^{-}.$ In the case $a_{i}^{+}=a_{i}^{-},b_{i}^{+}=b_{i}^{-},i=1,2$, even the corners $\\{(a_{2}^{+},a_{1}^{-}),(a_{1}^{+},a_{2}^{-}),(b_{2}^{+},b_{1}^{-}),(b_{1}^{+},b_{2}^{-})\\}$ are good. Proof: This is direct verification to see that the diagonal lines $\lambda_{1}+\lambda_{2}=const$ passing through the respective corners do not intersect any other rectangle. In the latter case when the spectra are the same, we have $a_{2}^{+}+a_{1}^{-}=a_{1}^{+}+a_{2}^{-}$ and $b_{2}^{+}+b_{1}^{-}=b_{1}^{+}+b_{2}^{-}$, hence the stated result. ∎ ###### Remark 7. In the symmetric case $a_{i}^{\pm}=a_{i},b_{j}^{\pm}=b_{j}$, however, the rectangles $R_{\beta},R_{\gamma}\subset S_{\beta}$ if $\beta=(ij),\gamma=(ji)$. In this case the above assumption still ensures that the lower-left and top-right corners of the rectangles are good. $a_{1}$$b_{1}$$a_{2}$$b_{2}$$a_{3}$$b_{3}$$a_{4}$$b_{4}$$a_{1}$$b_{1}$$a_{2}$$b_{2}$$a_{3}$$b_{3}$$a_{4}$$b_{4}$XXXXXB Figure 1: Products of Spectra $\lambda_{2}$$\lambda_{1}+\lambda_{2}=c$$\lambda_{1}+\lambda_{2}=c+a$$a$$\sqrt{2}a$$\sqrt{2}a$$\lambda_{1}$ Figure 2: A corner of a rectangle ## 3 Discrete Models: Consider $\ell^{2}(\mathbb{Z}^{d})$ and the discrete Laplacian $(\Delta u)(n)=\sum_{|n-i|=1}u(i)$. Consider real valued i.i.d random variables $\\{q(n)\\}$ with common distribution $\mu$. Let $V_{\omega}$ denote the operator of multiplication by the sequence $q_{\omega}(n)$. Consider the operators $H_{\omega}^{\pm}=\Delta\pm q_{\omega}.$ Taking $G=L=\mathbb{Z}^{d}$, it is known that operators $E_{H_{\omega}}(A)$ are covariant. The projection $P$ is taken to be the projection $|\delta_{0}\rangle\langle\delta_{0}|$ onto the subspace generated by the vector $\delta_{0}$, which is an element of the standard basis for $\ell^{2}(\mathbb{Z}^{d})$. Then the density of states in these models are given by $n_{\pm}((a,b))=\mathbb{E}\left(Tr(PE_{H_{\omega}^{\pm}}((a,b))\right)=\mathbb{E}\left(\langle\delta_{0},E_{H_{\omega}^{\pm}}((a,b))\delta_{0}\rangle\right)$ and the correlation measure $\rho$ is given by $\rho((a,b)\times(c,d))=\mathbb{E}\left(\langle\delta_{0},E_{H_{\omega}^{+}}((a,b))E_{H_{\omega}^{-}}((c,d))\delta_{0}\rangle\right)$ and is a probability measure as per Proposition 4 (1), since $P$ is trace class in this case. In this model the density of states of $H_{\omega}^{\pm}$ are shown to have Lifshitz tails behaviour at the bottom of the spectra [21], under the condition that $\mu$ satisfies $\mu((a,a+\epsilon))\geq C\epsilon^{N}$, where $a$ is the infimum of the support of $\mu$. In the case when the support of $\mu$ has two closed intervals $[a_{1},b_{1}]\cup[a_{2},b_{2}]$,($a_{i},b_{i}$ arranged in an increasing order so that $a_{i+1}>a_{i}$ for all $i$) and such that $b_{i}+2d<a_{i+1}-2d$, Simon [22] proves the Lifshitz tails behaviour at the internal band edges, if $\mu$ satisfies $\mu((a_{i},a_{i}+\epsilon))\geq C\epsilon^{N}$ and $\mu((b_{i}-\epsilon,b_{i}))\geq C\epsilon^{N}$ for all $i$ . When $[a_{1}-2d,b_{1}+2d]$ and $[a_{2}-2d,b_{2}+2d]$ are disjoint, Lifshitz tails behaviour at the band edges is also shown for the associated density of states $n$. That is at any of the band edges one has $n((E-\delta,E+\delta))=O(e^{-C\delta^{-\frac{d}{2}}})$ as $\delta\rightarrow 0$. An application of Theorems 2.1, 2.2 shows that the results are true for the ILAC $A$, namely ###### Theorem 3.1. Consider the Anderson models as above on $\ell^{2}(\mathbb{Z}^{d})$. If $[a_{1}^{\pm},b_{1}^{\pm}]\cup[a_{2}^{\pm},b_{2}^{\pm}]$, are $\pm(supp(\mu))$. Then, for some $C>0$, * • (External band edge case) For $E\in\\{a_{1}^{+}+a_{1}^{-},b_{2}^{+}+b_{2}^{-}\\}$, one has $A(E+\delta)-A(E-\delta)=o(e^{-C\delta^{-\frac{d}{2}}}),\leavevmode\nobreak\ \mathrm{as}\leavevmode\nobreak\ \delta\rightarrow 0.$ * • (Internal band edge case) If the gap between the intervals $[a_{1}^{\pm}-2d,b_{1}^{\pm}+2d]$ and $[a_{2}^{\pm}-2d,b_{2}^{\pm}+2d]$ is large enough, then $A(E+\delta)-A(E-\delta)=o(e^{-C\delta^{-\frac{d}{2}}}),\leavevmode\nobreak\ \mathrm{as}\leavevmode\nobreak\ \delta\rightarrow 0,$ for any $E\in\\{b_{1}^{+}+a_{1}^{-},a_{2}^{+}+a_{1}^{-},b_{2}^{+}+a_{1}^{-},a_{1}^{+}+a_{2}^{-},b_{1}^{+}+b_{2}^{-},a_{2}^{+}+a_{2}^{-}\\}$. ###### Remark 8. We gave a simple example of a discrete model, however there are many more, those with periodic backgrounds [11], those which are unbounded [16] and so on. We refer to the review [7] for the numerous cases where the Lifshitz tails for the density of states is proved and for which our theorem applies to the ILAC. ## 4 Continuous Models: Let us start by stating a theorem which is essentially a very weak version of the uncertainty principle. We take $H_{0}=-\Delta=-\sum_{i=1}^{d}D_{j}^{2},D_{j}=i\frac{\partial}{\partial x_{j}}$, is self adjoint on its natural domain in $L^{2}(\mathbb{R}^{d})$ and its spectrum is $[0,\infty)$. We start with a couple of lemmas. We recall the definition of the trace ideal ${\mathscr{I}}_{p}$ to be those bounded operators $A$ with the property $|A|^{p}$ is trace class. Recall that elements of $\mathscr{I}_{1}$ are called Trace class operators. ###### Lemma 9. Consider $L^{2}(\mathbb{R}^{d})$ and the operator $M=|-i\nabla|$. Then the operator $(|x|+i)^{-1}(M+i)^{-1}\in\mathscr{I}_{d+1}$. Proof: Since the function $f(x)=(|x|+i)^{-1}$ is $L^{d+1}(\mathbb{R}^{d})$ and the operator in question is just $f(x)f(-i\nabla)$, the result follows by an application of Theorem 4.1 in [23], which gives an estimate $\|f(x)g(-i\nabla)\|_{\mathscr{I}_{p}}\leq 2\pi^{-\frac{d}{p}}\|f\|_{p}\|g\|_{p}.$ ∎ Let $V$ be an operator of multiplication by a function $V(x)$ on $L^{2}(\mathbb{R}^{d})$ on its natural domain and such that $V$ is bounded with respect to $H_{0}$ having relative bound smaller than $1$. This means the operator $V(H+i)^{-1}$ is bounded. Then $H=H_{0}+V$ is also self adjoint (Kato-Rellich theorem ) on the domain of $H_{0}$ and its spectrum is also bounded below. Writing $(H_{0}+i)(H+i)^{-1}=I-V(H+i)^{-1}$, we see that $(H_{0}+i)(H+i)^{-1}$ is also bounded. Let $P$ denote the operator of multiplication by the indicator function $\chi_{\Lambda}$ of a bounded region $\Lambda\subset\mathbb{R}^{d}$ on $L^{2}(\mathbb{R}^{d})$. Let $E_{H}(A)$ denote the spectral measure of a bounded borel set $A$, with respect to the (projection valued) spectral measure of $H$. Then, ###### Theorem 4.1. Consider $L^{2}(\mathbb{R}^{d})$ and the operator $H_{0}=-\Delta$. Let $V$ be an operator of multiplication by a function $V(x)$, such that $V$ is relatively bounded w.r.t. $H_{0}$ with relative bound $c<1$ and consider $H=H_{0}+V$. Suppose either 1. 1. $d\leq 3$, then $PE_{H}(A)$ and $E_{H}P$ are Hilbert-Schmidt, so $PE_{H}(A)P$ is trace class for any bounded borel set $A$. 2. 2. Suppose $d\geq 1$ and suppose $V$ is bounded or $\frac{\partial}{\partial x_{j}}V,j=1,\dots,d$ are relatively bounded w.r.t $H_{0}$. Then $PE_{H}(A)$ and $E_{H}(A)P$ are trace class. Proof: (1) Writing $PE_{H}(A)=P(|x|+i)^{d}(|x|+i)^{-d}(H_{0}+i)^{-1}(H_{0}+i)(H+i)^{-1}(H+i)E_{h}(A)$, we see that since all the factors are bounded, it is enough to show that $(|x|+i)^{-d}(H_{0}+i)^{-1}$ is Hilbert-Schmidt. The operator $(H_{0}+i)^{-1}$ is multiplication by $(|\xi|^{2}+i)^{-1}$ after taking Fourier transforms and hence is in $L^{2}(\mathbb{R}^{d}),d\leq 3$. Therefore an application of Lemma 9, shows that the product is Hilbert-Schmidt. (2) We will prove that $PE_{H}(A)\in\mathscr{I}_{1}$, the proof for $E_{H}(A)P$ is similar. By taking a compactly supported smooth function $\phi$ which is value $1$ on the closure of $A$, we have $\phi(H)E_{H}(A)=E_{H}(A)$. We will therefore show that $P\phi(H)$ is trace class for any compactly supported smooth function $\phi$. We also note that the function $H\phi(H)$ is again a function of the same type as $\phi$. Further since $P$ is multiplication by compactly supported function of $x$, $P(x^{2}+i)^{d}$ is bounded. Therefore we will show that $(x^{2}+i)^{-d}\phi(H)\in{\mathscr{I}}_{1}$. We prove this by induction. Before we start, we note that if $M\in\mathscr{I}_{p}$ and $N$ is a bounded operator then $MN\in\mathscr{I}_{p}$. First consider $(x^{2}+i)^{-1}\phi(H)$. We write this product as $(x^{2}+i)^{-1}(H+i)^{-1}(H+i)\phi(H)$ and consider (recalling $M=|-i\nabla|$), $(x^{2}+i)^{-1}(H+i)^{-1}=(x^{2}+i)^{-1}(M+i)^{-1}(M+i)(H_{0}+i)^{-1}(H_{0}+i)(H+i)^{-1}.$ (23) The product of the first two factors is in $\mathscr{I}_{d+1}$ (since $(|\xi|+i){-d-1}$ is integrable), by Lemma 9, the next two factors form a bounded operator (which can be seen by taking Fourier transforms). The final two factors form a bounded operator as argued before the lemma. Therefore the entire product is in $\mathscr{I}_{d+1}$. Since $(H+i)\phi(H)$ is bounded also, we get that $(x^{2}+i)^{-1}\phi(H)\in\mathscr{I}_{d+1}$. Now assume that $(x^{2}+i)^{-n}\phi(H)\in\mathscr{I}_{\frac{d+1}{n}}$, and show that $(x^{2}+i)^{-n-1}\phi(H)\in\mathscr{I}_{\frac{d+1}{n+1}}$. We write, $\psi(H)=(H+i)\phi(H)$, then $\displaystyle(x^{2}+i)^{-d-1}\phi(H)$ (24) $\displaystyle=(x^{2}+i)^{-d-1}(H+i)^{-1}(H+i)\phi(H)$ $\displaystyle(x^{2}+i)^{-1}[(x^{2}+i)^{-n},(H+i)^{-1}]\psi(H)+(x^{2}+i)^{-1}(H+i)^{-1}(x^{2}+i)^{-n}\psi(H).$ Using Theorem 2.8 (2.5b) in [23], (which says $M\in\mathscr{I}_{q},N\in\mathscr{I}_{r}\implies MN\in\mathscr{I}_{p}$ with $\frac{1}{p}=\frac{1}{q}+\frac{1}{r}$), so using the induction hypothesis and the already proved fact that $(x^{2}+i)^{-1}(H+i)^{-1}\in\mathscr{I}_{d+1}$, the last term is seen to be in $\mathscr{I}_{\frac{d+1}{n+1}}$. So we concentrate on the first term. $\displaystyle(x^{2}+i)^{-1}[(x^{2}+i)^{-n},(H+i)^{-1}]\psi(H)$ (25) $\displaystyle=(x^{2}+i)^{-1}(H+i)^{-1}[H,(x^{2}+i)^{-n}](H+i)^{-1}\psi(H)$ $\displaystyle=(x^{2}+i)^{-1}(H+i)^{-1}[H_{0},(x^{2}+i)^{-n}](H+i)^{-1}\psi(H)$ $\displaystyle=(x^{2}+i)^{-1}(H+i)^{-1}\times$ $\displaystyle\left(-4ni\sum_{j=1}^{d}P_{j}x_{j}(x^{2}+i)^{-1}-2d(x^{2}+i)^{-1}+4d(n+1)x^{2}(x^{2}+i)^{-2}\right)$ $\displaystyle\times(x^{2}+i)^{-n}\psi_{1}(H)$ where we set $(H+i)^{-1}\psi(H)=\psi_{1}(H)$, where $P_{j}=-i\nabla_{j}$. $\displaystyle(x^{2}+i)^{-1}(H+i)^{-1}P_{j}$ $\displaystyle=(x^{2}+i)^{-1}(H_{0}+1)^{-1/2}(H_{0}+1)^{1\over 2}(H+i)^{-1}(H_{0}+1)^{{1\over 2}}(H_{0}+1)^{-{1\over 2}}P_{j},$ and using Lemma 9, Lemma 10 below, we see that this expression is in $\mathscr{I}_{d+1}$. Induction hypothesis gives $(x^{2}+i)^{-n}\psi_{1}(H)\in\mathscr{I}_{\frac{d+1}{n}}$. Therefore combining these two facts we see that $(x^{2}+i)^{-n-1}\phi(H)\in\mathscr{I}_{\frac{d+1}{n+1}}$. ∎ ###### Lemma 10. Suppose either $V$ is bounded or $(\frac{\partial}{\partial x_{j}}V)(H+i)^{-1},j=1,\dots,d$ are bounded. Then $(H_{0}+1)^{1\over 2}(H+i)^{-1}P_{j}$ is a bounded operator for each $j=1,\dots d$. Proof: Consider the case when $\frac{\partial}{\partial x_{j}}V(H+i)^{-1}$ is bounded for each $j$. Then writing the expression using commutators $\displaystyle(H_{0}+1)^{{1\over 2}}(H+i)^{-1}P_{j}=(H_{0}+1)^{1\over 2}P_{j}(H+i)^{-1}$ $\displaystyle+(H_{0}+1)^{1\over 2}(H+i)^{-1}[P_{j},H](H+i)^{-1}$ $\displaystyle=(H_{0}+1)^{1\over 2}P_{j}(H+i)^{-1}+(H_{0}+1)^{1\over 2}(H+i)^{-1}(\frac{\partial}{\partial x_{j}}V)(H+i)^{-1}.$ The boundedness of the first term was seen before since $(H_{0}+1)^{1\over 2}P_{j}(H_{0}+1)^{-1}$ and $(H_{0}+1)(H+1)^{-1}$ are bounded. second term is bounded by the assumption on $V$ and the boundedness of $(H_{0}+1)^{-{1\over 2}}$. Now consider the case when $V$ is bounded, then taking $f,g$ in the domain of $H_{0}$, we have $\langle f,(H_{0}+1)f\rangle=\langle g,(H_{0}+V+c+1)f\rangle-\langle g,(V+c)f\rangle,$ where $c$ is a positive constant such that $H+c+1$ is a positive operator (which is possible since $H$ is bounded below). Since $H+c+1$ is positive it has a unique square root, so using the boundedness of $V$ and the above inequality, we obtain, for some finite $C$, $\|(H_{0}+1)^{1\over 2}f\|^{2}\leq\|(H+c)^{{1\over 2}}f\|^{2}+C\|f\|\leq D\|(H+c)^{{1\over 2}}f\|^{2}.$ Taking $f=(H_{0}+1)^{1\over 2}g,\|g\|=1$, for a set of $g$ coming from $C_{0}^{\infty}(\mathbb{R}^{d})$, we see that $K\leq\|(H+c)^{1\over 2}(H_{0}+1)^{-{1\over 2}}g\|^{2},\leavevmode\nobreak\ K>0,$ $K$ independent of $g$. This shows that $(H+c)^{1\over 2}(H_{0}+1)^{-{1\over 2}}$ has a bounded inverse and that its inverse $(H_{0}+1)^{-{1\over 2}}(H+c)^{1\over 2}$ and $(H+c)^{1\over 2}(H_{0}+1)^{-{1\over 2}}$ are both bounded (since $M$ bounded implies $M^{*}$ is also bounded). Therefore writing $\displaystyle(H_{0}+1)^{1\over 2}(H+i)^{-1}P_{j}$ $\displaystyle=(H_{0}+1)^{1\over 2}(H+c)^{-{1\over 2}}(H+c)(H+i)^{-1}(H+c)^{-{1\over 2}}(H_{0}+1)^{1\over 2}(H_{0}+1)^{-{1\over 2}}P_{j},$ we see that the left hand side is bounded. ∎ We are now ready to present examples where the theorems of the previous section are applicable. We fist give a few examples of models on the lattice. Consider $L^{2}(\mathbb{R}^{d})$, $H_{0}=\Delta$, $q(n),n\in\mathbb{Z}^{d}$, i.i.d random variables with distribution $\mu$ having compact support. Let $\Lambda$ denote the unit cube centred at $0\in\mathbb{R}^{d}$ and $\Lambda(n)$ denote the unit cube centred at the point $n\in\mathbb{Z}^{d}$. Let $V_{\omega}=\sum_{n\in\mathbb{Z}^{d}}q^{\omega}(n)\chi_{\Lambda(n)}$, where $\chi_{A}$ is the operator of multiplication by the indicator function of $A$. Then taking $H_{\omega}^{\pm}=\Delta\pm V_{\omega},$ we see that, since $V_{\omega}$ is bounded for each $\omega$, the conditions of Theorem 4.1 are satisfied. Further taking $G=\mathbb{R}^{d}$ and $L=\mathbb{Z}^{d}$, $(U_{x}f)(y)=f(y-x),on\leavevmode\nobreak\ L^{2}(\mathbb{R}^{d})$, $q_{{}_{T^{m}\omega}}(n)=q_{\omega}(n+m)$, in Hypothesis 1, the spectral projections $E_{H_{\omega}^{\pm}}((a,b))$ are covariant families in the sense of Definition 1. The Theorem 4.1 shows that $\chi_{\Lambda(0)}E_{H_{\omega}^{\pm}}((a,b))\chi_{\Lambda(0)}$ is trace class whenever $(a,b)$ is a bounded interval. Hence we can define the density of states and the ILAC as in equations (18) and (19), by taking $P$ to be multiplication by $\chi_{{}_{\Lambda(0)}}$. Therefore the Theorems 2.1, 2.2 are valid in this case. Our theorem covers models where the random potential has the following forms. * • $V^{\omega}(x)=\sum_{n\in\mathbb{Z}^{d}}q^{\omega}(n)u(x-n)$, $\\{q(n)\\}$ i.i.d.random variables whose distribution has compact support and $u$ a nice function with $u(x-n)$ summable. * • An addition of a periodic background potential $W$ to the random potential above. * • Addition of magnetic fields. If in all these cases the density of states have Lifshitz tails behaviour at the band edges the same is acquired by the ILAC at an appropriate energy level. ###### Remark 11. Let us remark that in the above examples we can even replace the Laplacian $-\Delta$ with a real polynomial function $Q$ of $-i\nabla$ and the results go through, if for some $R>0$, the polynomial satisfies $c_{1}\|\xi\|^{2n}\leq Q(\xi)\leq c_{2}\|\xi\|^{2n},\leavevmode\nobreak\ |\xi|>R,c_{1},c_{2}>0.$ ## References * [1] M.S. Atoyan, E.M. Kazaryan, H.A. Sarkisyan: Interband light absorption in parabolic quantum dot in the presence of electrical and magnetic fields, Physica E: Low-dimensional Systems and Nanostructures Vol 31, 83-85 (2006). * [2] R. Carmona, J. Lacroix: Spectral Theory of Random Schrödinger Operators, (Birkhäuser Verlag, Boston 1990) * [3] H. Cycone, R. Froese, W. Kirsch and B. Simon: Schrödinger Operators, Texts and Monographs in Physic (Springer Verlag, 1985) * [4] M. Demuth and M. Krishna : Determining spectra in Quantum Theory, Progress in Mathematical Physics Vol 44, (Birkhauser, Boston, 2005). * [5] A.L. Efros: Density of states and interband absorption of light in strongly doped semiconductors, Semiconductors, Vol 16, 1209- (1982). * [6] A. Figotin, L. Pastur: Spectra of Random and Almost-Periodic Operators (Springer Verlag, Berlin 1992) * [7] W. Kirsch and B. Metzger: The Integrated Density of States for Random Schr dinger Operators, Spectral theory and mathematical physics: a Festschrift in honor of Barry Simon’s 60th birthday, Proc. Sympos. Pure Math., Vol 76 649–696 (2007). * [8] W. Kirsch and L.A.Pastur : The large-time asymptotics of some Wiener integrals and the interband light absorption coefficient in the deep fluctuation spectrum , Comm. Math. Phys., Vol 132, 365–382 (1990). * [9] W. Kirsch and L.A.Pastur : The interband light absorption coefficient in the weak disorder regime: an asymptotically exactly solvable model, J. Phys. A, Vol 27, 2527–2543 (1994). * [10] W. Kirsch, L.A.Pastur and H. Stork : Asymptotics of the interband light absorption coefficient near the band edge for an alloy-type model, J. Statist. Phys, Vol 92, 1173–1191 (1998) * [11] W. Kirsch, B. Simon: Lifshitz tails for periodic plus random potential, J. Statist. Phys, Vol 42, no 4-6, 799-808 (1986). * [12] B. Khoruzenko, W. Kirsch and L.A.Pastur: The Interband Light Absorption Coefficient in the weak disorder regime: An asymptotically exactly solvable model, J. Phys. A: Math. Gen. Vol 27, 2527-2543 (1994). * [13] Klopp, Frederic and Wolff, Thomas: Lifshitz tails for 2-dimensional random Schrödinger operators: Dedicated to the memory of Tom Wolff, J. Anal. Math. Vol 88, 63–147 (2002). * [14] Klopp, F: Weak disorder localization and Lifshitz tails: continuous Hamiltonians, Ann. Henri Poincare, Vol 3, no. 4, 711–737 (2002). * [15] Klopp, Frederic: Lifshitz tails for random perturbations of periodic Schrödinger operators, Spectral and inverse spectral theory (Goa, 2000), Proc. Indian Acad. Sci. Math. Sci. Vol 112, no. 1, 147–162 (2002). * [16] Klopp, Frederic: Precise high energy asymptotics for the integrated density of states for an unbounded random jacobi matrix, Rev. Math. Phys, Vol 12, 575-620 (2000). * [17] M. Krishna: Continuity of integrated density of states - independent randomness, Proc. Ind. Acad. Sci., Vol 173, 401-410 (2007). * [18] M. Krishna: Regularity of the Interband Light Absorption Coefficient, Preprint (2008). * [19] K.R. Parthasarathy: Introduction to Probability and Measure, Texts and Readings in Mathematics, Vol 33, Hindustan Book Agency, New Delhi (2005). * [20] M. Reed and B. Simon: Methods of Modern Mathematical Physics, Functional Analysis, Academic Press (1972). * [21] B. Simon: Lifshitz tails for the Anderson Model, J. Stat. Phys, Vol 38, 65-76 (1985). * [22] B. Simon: Internal Lifshitz tails, J. Stat. Phys, Vol 46, 911-918 (1987). * [23] B. Simon: Trace Ideals and their applications, Second Edition, Mathematical Surveys and Monographs, Vol 120, American Mathematical Society, Providence RI (2005). * [24] V. S. Sunder: Functional Analysis - Spectral Theory, Texts and Readings in Mathematics, Vol 13, Hindustan Book Agency, New Delhi (1997). * [25] Ivan Veselic: Existence and Regularity Properties of the Integrated Density of States of Random Schrödinger Operators, Lecture Notes in Mathematics No 1917, Springer Verlag (2008).
arxiv-papers
2009-03-31T06:38:19
2024-09-04T02:49:01.534057
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "W. Kirsch and M. Krishna", "submitter": "M. Krishna", "url": "https://arxiv.org/abs/0903.5376" }
0903.5444
# Stochastic receding horizon control with bounded control inputs: a vector space approach Debasish Chatterjee , Peter Hokayem and John Lygeros Automatic Control Laboratory Physikstrasse 3 ETH Zürich 8092 Zürich Switzerland {chatterjee,hokayem,lygeros}@control.ee.ethz.ch ###### Abstract. We design receding horizon control strategies for stochastic discrete-time linear systems with additive (possibly) unbounded disturbances, while obeying hard bounds on the control inputs. We pose the problem of selecting an appropriate optimal controller on vector spaces of functions and show that the resulting optimization problem has a tractable convex solution. Under the assumption that the zero-input and zero-noise system is asymptotically stable, we show that the variance of the state is bounded when enforcing hard bounds on the control inputs, for any receding horizon implementation. Throughout the article we provide several examples that illustrate how quantities needed in the formulation of the resulting optimization problems can be calculated off- line, as well as comparative examples that illustrate the effectiveness of our control strategies. This research was partially supported by the Swiss National Science Foundation under grant 200021-122072, and the FeedNetBack project FP7-ICT-223866 (www.feednetback.eu). ###### Contents 1. 1 Introduction 2. 2 Problem Statement 3. 3 Main Result 4. 4 Various Cases of Constrained Controls 1. 4.1 Bounded controls, unbounded noise, and $p=\infty$ 2. 4.2 Bounded controls, bounded noise, and $p=2$ 3. 4.3 Constraints on control energy 5. 5 Stability Analysis 1. 5.1 Mean-square boundedness 2. 5.2 Input-to-state stability 6. 6 Numerical Examples 7. 7 Conclusion and Future Directions 8. A.1 Some identities 9. A.2 Proof of mean-square boundedness ## 1\. Introduction Receding horizon control is a popular paradigm for designing control policies. In the context of deterministic systems it has received a considerable amount of attention over the last two decades, and significant advancements have been made in terms of its theoretical foundations as well as industrial applications. The motivation comes primarily from the fact that receding horizon control yields tractabile control laws for deterministic systems in the presence of constraints, and has consequently become popular in the industry. The counterpart in the context of stochastic systems, however, is a relatively recent development. In this article we solve the problem of stochastic receding horizon control for linear systems subject to additive (possibly) unbounded disturbances and hard norm bounds on the control inputs, over a class of feedback policies. Methods for guaranteeing hard bounds on the control inputs, within our context, while ensuring tractability of the underlying optimization problem are, to our knowledge, not available in the current literature. Preliminary results in this direction were reported in [HCL09]. In the deterministic setting, the receding horizon control scheme is dominated by worst-case analysis relying on robust control and robust optimization methods, see, for example, [Ber05, MRRS00, BM99, LHBW07, Mac01, Bla99, FB05, YB09, RH05] and the references therein. The central idea is to synthesize a controller based on the bounds of the noise such that a certain target set becomes invariant with respect to the closed-loop dynamics. However, such an approach tends to yield rather conservative controllers and large infeasibility regions. Moreover, assigning an a priori bound to the noise seems to demand considerable insight. A stochastic model of the noise is a natural alternative approach to this problem: the conservativeness of worst- case controllers may be reduced, and one may not need to impose any a priori bounds on the maximum magnitude of the noise. In [BB07], the authors reformulate the stochastic programming problem as a deterministic one with bounded noise and solve a robust optimization problem over a finite horizon, followed by estimating the performance when the noise is unbounded but takes high values with low probability (as in the Gaussian case). In [PS09] a slightly different problem is addressed in which the noise enters in a multiplicative manner, and hard constraints on the states and control inputs are relaxed to constraints resembling the integrated chance constraints of [Han83] or risk measures in mathematical finance. Similar relaxations of hard constraints to soft probabilistic ones have also appeared in [CKW08] for both multiplicative and additive noise inputs, as well as in [OJM08] for additive noise inputs. There are also other approaches, e.g., those employing randomized algorithms as in [BW07, Bat04, MLL05]. Related lines of research can be found in [vHB03, vHB06] dealing with constrained model predictive control (MPC) for stochastic systems motivated by industrial applications, in [RCMA+09, BSW02, SSW06] dealing with stochastic stability, in [SB09b] dealing with Q-design, in, e.g., [LH07, LHC03] dealing with alternative approaches to control under actuator constraints and neural-network approximation. The articles [ACCL09, CACL09] deal with a formulation that allows probabilistic state constraints but not hard input constraints, and is hence complementary to the approach in the present article, and [HCCL10] treats the case of output feedback. . Finally, note that probabilistic constraints on the controllers naturally raise difficult questions on what actions to take when such constraints are violated, see [CCCL08] and [CP09] for partial solutions to these issues. The main contributions of the article are as follows: We give a tractable, convex, and globally feasible solution to the finite-horizon stochastic linear quadratic (LQ) problem for linear systems with possibly unbounded additive noise and hard constraints on the elements of the control policy. Within this framework one has two directions to pursue in terms of controller design, namely, a posteriori bounding the standard LQG controller, or employing certainty-equivalent receding horizon controller. While the former direction explicitly incorporates some aspects of feedback, the synthesis of the latter involves control constraints and implicitly incorporates the notion of feedback. Our choice of feedback policies explores the middle ground between these two choices: we explicitly incorporate both the control bounds and feedback at the design phase. More specifically, we adopt a policy that is affine in certain bounded functions of the past noise inputs. The optimal control problem is lifted onto general vector spaces of candidate control functions from which the controller can be selected algorithmically by solving a convex optimization problem. Our novel approach does not require artificially relaxing the hard constraints on the control input to soft probabilistic ones (to ensure large feasible sets), and still provides a globally feasible solution to the problem. Minimal assumptions of the noise sequence being i.i.d and having finite second moment are imposed. The effect of the noise appears in the convex optimization problem as certain fixed cross-covariance matrices, which may be computed off-line and stored. Once tractability of the optimization problem is ensured, we employ the resulting control policy in a receding horizon scheme. Under our policies the closed-loop system is in general not necessarily Markovian, and as a result stability of the closed-loop system is not immediate. In fact, we can no longer appeal directly to standard Foster-Lyapunov methods. We establish that our receding horizon control scheme provides stability under the assumption that the zero-input and zero-noise system is asymptotically stable. We provide examples that demonstrate the effectiveness of our policies with respect to standard methods such as certainty-equivalent MPC, standard unconstrained LQG and saturated LQG control. These examples show that our policies perform no worse than the standard unconstrained LQG controller in the absence of control constraints, and outperform the certainty-equivalent MPC as well as the saturated LQG control by a significant margin. Our mechanism for selection of a policy consists of two steps: The first concerns the structure of our policies, and is motivated by preceding work in robust optimization and MPC [Löf03, BTGGN04, GKM06]. The second concerns the procedure for selection of an optimal policy from a general vector space of candidate control functions, and is inspired by approximate dynamic programming techniques [BT96, LR06, SS85, dFR03, Pow07]. With respect to the first step, our policies are more general compared to those in [Löf03, BTGGN04, GKM06]. With respect to the second, the selection procedure of our policies consists of a one-step tractable static optimization program. The rest of this article is organized as follows. In Section 2 we state the main problem to be solved in the most general form. In Section 3 we provide a tractable solution to the finite horizon optimization problem on general vector spaces. This result is specialized to various classes of noise and input constraint sets in Section 4. Stability of receding horizon implementations of the obtained closed-loop policy is shown in Section 5, and input-to-state stability properties are discussed in Section 5.2. We provide a host of numerical examples that illustrate the effectiveness of our approach in Section 6. Finally, we conclude in Section 7 with a discussion on future research directions. ### Notation Hereafter, $\mathbb{N}\coloneqq\\{1,2,\ldots\\}$ is the set of natural numbers, $\mathbb{N}_{0}\coloneqq\mathbb{N}\cup\\{0\\}$, $\mathbb{Z}$ is the set of all the integers, $\mathbb{R}_{\geqslant 0}$ is the set of nonnegative real numbers, and $\mathbb{C}$ denotes the set of complex numbers. We let $\mathbf{1}_{A}(\cdot)$ denote the indicator function of a set $A$, and $\mathbf{I}_{n\times n}$ and $\mathbf{0}_{n\times m}$ denote the $n$-dimensional identity matrix and $n\times m$-dimensional zeros matrix, respectively. Let $\left\lVert{\cdot}\right\rVert$ denote the standard Euclidean norm, and $\left\lVert{\cdot}\right\rVert_{p}$ denote the usual $\ell_{p}$ norms. Also, let $\mathbb{E}_{x_{0}}[\cdot]$ denote the expected value given $x_{0}$, and $\mathbf{tr}\\!\left(\cdot\right)$ denote the trace of a matrix. If $M_{1}$ and $M_{2}$ are two matrices with the same number of rows, we employ the standard notation $[M_{1}\mid M_{2}]$ for the matrix obtained by stacking the columns of $M_{1}$ followed by the columns of $M_{2}$. For a given symmetric $n$-dimensional matrix $M$ with real entries, let $\\{\lambda_{i}(M)\mid i=1,\ldots,n\\}$ be the set of eigenvalues of $M$, and let $\lambda_{\rm max}(M)\coloneqq\max_{i}\lambda_{i}(M)$ and $\lambda_{\text{min}}(M)\coloneqq\min_{i}\lambda_{i}(M)$. Finally, for a random vector $X$ let $\Sigma_{X}$ denote the matrix $\mathbb{E}\bigl{[}XX^{\mathsf{T}}\bigr{]}$ and $\mu_{X}$ denote the vector $\mathbb{E}\bigl{[}X\bigr{]}$. ## 2\. Problem Statement Consider the following discrete-time stochastic dynamical system: (2.1) $x_{t+1}=\bar{A}x_{t}+\bar{B}u_{t}+w_{t},\qquad t\in\mathbb{N}_{0},$ where $x_{t}\in\mathbb{R}^{n}$ is the state, $u_{t}$ is the control input taking values in some given control set $\bar{\mathbb{U}}\subseteq\mathbb{R}^{m}$ to be defined later, $\bar{A}\in\mathbb{R}^{n\times n}$, $\bar{B}\in\mathbb{R}^{n\times m}$, and $(w_{t})_{t\in\mathbb{N}_{0}}$ is a sequence of stochastic noise vectors with $w_{t}\in\mathbb{W}\subseteq\mathbb{R}^{n}$. We assume that the initial condition $x_{0}$ is given and that, at any time $t$, $x_{t}$ is observed perfectly. We do not assume that the components of the noise $w_{t}$ are uncorrelated, nor that they have zero mean; this effectively means that $w_{t}$ may be of the form $\bar{F}w_{t}^{\prime}+b$ for some noise $w_{t}^{\prime}\in\mathbb{R}^{p}$ whose components are uncorrelated or mutually independent, $F\in\mathbb{R}^{n\times p}$, and $b\in\mathbb{R}^{n}$. Without loss of generality we shall stick to the simpler notation of (2.1) throughout this article. The results readily extend to the general case of $w_{t}=\bar{F}w_{t}^{\prime}+b$, as can be seen in [HCL09]. Generally, a _control policy_ $\pi$ is a sequence $(\pi_{0},\pi_{1},\pi_{2},\ldots)$ of Borel measurable maps $\pi_{t}:\underbrace{\mathbb{R}^{n}\times\cdots\times\mathbb{R}^{n}}_{k(t)-\text{ times}}\to\bar{\mathbb{U}},\;t\in\mathbb{N}_{0}$. Policies of finite length such as $(\pi_{t},\pi_{t+1},\ldots,\pi_{t+N-1})$ will be denoted in the sequel by $\pi_{t:t+N-1}$. Fix an optimization horizon $N\in\mathbb{N}$ and let us consider the following objective function at time $t$ given the state $x_{t}$: (2.2) $V_{t}\coloneqq\mathbb{E}\Biggl{[}\sum_{k=0}^{N-1}\bigl{(}x_{t+k}^{\mathsf{T}}Q_{k}x_{t+k}+u_{t+k}^{\mathsf{T}}R_{k}u_{t+k}\bigr{)}+x_{t+N}^{\mathsf{T}}Q_{N}x_{t+N}\,\Bigg{|}\,x_{t}\Biggr{]},$ where $Q_{t}>0,R_{t}>0,Q_{N}>0$ are some given symmetric matrices of appropriate dimension. At each time instant $t$, we are interested in minimizing (2.2) over the class of causal state feedback strategies $\Pi$ defined as: (2.3) $\left[\begin{matrix}u_{t}\\\ u_{t+1}\\\ \vdots\\\ u_{t+N-1}\end{matrix}\right]=\left[\begin{array}[]{l}\pi_{t}(x_{t})\\\ \pi_{t+1}(x_{t},x_{t+1})\\\ \vdots\\\ \pi_{t+N-1}(x_{t},x_{t+1},\cdots,x_{t+N-1})\end{array}\right],$ for some measurable functions $\pi_{t:t+N-1}\coloneqq\\{\pi_{t},\cdots,\pi_{t+N-1}\\}\in\Pi$, while satisfying $u_{t}\in\bar{\mathbb{U}}$ for each $t$. The _receding horizon control_ procedure for a given control horizon $N_{c}\in\\{1,\ldots,N\\}$ and time $t$ can be described as follows: * (a) measure the state $x_{t}$; * (b) determine an admissible optimal feedback control policy, say $\pi^{*}_{t:t+N-1}\in\Pi$, that minimizes the $N$-stage cost function (2.2) starting from time $t$, given the measured initial condition $x_{t}$; * (c) apply the first $N_{c}$ elements $\pi^{*}_{t:t+N_{c}-1}$ of the policy $\pi^{*}_{t:t+N-1}$; * (d) increase $t$ to $t+N_{c}$, and go back to step (a). In this context, if $N_{c}=1$ then this is usual MPC, and if $N_{c}=N$, then it is usually known as rolling horizon control. Since both the system (2.1) and cost (2.2) are time-invariant, it is enough to consider the problem of minimizing the cost for $t=0$. In view of the above we consider the problem: (2.4) $\displaystyle\min_{\pi_{0:N-1}\in\Pi}\bigl{\\{}V_{0}\,\big{|}\,\text{dynamics \eqref{eq:system}},\text{ and }u_{t}\in\bar{\mathbb{U}}\text{ for each }t\bigr{\\}}.$ If feasible, the problem (2.4) generates an optimal sequence of feedback control laws $\pi^{*}=\left\\{\pi^{*}_{0},\cdots,\pi^{*}_{N-1}\right\\}$. The evolution of the system (2.1) over a single optimization horizon $N$ can be described in a compact form as follows: (2.5) $x=Ax_{0}+Bu+Dw,$ where $x\coloneqq\begin{bmatrix}x_{0}\\\ x_{1}\\\ \vdots\\\ x_{N}\end{bmatrix},\qquad u\coloneqq\begin{bmatrix}u_{0}\\\ u_{1}\\\ \vdots\\\ u_{N-1}\end{bmatrix},\qquad w\coloneqq\begin{bmatrix}w_{0}\\\ w_{1}\\\ \vdots\\\ w_{N-1}\end{bmatrix},\qquad A\coloneqq\begin{bmatrix}\mathbf{I}_{n\times n}\\\ \bar{A}\\\ \vdots\\\ \bar{A}^{N}\end{bmatrix},$ $B\coloneqq\begin{bmatrix}\mathbf{0}_{n\times m}&\cdots&\cdots&\mathbf{0}_{n\times m}\\\ \bar{B}&\ddots&&\vdots\\\ \bar{A}\bar{B}&\bar{B}&\ddots&\vdots\\\ \vdots&&\ddots&\mathbf{0}_{n\times m}\\\ \bar{A}^{N-1}\bar{B}&\cdots&\bar{A}\bar{B}&\bar{B}\end{bmatrix},\qquad D\coloneqq\begin{bmatrix}\mathbf{0}_{n\times n}&\cdots&\cdots&\mathbf{0}_{n\times n}\\\ \mathbf{I}_{n\times n}&\ddots&&\vdots\\\ \bar{A}&\mathbf{I}_{n\times n}&\ddots&\vdots\\\ \vdots&&\ddots&\mathbf{0}_{n\times n}\\\ \bar{A}^{N-1}&\cdots&\bar{A}&\mathbf{I}_{n\times n}\end{bmatrix}.$ Using the compact notation above, the optimization Problem (2.4) can be rewritten as follows: (2.6) $\displaystyle\min_{\pi_{0:N-1}\in\Pi}$ $\displaystyle\bigl{\\{}\mathbb{E}_{x_{0}}\bigl{[}x^{\mathsf{T}}Qx+u^{\mathsf{T}}Ru\bigr{]}\,\big{|}\,\text{dynamics \eqref{eq:compactdyn}},u\in\mathbb{U}\bigr{\\}},$ where $Q=\operatorname{diag}\\{Q_{0},\ldots,Q_{N}\\}$, $R=\operatorname{diag}\\{R_{0},\ldots,R_{N-1}\\}$, and $\mathbb{U}\coloneqq\underbrace{\bar{\mathbb{U}}\times\ldots\times\bar{\mathbb{U}}}_{N-\text{times}}$. ## 3\. Main Result We require that our controller is selected from a vector space of candidate controllers spanned by a given set of “simple” basis functions. The precise algorithmic selection procedure is based on the solution to an optimization problem. The basis functions may represent particular types of control functions that are easy or inexpensive to implement, e.g., minimum attention control [Bro97], or may be the only ones available for a specific application. For instance, piecewise constant policy elements with finitely many elements in their range may be viewed as controllers that can provide only finitely many values; this may be viewed as an extended version of a bang-bang controller, or as a hybrid controller with a finite control alphabet. More formally, let $\mathcal{H}$ be a nonempty separable vector space of functions with the control set $\mathbb{U}$ as their range, i.e., $\mathcal{H}$ is the linear span of measurable functions ${\mathfrak{e}}^{\nu}:\mathbb{W}\to\mathbb{U}$, where $\nu\in\mathcal{I}$ \- an ordered countable index set (see [Lue69] for more details). As mentioned above, the elements of $\mathcal{H}$ may be linear combinations of typical “simple” controller functions for $t=0,1,\ldots,N-1$. We are interested in policies of the form $u_{t}=\eta_{t}+\sum_{i=0}^{t-1}\psi_{t,i}(w_{i})$, where $\eta_{t}$ is an $m$-dimensional vector and each component of the $m$-dimensional vector-valued function $\psi_{t,i}$ is a member of $\mathcal{H}$. Although this feedback function is directly from the noise, since the state is assumed to be perfectly measured, from the system dynamics (2.1) it follows at once that this controller $u_{t}$ is actually a feedback from all the states $x_{0},\ldots,x_{t}$. Indeed, in the spirit of [Löf03, BTGGN04, GKM06, SB09a] we have $\displaystyle u_{0}$ $\displaystyle=\eta_{0},$ $\displaystyle u_{1}$ $\displaystyle=\eta_{1}+\psi_{1,0}(x_{1}-\bar{A}x_{0}-\bar{B}\eta_{0}),$ $\displaystyle u_{2}$ $\displaystyle=\eta_{2}+\psi_{2,0}(x_{1}-\bar{A}x_{0}-\bar{B}\eta_{0})+\psi_{2,1}\bigl{(}x_{2}-\bar{A}x_{1}-\bar{B}\bigl{(}\eta_{1}+\psi_{1,0}(x_{1}-\bar{A}x_{0}-\bar{B}\eta_{0})\bigr{)}\bigr{)},$ $\displaystyle\vdots$ In other words, by construction, $u_{t}$ is generally a nonlinear feedback controller depending on the past $t$ states.111Note that the controller input at time $t$ is non-Markovian as it is a function of the state vectors at all the previous times and not just on $x_{t-1}$. Also by construction, it is causal. Our general control policy can now be expressed as the vector (3.1) $u=\eta+\varphi(w)\coloneqq\begin{bmatrix}\eta_{0}\\\ \eta_{1}\\\ \vdots\\\ \eta_{N-1}\end{bmatrix}+\begin{bmatrix}\varphi_{0}\\\ \varphi_{1}(w_{0})\\\ \vdots\\\ \varphi_{N-1}(w_{0},w_{1},\ldots,w_{N-2})\end{bmatrix},$ where, * • $\varphi_{0}=0$, * • $w_{t}$ for $t=0,\ldots,N-1$ is the $t$-th random noise vector, * • $\eta_{t}$ is an $m$-dimensional vector for $t=0,\ldots,N-1$, * • $\varphi_{t}(w_{0},\ldots,w_{t-1})=\sum_{i=0}^{t-1}\varphi_{t,i}(w_{i})$ for $t=1,\ldots,N-1$ is an $m$-dimensional vector, and * • each function $\varphi_{t,i}$ belongs to the linear span of the basis elements $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{I}}$, and thus has a representation as a linear combination $\varphi_{t,i}(\cdot)=\sum_{\nu\in\mathcal{I}}\theta_{t,i}^{\nu}{\mathfrak{e}}^{\nu}(\cdot)$, $t=1,\ldots,N-1$, $i=0,\ldots,t-1$, where $\theta_{t,i}^{\nu}$ are matrices of coefficients of appropriate dimension. Analogous to Fourier coefficients in harmonic analysis, we call the $\theta_{t,i}^{\nu}$ the $\nu$-th Fourier coefficient of the function $\varphi_{t,i}$. Therefore, whenever $|\mathcal{I}|<\infty$ for every $t=1,\ldots,N-1$, we have the finite representation (3.2) $\varphi_{t}(w_{0},\ldots,w_{t-1})=\begin{bmatrix}\theta_{t,0}&\theta_{t,1}&\ldots&\theta_{t,t-1}&\boldsymbol{0}&\ldots&\boldsymbol{0}\end{bmatrix}_{R^{m\times n|\mathcal{I}|(N-1)}}\begin{bmatrix}{\mathfrak{e}}(w_{0})\\\ {\mathfrak{e}}(w_{1})\\\ \vdots\\\ {\mathfrak{e}}(w_{N-2})\end{bmatrix}_{\mathbb{R}^{n|\mathcal{I}|(N-1)\times 1}},$ where $\theta_{t,i}\in\mathbb{R}^{m\times n|\mathcal{I}|}$, $\boldsymbol{0}\in\mathbb{R}^{m\times n|\mathcal{I}|}$, $\theta_{t,i}\coloneqq\left[\begin{matrix}\theta^{1}_{t,i}\,\;\cdots\,\,\theta^{|\mathcal{I}|}_{t,i}\end{matrix}\right],\;\;\theta_{t,i}^{\nu}\in\mathbb{R}^{m\times n},\quad{\rm and}\quad{\mathfrak{e}}(w_{i})\coloneqq\left[\begin{matrix}{\mathfrak{e}}^{1}(w_{i})\\\ \vdots\\\ {\mathfrak{e}}^{|\mathcal{I}|}(w_{i})\end{matrix}\right],\quad\forall\,i=0,1,\cdots,N-2.$ In this notation the policy (3.1) can be written as (3.3) $u=\eta+\varphi(w)=\eta+\begin{bmatrix}\boldsymbol{0}&\boldsymbol{0}&\cdots&\boldsymbol{0}\\\ \theta_{1,0}&\boldsymbol{0}&\cdots&\boldsymbol{0}\\\ \theta_{2,0}&\theta_{2,1}&\cdots&\boldsymbol{0}\\\ \vdots&\vdots&\ddots&\vdots\\\ \theta_{N-1,0}&\theta_{N-1,1}&\cdots&\theta_{N-1,N-2}\end{bmatrix}\begin{bmatrix}{\mathfrak{e}}(w_{0})\\\ {\mathfrak{e}}(w_{1})\\\ \vdots\\\ {\mathfrak{e}}(w_{N-2})\end{bmatrix}\eqqcolon\eta+\Theta{\mathfrak{e}}(w),$ where $\Theta$ is now the matrix of Fourier coefficients having dimension $Nm\times\bigl{(}n(N-1)|\mathcal{I}|\bigr{)}$. This Fourier coefficient matrix $\Theta$ and the vector $\eta$ play the role of the optimization parameters in our search for an optimal policy. Note that ${\mathfrak{e}}(w)$ does not include the noise vector $w_{N-1}$, and that $\Theta$ is strictly lower block triangular to enforce causality. In what follows, as a matter of notation, by $\Theta_{t}$ we shall denote the formal $t$-th block-row of the matrix $\Theta$ in (3.3), i.e., $\Theta_{t}\coloneqq\begin{bmatrix}\theta_{t,0}&\cdots&\theta_{t,t-1}&0&\cdots&0\end{bmatrix}$, for $t=0,\cdots,N-1$, with $\Theta_{0}$ being the identically $0$ row. We make the following assumption: ###### Assumption 3.1. The sequence $(w_{t})_{t\in\mathbb{N}_{0}}$ of noise vectors is i.i.d with $\Sigma=\mathbb{E}\bigl{[}w_{t}w_{t}^{\mathsf{T}}\bigr{]}$.$\diamondsuit$ So far we have not stipulated any boundedness properties on the elements of the vector space $\mathcal{H}$. This means that the control policy elements may be unbounded maps. First we stipulate the following structure on the control sets: For a given $p\in[1,\infty]$, the control input vector $u_{t}$ is bounded in $p$-norm at each instant of time $t$, i.e., for $p\in[1,\infty]$ let $U_{\max}^{(p)}>0$ be given, with (3.4) $\displaystyle u_{t}\in\bar{\mathbb{U}}_{p}$ $\displaystyle\coloneqq\bigl{\\{}\xi\in\mathbb{R}^{m}\big{|}\left\lVert{\xi}\right\rVert_{p}\leqslant U_{\max}^{(p)}\bigr{\\}}\quad\forall\,t\in\mathbb{N}_{0},\quad\text{and}$ $\displaystyle\mathbb{U}_{p}$ $\displaystyle\coloneqq\underbrace{\bar{\mathbb{U}}_{p}\times\ldots\times\bar{\mathbb{U}}_{p}}_{N-\text{times}}.$ One could easily include more general constraint sets $\mathbb{U}_{p}$, for instance, to capture bounds on the rate of change of inputs. Our basic result is the next Theorem. ###### Theorem 3.2. Consider the system (2.1). Suppose that Assumption 3.1 holds, $\mathcal{H}$ is finite-dimensional ($|\mathcal{I}|<\infty$), and every component of the basis functions ${\mathfrak{e}}^{\nu}$ is bounded by $\mathcal{E}>0$ in absolute value. Then the problem (2.6) under the policy (3.1) and control sets (3.4) for $p\in[1,\infty]$ is convex with respect to the decision variables $(\eta,\Theta)$ defined in (3.3). For $p=1,2$, and $\infty$ it admits convex tractable versions with tighter domains of $(\eta,\Theta)$, given by (3.5) $\displaystyle\underset{(\eta,\Theta)}{\text{minimize}}$ $\displaystyle\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\Sigma_{{\mathfrak{e}}}\Bigr{)}+2\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}{B}^{\mathsf{T}}QD\Sigma_{{\mathfrak{e}}}^{\prime}\Bigr{)}+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta$ $\displaystyle\quad+2\bigl{(}x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}{B}^{\mathsf{T}}QD\mu_{w}+x_{0}^{\mathsf{T}}A^{\mathsf{T}}QB\Theta\mu_{\mathfrak{e}}\bigr{)}$ $\displaystyle\quad+2\eta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\Theta\mu_{\mathfrak{e}}+c$ subject to $\displaystyle\text{$\Theta$ strictly lower block triangular as in~{}\eqref{e:Thetadef}},$ $\displaystyle\begin{cases}p=1:&\left\lVert{\eta_{t}}\right\rVert_{1}+\mathcal{E}t\left\lVert{\Theta_{t}}\right\rVert_{1}\leqslant U_{\max}^{(1)},\quad\forall\,t=0,1,\ldots,N-1,\\\ p=\infty:&\left\lVert{\eta_{t}}\right\rVert_{\infty}+\mathcal{E}\left\lVert{\Theta_{t}}\right\rVert_{\infty}\leqslant U_{\max}^{(\infty)},,\quad\forall\,t=0,1,\ldots,N-1,\\\ p=2:&\left\lVert{\begin{bmatrix}\eta_{t}&\Theta_{t}\end{bmatrix}}\right\rVert_{2}\mathchoice{{\hbox{$\displaystyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}\leqslant U_{\max}^{(2)},\quad\forall\,t=0,1,\ldots,N-1,\end{cases}$ where $\displaystyle\Sigma_{{\mathfrak{e}}}$ $\displaystyle\coloneqq\mathbb{E}\bigl{[}{\mathfrak{e}}(w){\mathfrak{e}}(w)^{\mathsf{T}}\bigr{]},$ $\displaystyle\Sigma_{{\mathfrak{e}}}^{\prime}$ $\displaystyle\coloneqq\mathbb{E}\bigl{[}w{\mathfrak{e}}(w)^{\mathsf{T}}\bigr{]},$ $\displaystyle\mu_{w}$ $\displaystyle\coloneqq\mathbb{E}[w],\quad\quad\mu_{\mathfrak{e}}\coloneqq\mathbb{E}[{\mathfrak{e}}(w)],$ $\displaystyle c$ $\displaystyle\coloneqq x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QAx_{0}+2x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QD\mu+\operatorname{\mathbf{tr}}\bigl{(}{D}^{\mathsf{T}}QD\Sigma_{w}\bigr{)}.$ ###### Proof of Theorem 3.2. It is easy to see that $x^{\mathsf{T}}Qx+u^{\mathsf{T}}Ru$ is convex nondecreasing, and both $x$ and $u$ are affine functions of the design parameters $(\eta,\Theta)$ for any realization of the noise $w$. Hence, $V_{0}$ is convex in $(\eta,\Theta)$ since taking expectations of a convex function retains convexity [BV04, Section 3.2]. Moreover, the control constraint sets in (3.4) are convex in $(\eta,\Theta)$. This settles the first claim. The objective function (2.2) is given by $\displaystyle\mathbb{E}_{x_{0}}$ $\displaystyle\bigl{[}\bigl{(}Ax_{0}+Bu+Dw\bigr{)}^{\mathsf{T}}Q\bigl{(}Ax_{0}+Bu+Dw\bigr{)}\bigr{]}+\mathbb{E}_{x_{0}}\bigl{[}{u}^{\mathsf{T}}Ru\bigr{]}$ $\displaystyle=\mathbb{E}_{x_{0}}\bigl{[}\bigl{(}Ax_{0}+B(\eta+\Theta{\mathfrak{e}}(w))+Dw\bigr{)}^{\mathsf{T}}Q\bigl{(}Ax_{0}+B(\eta+\Theta{\mathfrak{e}}(w))+Dw\bigr{)}\bigr{]}$ $\displaystyle\quad+\mathbb{E}_{x_{0}}\bigl{[}(\eta+\Theta{\mathfrak{e}}(w))^{\mathsf{T}}R(\eta+\Theta{\mathfrak{e}}(w))\bigr{]}$ $\displaystyle=x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QAx_{0}+2x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta$ $\displaystyle\quad+2\bigl{(}Ax_{0}+B\eta\bigr{)}^{\mathsf{T}}Q\bigl{(}B\Theta\mathbb{E}_{x_{0}}[{\mathfrak{e}}(w)]+D\mathbb{E}_{x_{0}}[w]\bigr{)}$ $\displaystyle\quad+\mathbb{E}_{x_{0}}\bigl{[}\bigl{(}B\Theta{\mathfrak{e}}(w)+Dw\bigr{)}^{\mathsf{T}}Q\bigl{(}B\Theta{\mathfrak{e}}(w)+Dw\bigr{)}\bigr{]}+\mathbb{E}_{x_{0}}\bigl{[}(\Theta{\mathfrak{e}}(w))^{\mathsf{T}}R\Theta{\mathfrak{e}}(w)\bigr{]}$ $\displaystyle=x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QAx_{0}+2x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta+2\eta^{\mathsf{T}}R\Theta\mathbb{E}[{\mathfrak{e}}(w)]$ $\displaystyle\quad+2\bigl{(}Ax_{0}+B\eta\bigr{)}^{\mathsf{T}}Q\bigl{(}D\mathbb{E}_{x_{0}}[w]+B\Theta\mathbb{E}[{\mathfrak{e}}(w)]\bigr{)}+\operatorname{\mathbf{tr}}\Bigl{(}{D}^{\mathsf{T}}QD\mathbb{E}_{x_{0}}\bigl{[}w^{\mathsf{T}}\bigr{]}\Bigr{)}$ $\displaystyle\quad+\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\mathbb{E}_{x_{0}}\bigl{[}{\mathfrak{e}}(w){\mathfrak{e}}(w)^{\mathsf{T}}\bigr{]}\Bigr{)}+2\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}{B}^{\mathsf{T}}QD\mathbb{E}_{x_{0}}\bigl{[}w{\mathfrak{e}}(w)^{\mathsf{T}}\bigr{]}\Bigr{)}.$ Incorporating the definitions $\Sigma_{{\mathfrak{e}}}$, $\Sigma_{{\mathfrak{e}}}^{\prime}$, $\mu_{w}$, $\mu_{\mathfrak{e}}$, and $c$, the right-hand side above equals $\displaystyle\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\Sigma_{{\mathfrak{e}}}\Bigr{)}+2\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}{B}^{\mathsf{T}}QD\Sigma_{{\mathfrak{e}}}^{\prime}\Bigr{)}+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta$ $\displaystyle\quad+2\bigl{(}x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}{B}^{\mathsf{T}}QD\mu_{w}+x_{0}^{\mathsf{T}}A^{\mathsf{T}}QB\Theta\mu_{\mathfrak{e}}\bigr{)}+2\eta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\Theta\mu_{\mathfrak{e}}$ $\displaystyle\quad+\bigl{(}x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QAx_{0}+2x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QD\mu_{w}+\operatorname{\mathbf{tr}}\bigl{(}{D}^{\mathsf{T}}QD\Sigma_{w}\bigr{)}\bigr{)}$ $\displaystyle=\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\Sigma_{{\mathfrak{e}}}\Bigr{)}+2\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}{B}^{\mathsf{T}}QD\Sigma_{{\mathfrak{e}}}^{\prime}\Bigr{)}+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta$ $\displaystyle\quad+2\bigl{(}x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}{B}^{\mathsf{T}}QD\mu_{w}+x_{0}^{\mathsf{T}}A^{\mathsf{T}}QB\Theta\mu_{\mathfrak{e}}\bigr{)}+2\eta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\Theta\mu_{\mathfrak{e}}+c.$ Since the matrix $\Sigma_{{\mathfrak{e}}}$ is positive semidefinite, it can be expressed as a finite nonnegative linear combination of matrices of the type $\sigma\sigma^{\mathsf{T}}$, for vectors $\sigma$ of appropriate dimension [BSM03, Theorem 1.10]. Accordingly, if $\Sigma_{{\mathfrak{e}}}=\sum_{i=1}^{k}\sigma_{i}\sigma_{i}^{\mathsf{T}}$, then $\displaystyle\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\Sigma_{{\mathfrak{e}}}\Bigr{)}$ $\displaystyle=\sum_{i=1}^{k}\operatorname{\mathbf{tr}}\bigl{(}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\sigma_{i}\sigma_{i}^{\mathsf{T}}\bigr{)}$ $\displaystyle=\sum_{i=1}^{k}\Bigl{(}\sigma_{i}^{\mathsf{T}}\Theta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\Theta\sigma_{i}\Bigr{)}.$ Defining $\widehat{\Theta}_{i}\coloneqq\Theta\sigma_{i}$ and adjoining these equalities to the constraints of the optimization program (3.5), we arrive at the optimization program (3.6) $\displaystyle\underset{(\Theta,\widehat{\Theta}_{1},\ldots,\widehat{\Theta}_{k})}{\text{minimize}}$ $\displaystyle\sum_{i=1}^{k}\widehat{\Theta}_{i}^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\widehat{\Theta}_{i}+2\operatorname{\mathbf{tr}}\Bigl{(}\Theta^{\mathsf{T}}{B}^{\mathsf{T}}QD\Sigma_{{\mathfrak{e}}}^{\prime}\Bigr{)}+\eta^{\mathsf{T}}\bigl{(}{B}^{\mathsf{T}}QB+R\bigr{)}\eta$ $\displaystyle\qquad+2\bigl{(}x_{0}^{\mathsf{T}}{A}^{\mathsf{T}}QB\eta+\eta^{\mathsf{T}}{B}^{\mathsf{T}}QD\mu+x_{0}^{\mathsf{T}}A^{\mathsf{T}}QB\Theta\mu^{\mathfrak{e}}\bigr{)}$ $\displaystyle\qquad+2\eta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\Theta\mu^{\mathfrak{e}}+c$ subject to $\displaystyle\Theta\text{ strictly lower block triangular as in~{}\eqref{e:Thetadef}},$ $\displaystyle\widehat{\Theta}_{i}=\Theta\sigma_{i}\quad\text{for all }i=1,\ldots,k.$ We see immediately that (3.6) is a convex program in the parameters $\eta$, $\Theta$ and $\widehat{\Theta}_{i}$, and is equivalent to the cost in (3.5). It only remains to consider the last constraint in (3.5). First we consider the cases of $p=1,\infty$. Using the notation above, an application of the triangle inequality immediately shows that the constraints can be written as (3.7) $\displaystyle\begin{cases}p=1:&\left\lVert{\eta_{t}}\right\rVert_{1}+\mathcal{E}t\left\lVert{\Theta_{t}}\right\rVert_{1}\leqslant U_{\max}^{(1)},\quad\forall\,t=0,1,\ldots,N-1,\\\ p=\infty:&\left\lVert{\eta_{t}}\right\rVert_{\infty}+\mathcal{E}\left\lVert{\Theta_{t}}\right\rVert_{\infty}\leqslant U_{\max}^{(\infty)},\quad\forall\,t=0,1,\ldots,N-1.\end{cases}$ It follows that the objective function in (3.6) is quadratic and the constraints in (3.6)-(3.7) are affine in the optimization parameters $\eta$, $\Theta$, and $\widehat{\Theta}$. As such, for $p=1,\infty$ our problem is a quadratic program. For the case of $p=2$, note that $\eta_{t}+\Theta_{t}{\mathfrak{e}}(w)=\begin{bmatrix}\eta_{t}&\Theta_{t}\end{bmatrix}\begin{bmatrix}1\\\ {\mathfrak{e}}(w)\end{bmatrix}$, and by definition of $\mathcal{E}$ it is clear that $\left\lVert{\begin{bmatrix}\eta_{t}&\Theta_{t}\end{bmatrix}\begin{bmatrix}1\\\ {\mathfrak{e}}(w)\end{bmatrix}}\right\rVert_{2}\leqslant\left\lVert{\begin{bmatrix}\eta_{t}&\Theta_{t}\end{bmatrix}}\right\rVert_{2}\mathchoice{{\hbox{$\displaystyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}$. This immediately translates to $\left\lVert{\begin{bmatrix}\eta_{t}&\Theta_{t}\end{bmatrix}}\right\rVert_{2}\mathchoice{{\hbox{$\displaystyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+\mathcal{E}t\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}\leqslant U_{\max}^{(2)}$, which is the third constraint in Problem 3.5 and it is a quadratic constraint in the optimization parameters $(\eta,\Theta)$. Therefore, for $p=2$ our problem is a quadratically constrained quadratic program. ∎ The optimization problem (3.5) simplifies if we assume that $\mu^{\mathfrak{e}}=\mathbb{E}[{\mathfrak{e}}(w)]=0$. Note that $\mathbb{E}[{\mathfrak{e}}(w)]=0$ if and only if $\mathbb{E}\bigl{[}{\mathfrak{e}}_{t,i}^{\nu}(w_{t,i})\bigr{]}=0$ for all $\nu\in\mathcal{I}$. At an intuitive level this translates to the condition that the functions ${\mathfrak{e}}_{t,i}^{\nu}\in\mathcal{H}$ should be “centered” with respect to the random variables $w_{t,i}$. In particular, this simply means that for noise distributions that are symmetric about $0$, the functions ${\mathfrak{e}}^{\nu}$ should be centered at $0$ and be antisymmetric. For example, if the noise is Gaussian with mean $0$ and diagonal covariance matrix (uncorrelated components), each component of the functions ${\mathfrak{e}}^{\nu}$ should be an odd function. The matrices $\Sigma_{{\mathfrak{e}}}$, $\Sigma_{{\mathfrak{e}}}^{\prime}$, the vector $v$, and the number $c$ in Theorem 3.2 are all constants independent of $x_{0}$, and can be computed off-line. As such, even if closed- form expressions for the entries of the matrices do not exist, they can be numerically computed to desired precision. The optimization problem (3.5) is a quadratic program [BV04, p. 152] for $p=1,\infty$, and a quadratically constrained quadratic program [BV04, p. 152] for $p=2$, in the optimization parameters $\bigl{\\{}\eta,\Theta,\bigl{\\{}\widehat{\Theta}_{i},i=1,\ldots,k\bigr{\\}}\bigr{\\}}$, and can be easily coded in standard software packages such as cvx [GB00] or YALMIP [Löf04]. Note that the optimization problem (3.5) is always feasible (simply set $\Theta=0$ and $\eta=0$ to see this). This is not a surprise, since there are no constraints on the state, and by construction $0\in\mathbb{U}$. Finally, note that the third constraint in Problem (3.5) for various values of $p$, is a result of robustly satisfying the constraints posed by the various control sets (3.4) for any realization of the noise $w$. In general, the total number of decision variables in the optimization program (3.5) is $mN\bigl{(}1+\tfrac{1}{2}n(N-1)|\mathcal{I}|\bigr{)}$. The number of decision variables can be substantially reduced, e.g., by choosing $\mathcal{H}$ to be $1$-dimensional, or by fixing certain (block) elements of the Fourier coefficient matrix $\Theta$ to $0$. ## 4\. Various Cases of Constrained Controls We examine in this section several special cases of Theorem 3.2 under various restrictions on the classes of noise and control inputs. ### 4.1. Bounded controls, unbounded noise, and $p=\infty$ Let the noise take values in $\mathbb{R}^{n}$. We provide tractable convex programs to design a policy that by construction respects the control constraint sets (3.4), with $p=\infty$. Starting from (3.1) let (4.1) $u=\eta+\Theta\varphi(w),$ where * • $\varphi(w)\coloneqq\left[\begin{matrix}\varphi_{0}\\\ \varphi_{1}(w_{0})\\\ \vdots\\\ \varphi_{N-1}(w_{0},\ldots,{w}_{N-2})\end{matrix}\right]$, * • $\varphi_{0}=0$, $\varphi_{t}(w_{0},\ldots,w_{t-1})=\sum_{j=0}^{t-1}\theta_{t}^{j}\varphi_{t,j}(w_{j})$ for $t=1,\ldots,N-2$, and * • $\varphi_{t,j}(w_{j})=\bigl{[}\widetilde{\varphi}(w_{j,1}),\ldots,\widetilde{\varphi}(w_{j,n})\bigr{]}^{\mathsf{T}}$ for some function $\widetilde{\varphi}$ such that $\sup\limits_{s\in\mathbb{R}}\widetilde{\varphi}(s)=\phi_{\max}<\infty$, and $\varphi_{t,j}:\mathbb{W}\to\mathbb{U}_{\infty}$. In other words, we saturate the measurements that we obtain from the noise input vector before inserting them into our control vector. This way we allow that the noise distribution is supported over the entire $\mathbb{R}^{n}$, which is an advantage over other approaches [BB07, GKM06]. Moreover, the choice of the component saturation function $\widetilde{\varphi}$ is left open as long as the noise sequence satisfies Assumption 3.1. For example, we can accommodate standard saturation, piecewise linear, and sigmoidal functions to name a few. Our choice of saturating the measurement from the noise vectors, as we shall see below, renders the resulting optimization problem tractable as opposed to calculating the entire control input vector $u$ and then saturating it a posteriori; one can see that the latter approach tends to lead to an intractable optimization problem. Note also that the choice of control inputs in (4.1) yields a possibly non-Markovian feedback. ###### Corollary 4.1. Consider the system (2.1). Suppose that Assumption 3.1 holds, and $\mathbb{E}[{\mathfrak{e}}(w)]=0$ with ${\mathfrak{e}}(w)=\varphi(w)$, where $\varphi$ is defined in (4.1). Then for $p=\infty$ the problem (2.6) under the control policy (4.1) is a convex optimization program with respect to the decision variables $(\eta,\Theta)$, given by (4.2) $\displaystyle\underset{(\eta,\Theta)}{\text{minimize}}$ $\displaystyle\mathbf{tr}\\!\left(\Theta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\Theta\Gamma_{1}\right)+2\mathbf{tr}\\!\left(DQB\Theta\Gamma_{2}\right)$ $\displaystyle+\eta^{\mathsf{T}}\bigl{(}R+B^{\mathsf{T}}QB\bigr{)}\eta+b^{\mathsf{T}}\eta+c$ subject to $\displaystyle\max\limits_{i=1,\cdots,m}\left(|\eta_{t,i}|+\left\lVert{\Theta_{t,i}}\right\rVert_{1}\phi_{\rm max}\right)\leqslant U_{\max}^{(\infty)},\quad t=0,\ldots,N-1,$ $\displaystyle\text{and $\Theta$ strictly lower block triangular as in~{}\eqref{e:Thetadef}},$ where $\eta_{t,i}$ and $\Theta_{t,i}$ are the $i$-th rows of $\eta_{t}$ and $\Theta_{t}$, respectively, $\displaystyle c$ $\displaystyle=x_{0}^{\mathsf{T}}AQAx_{0}+\mathbf{tr}\\!\left(D^{\mathsf{T}}QD\Sigma_{\bar{w}}\right),$ $\displaystyle b$ $\displaystyle=2B^{\mathsf{T}}QAx_{0},$ $\displaystyle\Gamma_{1}$ $\displaystyle=\mathrm{diag}\bigl{\\{}\mathbb{E}\bigl{[}\varphi_{0}(w_{0})\varphi_{0}(w_{0})^{\mathsf{T}}\bigr{]},\cdots,\mathbb{E}\bigl{[}\varphi_{N-1}(w_{N-1})\varphi_{N-1}(w_{N-1})^{\mathsf{T}}\bigr{]}\bigr{\\}},$ $\displaystyle\Gamma_{2}$ $\displaystyle=\mathrm{diag}\bigl{\\{}\mathbb{E}\bigl{[}\varphi_{0}(w_{0})w_{0}^{\mathsf{T}}\bigr{]},\cdots,\mathbb{E}\bigl{[}\varphi_{N-1}(w_{N-1})w_{N-1}^{\mathsf{T}}\bigr{]}\bigr{\\}}.$ The resulting policy is guaranteed to satisfy the control constraint set (3.4) for $p=\infty$. A complete proof may be found in [HCL09]; it proceeds along the lines of the proof of Theorem 3.2. Note that the program (4.2) exactly solves (2.6) under the policy (4.1) and is neither a restriction nor a relaxation. Problem (4.2) is a quadratic program in the optimization parameters $(\eta,\Theta)$ (see the discussion following Theorem 3.2). The matrices $\Gamma_{1}$ and $\Gamma_{2}$ capture the statistics of the noise in the presence of the functions $\varphi$ and can be computed numerically _off-line_ using Monte Carlo techniques [RC04, Section 3.2]. This method will be utilized in the examples in Section 6. However, in some instances it is actually possible to compute these matrices in closed form; this is shown in the next three examples. ###### Example 4.2. Let us consider (2.1) when the noise process $(w_{t})_{t\in\mathbb{N}_{0}}$ is an i.i.d sequence of Gaussian random vectors of mean $0$ and covariance $\Sigma$ and standard sigmoidal policy functions $\widetilde{\varphi}$, i.e., $\widetilde{\varphi}(t)\coloneqq t/\mathchoice{{\hbox{$\displaystyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\textstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\scriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=5.59444pt,depth=-4.47557pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.36427pt,depth=-3.49144pt}}}$. Assume further that the components of $w_{t}$ are mutually independent, which implies that $\Sigma$ is a diagonal matrix $\operatorname{diag}\\{\sigma_{1}^{2},\ldots,\sigma_{n}^{2}\\}$. Then from the identities in Fact 1 in §A.1, we have for $i=1,\ldots,n$ and $j=0,\ldots,N-1$, $\displaystyle\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{j,i})^{2}\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{-\infty}^{\infty}\widetilde{\varphi}(t)^{2}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t=2\cdot\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{0}^{\infty}\frac{t^{2}}{1+t^{2}}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}$ $\displaystyle=\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}-\pi\mathrm{e}^{-\frac{1}{2\sigma_{i}^{2}}}\operatorname{erfc}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\Bigr{)}.$ This shows that the matrix $\Gamma_{1}$ in Corollary 4.1 is $\operatorname{diag}\\{\Sigma^{\prime},\ldots,\Sigma^{\prime}\\}$, where $\Sigma^{\prime}\coloneqq\operatorname{diag}\left\\{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{1}-\pi\mathrm{e}^{-\frac{1}{2\sigma_{1}^{2}}}\operatorname{erfc}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{1}}\Bigr{)},\ldots,\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{n}-\pi\mathrm{e}^{-\frac{1}{2\sigma_{n}^{2}}}\operatorname{erfc}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{n}}\Bigr{)}\right\\}.$ Similarly, since $\displaystyle\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{j,i})w_{j,i}\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{-\infty}^{\infty}t\widetilde{\varphi}(t)\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t=2\cdot\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{-\infty}^{\infty}\frac{t^{2}}{\mathchoice{{\hbox{$\displaystyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\textstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\scriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=5.59444pt,depth=-4.47557pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.36427pt,depth=-3.49144pt}}}}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}}}\mathrm{d}t$ $\displaystyle=\frac{\sigma_{i}}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}}U\Bigl{(}\frac{1}{2},0,\frac{1}{2\sigma_{i}^{2}}\Bigr{)},$ where $U$ is the confluent hypergeometric function (defined in the Appendix), the matrix $\Gamma_{2}$ in Corollary 4.1 is $\operatorname{diag}\\{\Sigma^{\prime\prime},\ldots,\Sigma^{\prime\prime}\\}$, where $\Sigma^{\prime\prime}\coloneqq\operatorname{diag}\left\\{\frac{\sigma_{1}}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}}U\Bigl{(}\frac{1}{2},0,\frac{1}{2\sigma_{1}^{2}}\Bigr{)},\ldots,\frac{\sigma_{n}}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}}U\Bigl{(}\frac{1}{2},0,\frac{1}{2\sigma_{n}^{2}}\Bigr{)}\right\\}.$ Therefore, given the system (2.1), the control policy (4.6), and the description of the noise input as above, the matrices $\Gamma_{1}$ and $\Gamma_{2}$ derived above complete the set of hypotheses of Corollary 4.1. The problem (2.4) can now be solved as the quadratic program (4.2).$\triangle$ ###### Example 4.3. Consider the setting of Example 4.2 (with $\widetilde{\varphi}$ a standard sigmoid) under the assumption that $\Sigma$ is a not necessarily diagonal matrix. To wit, the components of $w_{t}$ may be correlated at each time $t\in\mathbb{N}_{0}$; however, the random vector sequence $(w_{t})_{t\in\mathbb{N}_{0}}$ is assumed to be i.i.d. This is equivalent to the knowledge of the correlations between the random variables $\bigl{\\{}w_{t,i}\big{|}i=1,\ldots,n\bigr{\\}}$, which are constant over $t$. Then $\mathbb{E}[\varphi(\bar{w})\varphi(\bar{w})^{\mathsf{T}}]$ is a block diagonal matrix. Indeed, we have with $\Sigma_{i,j}\coloneqq\begin{bmatrix}\sigma_{i}^{2}&\rho_{i,j}^{2}\\\ \rho_{i,j}^{2}&\sigma_{j}^{2}\end{bmatrix}$, $\displaystyle\mathbb{E}\bigl{[}$ $\displaystyle\widetilde{\varphi}(w_{t,i})\widetilde{\varphi}(w_{t,j})\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\det{\Sigma_{i,j}}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\textstyle\sqrt{2\pi\det{\Sigma_{i,j}}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\det{\Sigma_{i,j}}\,}$}\lower 0.4pt\hbox{\vrule height=4.8611pt,depth=-3.8889pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\det{\Sigma_{i,j}}\,}$}\lower 0.4pt\hbox{\vrule height=3.47221pt,depth=-2.77779pt}}}}\iint_{\mathbb{R}^{2}}\frac{t_{1}t_{2}}{\mathchoice{{\hbox{$\displaystyle\sqrt{(1+t_{1}^{2})(1+t_{2}^{2})\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\textstyle\sqrt{(1+t_{1}^{2})(1+t_{2}^{2})\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\scriptstyle\sqrt{(1+t_{1}^{2})(1+t_{2}^{2})\,}$}\lower 0.4pt\hbox{\vrule height=5.59444pt,depth=-4.47557pt}}}{{\hbox{$\scriptscriptstyle\sqrt{(1+t_{1}^{2})(1+t_{2}^{2})\,}$}\lower 0.4pt\hbox{\vrule height=4.36427pt,depth=-3.49144pt}}}}\exp\biggl{(}-\frac{1}{2}\begin{bmatrix}t_{1}&t_{2}\end{bmatrix}\Sigma_{i,j}^{-1}\begin{bmatrix}t_{1}\\\ t_{2}\end{bmatrix}\biggr{)}\;\mathrm{d}t_{1}\mathrm{d}t_{2},$ and $\displaystyle\mathbb{E}\bigl{[}$ $\displaystyle\widetilde{\varphi}(w_{t,i})w_{t,j}\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\det\Sigma_{i,j}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\textstyle\sqrt{2\pi\det\Sigma_{i,j}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\det\Sigma_{i,j}\,}$}\lower 0.4pt\hbox{\vrule height=4.8611pt,depth=-3.8889pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\det\Sigma_{i,j}\,}$}\lower 0.4pt\hbox{\vrule height=3.47221pt,depth=-2.77779pt}}}}\iint_{\mathbb{R}^{2}}\frac{t_{1}t_{2}}{\mathchoice{{\hbox{$\displaystyle\sqrt{1+t_{1}^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\textstyle\sqrt{1+t_{1}^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\scriptstyle\sqrt{1+t_{1}^{2}\,}$}\lower 0.4pt\hbox{\vrule height=5.59444pt,depth=-4.47557pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+t_{1}^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.36427pt,depth=-3.49144pt}}}}\exp\biggl{(}-\frac{1}{2}\begin{bmatrix}t_{1}&t_{2}\end{bmatrix}\Sigma_{i,j}^{-1}\begin{bmatrix}t_{1}\\\ t_{2}\end{bmatrix}\biggr{)}\;\mathrm{d}t_{1}\mathrm{d}t_{2}.$ Note that the computations of the integrals above can be carried out off-line. We define the matrices $\Sigma_{t}$ and $\Sigma_{t}^{\prime}$ with the $(i,j)$-th entry of $\Sigma_{t}$ being $\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{t,i})\widetilde{\varphi}(w_{t,j})\bigr{]}$ and the $(i,j)$-th entry of $\Sigma_{t}^{\prime}$ being $\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{t,i})w_{t,j}\bigr{]}$, and it follows that the matrices $\Gamma_{1}=\operatorname{diag}\bigl{\\{}\Sigma_{0},\ldots,\Sigma_{N-2}\bigr{\\}}$, and $\Gamma_{2}=\operatorname{diag}\bigl{\\{}\Sigma_{0}^{\prime},\ldots,\Sigma_{N-2}^{\prime}\bigr{\\}}$. $\triangle$ ###### Example 4.4. Consider the system (2.1) as in Example 4.2, and with $\widetilde{\varphi}$ the standard saturation function defined as $\widetilde{\varphi}(t)=\operatorname{sgn}(t)\min\\{|t|,1\\}$. From Corollary 4.1 we have for $i=1,\ldots,n$ and $j=0,\ldots,N-1$, using the identities in Fact 1 in §A.1, $\displaystyle\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{j,i})^{2}\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{-\infty}^{\infty}\widetilde{\varphi}(t)^{2}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t$ $\displaystyle=\frac{2}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{0}^{1}t^{2}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t+\frac{2}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{1}^{\infty}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t$ $\displaystyle=\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}^{3}\operatorname{erf}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\Bigr{)}-2\sigma_{i}^{2}\mathrm{e}^{-\frac{1}{2\sigma_{i}^{2}}}+1+\operatorname{erf}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\Bigr{)}$ $\displaystyle\eqqcolon\xi_{i}^{\prime}\text{ (say)},$ and $\displaystyle\mathbb{E}\bigl{[}\widetilde{\varphi}(w_{j,i})w_{j,i}\bigr{]}$ $\displaystyle=\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{-\infty}^{\infty}t\widetilde{\varphi}(t)\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t$ $\displaystyle=\frac{2}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{0}^{1}t^{2}\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t+\frac{2}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\int_{1}^{\infty}t\mathrm{e}^{-\frac{t^{2}}{2\sigma_{i}^{2}}}\mathrm{d}t$ $\displaystyle=\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}^{3}\operatorname{erf}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma_{i}}\Bigr{)}-2\sigma_{i}^{2}\mathrm{e}^{-\frac{1}{2\sigma_{i}^{2}}}+\mathchoice{{\hbox{$\displaystyle\sqrt{\frac{2}{\pi}\,}$}\lower 0.4pt\hbox{\vrule height=8.59721pt,depth=-6.8778pt}}}{{\hbox{$\textstyle\sqrt{\frac{2}{\pi}\,}$}\lower 0.4pt\hbox{\vrule height=6.01805pt,depth=-4.81447pt}}}{{\hbox{$\scriptstyle\sqrt{\frac{2}{\pi}\,}$}\lower 0.4pt\hbox{\vrule height=4.2986pt,depth=-3.4389pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\frac{2}{\pi}\,}$}\lower 0.4pt\hbox{\vrule height=4.2986pt,depth=-3.4389pt}}}\sigma_{i}\operatorname{Gamma}(2\sigma_{i}^{2},1)$ $\displaystyle\eqqcolon\xi_{i}^{\prime\prime}\text{ (say)}.$ Therefore, in this case the matrix $\Gamma_{1}$ in Corollary 4.1 is $\operatorname{diag}\\{\Sigma^{\prime},\ldots,\Sigma^{\prime}\\}$ with $\Sigma^{\prime}\coloneqq\operatorname{diag}\\{\xi_{1}^{\prime},\ldots,\xi_{n}^{\prime}\\}$, and the matrix $\Gamma_{2}$ is $\operatorname{diag}\\{\Sigma^{\prime\prime},\ldots,\Sigma^{\prime\prime}\\}$ with $\Sigma^{\prime\prime}\coloneqq\operatorname{diag}\\{\xi_{1}^{\prime\prime},\ldots,\xi_{n}^{\prime\prime}\\}$. These information complete the set of hypotheses of Corollary 4.1, and the problem (2.4) can now be solved as a quadratic program (4.2).$\triangle$ ### 4.2. Bounded controls, bounded noise, and $p=2$ In this subsection we specialize to the case of the noise being drawn from a compact subset of $\mathbb{R}^{n}$, and the control inputs set $\mathbb{U}_{2}$. We make the following assumption: ###### Assumption 4.5. The noise takes values in a compact set $\mathbb{W}\subseteq\mathbb{R}^{n}$.$\diamondsuit$ Under Assumption 4.5 Hilbert space techniques may be effectively employed in our basic controller synthesis framework of Section 3 in the following way. Let $(\mathcal{H},\left\langle{\cdot},{\cdot}\right\rangle_{\mathcal{H}})$ be a separable Hilbert space of measurable maps ${\mathfrak{e}}:\mathbb{W}\to\mathbb{U}_{2}$ supported on the compact set $\mathbb{W}$. The inner product is defined as $\left\langle{\varphi_{1}},{\varphi_{2}}\right\rangle_{\mathcal{H}}\coloneqq\sum_{i=1}^{n}\left\langle{\varphi_{1,i}},{\varphi_{2,i}}\right\rangle$ where $\left\langle{\cdot},{\cdot}\right\rangle$ is the standard inner product on real-valued functions on $\mathbb{W}$. Fix a complete orthonormal basis $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{I}}\subseteq\mathcal{H}$. Since $\mathcal{H}$ is separable, the set $\mathcal{I}$ is at most countable. Just as in (3.1) we let our candidate control policies be of the form (4.3) $u=\begin{bmatrix}\eta_{0}\\\ \eta_{1}\\\ \vdots\\\ \eta_{N-1}\end{bmatrix}+\begin{bmatrix}\mathbf{0}&\mathbf{0}&\cdots&\mathbf{0}\\\ \theta_{1,0}&\mathbf{0}&\cdots&\mathbf{0}\\\ \theta_{2,0}&\theta_{2,1}&\cdots&\mathbf{0}\\\ \vdots&\vdots&\ddots&\vdots\\\ \theta_{N-1,0}&\theta_{N-1,1}&\cdots&\theta_{N-1,N-2}\end{bmatrix}\begin{bmatrix}{\mathfrak{e}}(w_{0})\\\ {\mathfrak{e}}(w_{1})\\\ \vdots\\\ {\mathfrak{e}}(w_{N-2})\end{bmatrix}\eqqcolon\eta+\Theta{\mathfrak{e}}(w),$ where the vector ${\mathfrak{e}}(\cdot)$ is the formal vector formed by concatenating the (ordered) basis elements $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{I}}$, the various $\theta$-s are formal matrices as in Section 3, and $\eta_{t}$ is an $m$-dimensional vector for $t=0,\ldots,N-1$. This takes us back to the setting of Section 3. The following Corollary illustrates the technique explained above; its proof will only be sketched—it is similar to the proof of Theorem 3.2. Note that for finite-dimensional Hilbert spaces, depending on the choice of the orthonormal basis, the matrix $\Theta$ may have complex or real entries. ###### Corollary 4.6. Consider the system (2.1). Suppose that Assumptions 3.1 and 4.5 hold. Then for $p=2$ and corresponding control set $\mathbb{U}_{2}$ problem (2.6) under the policy (4.3) admits convex tractable reformulation with tighter domains of the decision variables $(\eta,\Theta)$ defined in (4.3), and is equivalent to the following program: (4.4) the minimization problem (3.5) $\displaystyle\text{subject to}\quad\left\lVert{\eta_{t}}\right\rVert+\mathchoice{{\hbox{$\displaystyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}\left\lVert{\Theta_{t}}\right\rVert\leqslant U_{\max}^{(2)},\quad\text{for }t=0,\ldots,N-1,$ $\displaystyle\qquad\qquad\qquad\text{and $\Theta$ strictly lower block triangular as in~{}\eqref{e:Thetadef}}.$ Moreover, if $\hat{\mathcal{H}}$ is a finite-dimensional subspace of $\mathcal{H}$ spanned by $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{J}}$ for some finite $\mathcal{J}\subseteq\mathcal{I}$, then the problem (4.4) admits a reformulation as a quadratically constrained quadratic program with respect to the new decision variables $\bigl{(}\eta,\hat{\Theta}\bigr{)}$ corresponding to $\hat{\mathcal{H}}$, given by (4.5) the minimization problem (3.5) $\displaystyle\text{subject to}\quad\left\lVert{\begin{bmatrix}\eta_{t}&\hat{\Theta}_{t}\end{bmatrix}}\right\rVert\leqslant U_{\max}^{(2)}/\mathchoice{{\hbox{$\displaystyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}\quad\text{for }t=0,\ldots,N-1,$ $\displaystyle\qquad\qquad\qquad\text{and $\Theta$ strictly lower block triangular as in~{}\eqref{e:Thetadef}},$ where the vector ${\hat{\mathfrak{e}}}(\cdot)$ is the vector formed by concatenating the (ordered) basis elements $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{J}}$, ${\hat{\mathfrak{e}}}(w)\coloneqq\bigl{[}{\hat{\mathfrak{e}}}(w_{0})^{\mathsf{T}},\ldots,{\hat{\mathfrak{e}}}(w_{N-2})^{\mathsf{T}}\bigr{]}^{\mathsf{T}}$, $\hat{\Sigma}_{{\mathfrak{e}}}\coloneqq\mathbb{E}\bigl{[}{\hat{\mathfrak{e}}}(w){\hat{\mathfrak{e}}}(w)^{\mathsf{T}}\bigr{]}$, $\hat{\Sigma}_{{\mathfrak{e}}}^{\prime}\coloneqq\mathbb{E}\bigl{[}w{\hat{\mathfrak{e}}}(w)^{\mathsf{T}}\bigr{]}$. In both the above cases the resulting policies are guaranteed to satisfy the control constraint set (3.4) for $p=2$. ###### Proof. (Sketch.) Evaluating the objective function in (2.6) gives the objective function in (3.5). Recall that $\Theta_{t}$ is the $t$-th block row of the formal matrix $\Theta$, and $\Theta_{t,i}$ is the $i$th sub-row of the block row $\Theta_{t}$, where $t=0,\ldots,N-1$ and $i=1,\ldots,n$. Applying the triangle inequality for any $t=0,\ldots,N-1$, we get $\displaystyle\left\lVert{\eta_{t}+\Theta_{t}{\mathfrak{e}}(w)}\right\rVert$ $\displaystyle\leqslant\left\lVert{\eta_{t}}\right\rVert+\left\lVert{\Theta_{t}{\mathfrak{e}}(w)}\right\rVert=\left\lVert{\eta_{t}}\right\rVert+\mathchoice{{\hbox{$\displaystyle\sqrt{\left\langle{\Theta_{t}{\mathfrak{e}}(w)},{\Theta_{t}{\mathfrak{e}}(w)}\right\rangle_{\mathcal{H}}\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\textstyle\sqrt{\left\langle{\Theta_{t}{\mathfrak{e}}(w)},{\Theta_{t}{\mathfrak{e}}(w)}\right\rangle_{\mathcal{H}}\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptstyle\sqrt{\left\langle{\Theta_{t}{\mathfrak{e}}(w)},{\Theta_{t}{\mathfrak{e}}(w)}\right\rangle_{\mathcal{H}}\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\left\langle{\Theta_{t}{\mathfrak{e}}(w)},{\Theta_{t}{\mathfrak{e}}(w)}\right\rangle_{\mathcal{H}}\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}$ $\displaystyle=\left\lVert{\eta_{t}}\right\rVert+\mathchoice{{\hbox{$\displaystyle\sqrt{\sum_{i=1}^{n}\left\langle{\Theta_{t,i}{\mathfrak{e}}(w)},{\Theta_{t,i}{\mathfrak{e}}(w)}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\textstyle\sqrt{\sum_{i=1}^{n}\left\langle{\Theta_{t,i}{\mathfrak{e}}(w)},{\Theta_{t,i}{\mathfrak{e}}(w)}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptstyle\sqrt{\sum_{i=1}^{n}\left\langle{\Theta_{t,i}{\mathfrak{e}}(w)},{\Theta_{t,i}{\mathfrak{e}}(w)}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\sum_{i=1}^{n}\left\langle{\Theta_{t,i}{\mathfrak{e}}(w)},{\Theta_{t,i}{\mathfrak{e}}(w)}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}=\left\lVert{\eta_{t}}\right\rVert+\mathchoice{{\hbox{$\displaystyle\sqrt{(N-1)\sum_{i=1}^{n}\left\lVert{\Theta_{t,i}}\right\rVert^{2}\,}$}\lower 0.4pt\hbox{\vrule height=9.30444pt,depth=-7.44359pt}}}{{\hbox{$\textstyle\sqrt{(N-1)\sum_{i=1}^{n}\left\lVert{\Theta_{t,i}}\right\rVert^{2}\,}$}\lower 0.4pt\hbox{\vrule height=9.30444pt,depth=-7.44359pt}}}{{\hbox{$\scriptstyle\sqrt{(N-1)\sum_{i=1}^{n}\left\lVert{\Theta_{t,i}}\right\rVert^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.78888pt,depth=-7.03114pt}}}{{\hbox{$\scriptscriptstyle\sqrt{(N-1)\sum_{i=1}^{n}\left\lVert{\Theta_{t,i}}\right\rVert^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.78888pt,depth=-7.03114pt}}}$ $\displaystyle=\left\lVert{\eta_{t}}\right\rVert+\mathchoice{{\hbox{$\displaystyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{N-1\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}\left\lVert{\Theta_{t}}\right\rVert$ by orthogonality of the basis elements $({\mathfrak{e}}^{\nu})_{\nu\in\mathcal{I}}$. The right-hand side of the last equality appears as the constraint in (4.4). For the finite-dimensional case (4.5), we note that the objective function is identical to the one in (4.4), and the constraint in (4.5) follows from the fact that $\left\lVert{\eta_{t}+\hat{\Theta}_{t}{\hat{\mathfrak{e}}}(w)}\right\rVert=\left\lVert{\begin{bmatrix}\eta_{t}&\hat{\Theta}_{t}\end{bmatrix}\begin{bmatrix}1\\\ {\hat{\mathfrak{e}}}(w)\end{bmatrix}}\right\rVert$, and $\left\lVert{\begin{bmatrix}1\\\ {\hat{\mathfrak{e}}}(w)\end{bmatrix}}\right\rVert=\mathchoice{{\hbox{$\displaystyle\sqrt{1+\sum_{i=0}^{N-2}\left\langle{{\hat{\mathfrak{e}}}(w_{i})},{{\hat{\mathfrak{e}}}(w_{i})}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\textstyle\sqrt{1+\sum_{i=0}^{N-2}\left\langle{{\hat{\mathfrak{e}}}(w_{i})},{{\hat{\mathfrak{e}}}(w_{i})}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptstyle\sqrt{1+\sum_{i=0}^{N-2}\left\langle{{\hat{\mathfrak{e}}}(w_{i})},{{\hat{\mathfrak{e}}}(w_{i})}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+\sum_{i=0}^{N-2}\left\langle{{\hat{\mathfrak{e}}}(w_{i})},{{\hat{\mathfrak{e}}}(w_{i})}\right\rangle\,}$}\lower 0.4pt\hbox{\vrule height=7.5pt,depth=-6.00003pt}}}=\mathchoice{{\hbox{$\displaystyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{N\,}$}\lower 0.4pt\hbox{\vrule height=3.41666pt,depth=-2.73334pt}}}$. This leads to a quadratically constrained quadratic program in the finite- dimensional decision variables $\bigl{(}\eta,\hat{\Theta}\bigr{)}$. ∎ Let us illustrate the usage of Corollary 4.6 through the following example. ###### Example 4.7. Consider the system (2.1), and suppose that the $n$ components of the noise vector $w_{t}$ are independent uniform random variables taking values in $[-a,a]$ for some $a>1$. Therefore, $\mathbb{W}=[-a,a]^{n}$. It is a standard fact in Fourier analysis that the system $\bigl{\\{}\mathrm{e}^{2\pi\mathrm{i}\nu(t/(2a))}\,\big{|}\,\nu\in\mathbb{Z}\bigr{\\}}$ is an orthonormal basis for the Hilbert space of square-integrable functions on $[-a,a]$ equipped with the standard inner product $\left\langle{f},{g}\right\rangle\coloneqq\frac{1}{2a}\int_{-a}^{a}f(t)g(t){\mathrm{d}t}$. We let $\displaystyle\hat{\mathcal{H}}$ $\displaystyle\coloneqq\operatorname{span}\Biggl{\\{}\biggl{[}\frac{\sin(\pi\nu t_{1}/a)}{\mathchoice{{\hbox{$\displaystyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=4.30554pt,depth=-3.44446pt}}}{{\hbox{$\textstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=4.30554pt,depth=-3.44446pt}}}{{\hbox{$\scriptstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=3.01389pt,depth=-2.41113pt}}}{{\hbox{$\scriptscriptstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=2.15277pt,depth=-1.72223pt}}}},\ldots,\frac{\sin(\pi\nu t_{n}/2)}{\mathchoice{{\hbox{$\displaystyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=4.30554pt,depth=-3.44446pt}}}{{\hbox{$\textstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=4.30554pt,depth=-3.44446pt}}}{{\hbox{$\scriptstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=3.01389pt,depth=-2.41113pt}}}{{\hbox{$\scriptscriptstyle\sqrt{n\,}$}\lower 0.4pt\hbox{\vrule height=2.15277pt,depth=-1.72223pt}}}}\biggr{]}^{\mathsf{T}}\,\Bigg{|}\,t_{i}\in[-a,a],i=1,\ldots,n,\nu=1,\ldots,M\Biggr{\\}}.$ Let ${\mathfrak{e}}^{\nu}(t_{1},\ldots,t_{n})\coloneqq\mathchoice{{\hbox{$\displaystyle\sqrt{\frac{2}{n}\,}$}\lower 0.4pt\hbox{\vrule height=8.59721pt,depth=-6.8778pt}}}{{\hbox{$\textstyle\sqrt{\frac{2}{n}\,}$}\lower 0.4pt\hbox{\vrule height=6.01805pt,depth=-4.81447pt}}}{{\hbox{$\scriptstyle\sqrt{\frac{2}{n}\,}$}\lower 0.4pt\hbox{\vrule height=4.2986pt,depth=-3.4389pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\frac{2}{n}\,}$}\lower 0.4pt\hbox{\vrule height=4.2986pt,depth=-3.4389pt}}}\bigl{[}\sin(\pi\nu t_{1}/a),\ldots,\sin(\pi\nu t_{n}/a)\bigr{]}^{\mathsf{T}}$, $t_{i}\in[-a,a]$. It is clear that the $\mathbb{R}^{n}$-valued functions $\bigl{\\{}{\mathfrak{e}}^{\nu},\;\nu=1,\ldots,M\bigr{\\}}$ form an orthonormal set. Indeed, $\displaystyle\left\langle{{\mathfrak{e}}_{\nu_{1}}},{{\mathfrak{e}}_{\nu_{2}}}\right\rangle_{\hat{\mathcal{H}}}$ $\displaystyle=\sum_{i=1}^{n}\left\langle{{\mathfrak{e}}_{\nu_{1},i}},{{\mathfrak{e}}_{\nu_{2},i}}\right\rangle=\frac{2}{n}\sum_{i=1}^{n}\frac{1}{2a}\int_{-a}^{a}\sin(\pi\nu_{1}t_{i}/a)\sin(\pi\nu_{2}t_{i}/a)\mathrm{d}t_{i}$ $\displaystyle=\frac{2}{n}\sum_{i=1}^{n}\frac{1}{4}\int_{-1}^{1}\bigl{(}\cos((\nu_{1}-\nu_{2})\pi s_{i})-\cos((\nu_{1}+\nu_{2})\pi s_{i})\bigr{)}\mathrm{d}s_{i}$ $\displaystyle=\begin{cases}\frac{1}{2n}\sum_{i=1}^{n}2=1&\text{if }\nu_{1}=\nu_{2},\\\ 0&\text{otherwise}.\end{cases}$ We define $u_{t}\coloneqq\eta_{t}+\Theta_{t}{\mathfrak{e}}(w)=\eta_{t}+\sum_{j=0}^{t-1}\theta_{t,j}{\mathfrak{e}}(w_{j})=\eta_{t}+\sum_{j=0}^{t-1}\sum_{\nu=1}^{M}\theta_{t,j}^{\nu}{\mathfrak{e}}^{\nu}(w_{j})$ for appropriate matrices $\theta_{t,j}^{\nu}$. Now finding policies of the form (4.3) that minimize the objective function in (2.6) becomes straightforward in the setting of Corollary 4.6. The matrices $\Sigma_{{\mathfrak{e}}}$ and $\Sigma_{{\mathfrak{e}}}^{\prime}$ in Corollary 4.6 are now easy to derive from Euler’s identity $\mathrm{e}^{\mathrm{i}\theta}=\cos\theta+\mathrm{i}\sin\theta$, and the fact that the characteristic function of a uniform random variable $\zeta$ supported on $[-a,a]$ is given by $\mathbb{E}\bigl{[}\mathrm{e}^{2\pi\mathrm{i}v\zeta}\bigr{]}=\frac{1}{2a}\int_{-a}^{a}\mathrm{e}^{2\pi\mathrm{i}vt}\,\mathrm{d}t=\operatorname{sinc}(2\pi va)$ for some $v\in\mathbb{R}$, where the function $\operatorname{sinc}$ is defined as $\operatorname{sinc}(\xi)\coloneqq\sin(\xi)/\xi$ if $\xi\neq 0$ and $1$ otherwise. An alternative representation of the various matrices may be obtained by looking at each component of the policy elements separately. In this approach we define $\displaystyle{\hat{\mathfrak{e}}}(w_{t,i})$ $\displaystyle\coloneqq\begin{bmatrix}{\mathfrak{e}}_{0}(w_{t,i})&{\mathfrak{e}}_{1}(w_{t,i})&\cdots&{\mathfrak{e}}_{M}(w_{t,i})\end{bmatrix}^{\mathsf{T}},$ $\displaystyle{\hat{\mathfrak{e}}}(w_{t})$ $\displaystyle\coloneqq\begin{bmatrix}{\hat{\mathfrak{e}}}(w_{t,1})^{\mathsf{T}}&\cdots&{\hat{\mathfrak{e}}}(w_{t,n})^{\mathsf{T}}\end{bmatrix}^{\mathsf{T}},\quad{\hat{\mathfrak{e}}}(w)\coloneqq\begin{bmatrix}{\hat{\mathfrak{e}}}(w_{0})^{\mathsf{T}}&\cdots&{\hat{\mathfrak{e}}}(w_{N-2})^{\mathsf{T}}\end{bmatrix}^{\mathsf{T}}.$ In the above notation $\eta_{t,i}+\sum_{j=0}^{t-1}\theta_{j,i}{\hat{\mathfrak{e}}}(w_{j,i})$ is of course the $i$-th entry of the input $u_{t}$ at time $t$, where $t=0,\ldots,N-1$ and $i=1,\ldots,n$. $\triangle$ ### 4.3. Constraints on control energy Some applications require constraints on the total control energy expended over a finite horizon. In the framework that we have established so far, such constraints are easy to incorporate. Indeed, if we require that $u^{\mathsf{T}}Su\leqslant\beta^{2}$ for some preassigned $\beta>0$ and positive definite matrix $S$, then in the setting of Theorem 3.2 this can be ensured by adjoining the condition $\left\lVert{\eta}\right\rVert_{S}+\left\lVert{\Theta}\right\rVert_{S}\left\lVert{S}\right\rVert_{\infty}\mathcal{E}\leqslant\beta$ to the constraints, where $\left\lVert{\eta}\right\rVert_{M}\coloneqq\mathchoice{{\hbox{$\displaystyle\sqrt{\eta^{\mathsf{T}}M\eta\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\textstyle\sqrt{\eta^{\mathsf{T}}M\eta\,}$}\lower 0.4pt\hbox{\vrule height=6.83331pt,depth=-5.46667pt}}}{{\hbox{$\scriptstyle\sqrt{\eta^{\mathsf{T}}M\eta\,}$}\lower 0.4pt\hbox{\vrule height=4.78333pt,depth=-3.82668pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\eta^{\mathsf{T}}M\eta\,}$}\lower 0.4pt\hbox{\vrule height=3.51944pt,depth=-2.81557pt}}}$ is the standard weighted $2$-norm for a positive definite matrix $M$. ### Comparison with affine policies As pointed out earlier affine feedback policies from the noise have been previously treated in [Löf03, BTGGN04, GKM06, GK08], where the following feedback policy was considered: (4.6) $u_{t}=\sum_{i=0}^{t-1}\theta_{t,i}w_{i}+\eta_{t}.$ In the deterministic setting it was shown in [GKM06] that there exists a one- to-one (nonlinear) mapping between control policies in the form (4.6) and the class of affine state feedback policies. That is, provided one is interested in affine state feedback policies, the parametrization (4.6) constitutes no loss of generality. In fact, we shall illustrate in the examples, in the unconstrained inputs case, that the performance of this strategy with ${\mathfrak{e}}(w_{i})$ in place of $w_{i}$ is almost as good as the standard LQG controller if not equally good. However, in the constrained inputs case this choice is suboptimal in the class of measurable control policies, but it ensures tractability of a large class of optimal control problems. It can be seen that the solution to the optimization problem (2.4) is tractable with this parametrization [GKM06]. However, if the elements of the noise vector $w$ are unbounded, the control input (4.6) does not have an upper bound. For the case of bounded inputs, the control policy (4.6) under unbounded noise will in general not satisfy the control constraint sets (3.4). This unboundedness is a potential problem in practical applications, and has been usually circumvented by assuming that the noise input lies within a compact set [BB07, GKM06] and designing a worst-case min-max type controller under this assumption. It is important to point out that our result in Section 4.2 differs from that in [GKM06] in two aspects. First, we are solving the problem on finite- dimensional Hilbert spaces with general basis functions as opposed to a finite collection of affine functions in [GKM06]. Second, the feasibility of our problem is maintained for any bound on the elements of $\mathbb{W}$, as our constraint in (4.5) could still produce a feedback gain matrix $\Theta$ that has norm substantially different that $0$, whereas if there are elements in $\mathbb{W}$ with large enough norm and we take the control input to be $u=\eta+\Theta w$, the constraints produce always a solution $\Theta$ with norm very close to $0$, hence practically only the open-loop term remains in the case of [GKM06]. ## 5\. Stability Analysis The main result in Theorem 3.2 asserts that the finite horizon optimization problem (2.6) is convex and tractable using the policy (3.1). To apply this result in a receding horizon fashion, it is imperative to further study some qualitative stability properties of the proposed policy. Under this policy the closed-loop system is not necessarily Markovian, and as such, standard Foster- Lyapunov methods cannot be directly applied. In what follows, we treat the stability problem for $p=\infty$ and $U_{\max}\coloneqq U_{\max}^{(\infty)}$. However, this is without any loss of generality, for the same results hold (with minor modifications in the proofs) for $p=1,2$ as well. We impose the following assumption: ###### Assumption 5.1. The matrix $A$ in (2.1) is Schur stable, i.e., the absolute value of the eigenvalues of $A$ are all strictly less than $1$.$\diamondsuit$ At a first glance this assumption on $A$ might seem restrictive. Indeed, in the deterministic setting we know [YSS97] that for discrete-time controlled systems it is possible to achieve global asymptotic stability with bounded control inputs if and only if the pair $(A,B)$ is stabilizable with arbitrary controls, and the spectral radius of $A$ is at most $1$. However, the problem of ensuring bounded variance of linear stochastic systems with bounded control inputs is to our knowledge still largely open; see, however, the recent manuscript [RCMA+09] for partial results as well as in [BSW02, SSW06]. ### 5.1. Mean-square boundedness We shall show that the variance of the state is uniformly bounded under receding horizon application of the strategy (3.1), for any control horizon $N_{c}\leqslant N$. The receding horizon implementation is iterative in nature: the optimization problem is solved every $kN_{c}$ steps, where $k\in\mathbb{N}_{0}$. The resulting optimal control policy (applied over a horizon $N_{c}$) is given by $\pi_{kN_{c}:(k+1)N_{c}-1}^{*}(x_{kN_{c}})\coloneqq\left[\begin{matrix}\pi^{*}_{kN_{c}}(x_{kN_{c}})\\\ \pi^{*}_{kN_{c}+1}(x_{kN_{c}})\\\ \vdots\\\ \pi^{*}_{(k+1)N_{c}-1}(x_{kN_{c}})\end{matrix}\right]=\left[\begin{matrix}\eta_{0}^{*}(x_{kN_{c}})\\\ \eta_{1}^{*}(x_{kN_{c}})+\Theta_{1}^{*}(x_{kN_{c}}){\mathfrak{e}}(w)\\\ \vdots\\\ \eta_{N_{c}-1}^{*}(x_{kN_{c}})+\Theta^{*}_{N_{c}-1}(x_{kN_{c}}){\mathfrak{e}}(w)\end{matrix}\right]$ where the control gains depend explicitly on the initial condition $x_{kN_{c}}$. For $\ell=1,\cdots,N_{c}$, the resulting closed-loop system over horizon $N_{c}$ is given by: (5.1) $x_{kN_{c}+\ell}=A^{\ell}x_{kN_{c}}+B_{\ell}\pi_{kN_{c}:kN_{c}+\ell-1}^{*}(x_{kN_{c}})+D_{\ell}\tilde{w}_{kN_{c}:kN_{c}+\ell-1},\qquad k\in\mathbb{N}_{0},$ where $B_{\ell}\coloneqq\left[\begin{matrix}{\bar{A}}^{\ell-1}\bar{B}&\cdots&\bar{A}\bar{B}&\bar{B}\end{matrix}\right]$, $D_{\ell}\coloneqq\left[\begin{matrix}{\bar{A}}^{\ell-1}&\cdots&\bar{A}&\mathbf{I}_{n\times n}\end{matrix}\right]$, and $\tilde{w}_{kN_{c}:kN_{c}+\ell-1}\coloneqq\left[\begin{matrix}w_{kN_{c}}^{\mathsf{T}}&\cdots&w_{kN_{c}+\ell-1}^{\mathsf{T}}\end{matrix}\right]^{\mathsf{T}}$. Suppose that the above $N_{c}$-horizon optimal policy is computed as in Corollary 4.1. We define the receding horizon policy corresponding to the consecutive concatenation of this $N_{c}$-horizon optimal policy as (5.2) $\pi^{*}\coloneqq\bigl{(}\pi_{0:N_{c}-1}^{*}(x_{0}),\;\pi_{N_{c}:2N_{c}-1}^{*}(x_{N_{c}}),\;\pi_{2N_{c}:3N_{c}-1}^{*}(x_{2N_{c}}),\cdots\bigr{)}.$ ###### Proposition 5.2. Consider the system (2.1), and suppose that Assumptions 3.1 and 5.1 hold. For $p=\infty$ and any control horizon $1\leqslant N_{c}\leqslant N$ the receding horizon control policy $\pi^{*}$ renders the closed loop system (5.1) mean- square bounded, i.e., $\sup_{t\in\mathbb{N}_{0}}\mathbb{E}_{x_{0}}\bigl{[}\left\lVert{x_{t}}\right\rVert^{2}\bigr{]}<\infty$ for every initial condition $x_{0}\in\mathbb{R}^{n}$. The proof of this Proposition is postponed to §A.2 in the Appendix. ### 5.2. Input-to-state stability Input-to-state stability (iss) is an interesting and important qualitative property of input-output behavior of dynamical systems. In the deterministic discrete-time setting [JW01], iss generalizes the well-known bounded-input bounded-output (BIBO) property of linear systems [AM06, p. 490] to the setting of nonlinear systems. iss provides a description of the behavior of a system subjected to bounded inputs, and as such it may be viewed as an $\mathcal{L}_{\infty}$ to $\mathcal{L}_{\infty}$ gain of a given nonlinear system. In this section we are interested in a useful stochastic variant of input-to-state stability; see e.g., [Bor00, ST03] for other possible definitions and ideas (primarily in continuous-time). ###### Definition 5.3. The system (2.1) is _input-to-state stable in $\mathcal{L}_{1}$_ if there exist functions $\beta\in\mathcal{KL}$ and $\alpha,\gamma_{1},\gamma_{2}\in\mathcal{K}_{\infty}$ such that for every initial condition $x_{0}\in\mathbb{R}^{n}$ we have (5.3) $\mathbb{E}_{x_{0}}\bigl{[}\alpha(\left\lVert{x_{t}}\right\rVert)\bigr{]}\leqslant\beta(\left\lVert{x_{0}}\right\rVert,t)+\gamma_{1}\Bigl{(}\sup_{s\in\mathbb{N}_{0}}\left\lVert{u_{s}}\right\rVert_{\infty}\Bigr{)}+\gamma_{2}\bigl{(}\left\lVert{\Sigma}\right\rVert^{\prime}\bigr{)}\qquad\forall\,t\in\mathbb{N}_{0},$ where $\left\lVert{\cdot}\right\rVert^{\prime}$ is an appropriate matrix norm.$\Diamond$ One evident difference of iss in $\mathcal{L}_{1}$ with the deterministic definition of iss is the presence of the function $\alpha$ inside the expectation in (5.3). It turns out that often it is more natural to arrive at an estimate of $\mathbb{E}_{x_{0}}[\alpha(\left\lVert{x_{t}}\right\rVert)]$ for some $\alpha\in\mathcal{K}_{\infty}$ than an estimate of $\mathbb{E}_{x_{0}}[\left\lVert{x_{t}}\right\rVert]$. Moreover, in case $\alpha$ is convex, Jensen’s inequality [Dud02, p. 348] implies that such an estimate is stronger than an estimate of $\mathbb{E}_{x_{0}}[\left\lVert{x_{t}}\right\rVert]$. The property expressed by (5.3) is one possible iss-type property for stochastic systems. One can come up with alternative stochastic analogs of the iss property, such as the following: $\forall\,\varepsilon\in\;]0,1[$ $\exists\,\beta\in\mathcal{KL}$ and $\exists\,\gamma_{1},\gamma_{2}\in\mathcal{K}_{\infty}$ such that $\mathbb{P}\bigl{(}\left\lVert{x_{t}}\right\rVert\leqslant\beta(\left\lVert{x_{0}}\right\rVert,t)+\gamma(\sup_{s\in\mathbb{N}_{0}}\left\lVert{u_{s}}\right\rVert)+\gamma_{2}(\left\lVert{\Sigma}\right\rVert^{\prime})\;\forall\,t\in\mathbb{N}_{0}\bigr{)}\geqslant 1-\varepsilon$. Intuitively this means that for $1-\varepsilon$ proportion of the sample paths the deterministic iss property holds uniformly. However, in an additive i.i.d unbounded noise setting as in (2.1), this property fails to hold because almost surely the states undergo excursions outside any bounded set infinitely often; in this case the weaker version: $\forall\,\varepsilon\in\;]0,1[$ $\exists\,\beta\in\mathcal{KL}$ and $\exists\,\gamma_{1},\gamma_{2}\in\mathcal{K}_{\infty}$ such that $\mathbb{P}\bigl{(}\left\lVert{x_{t}}\right\rVert\leqslant\beta(\left\lVert{x_{0}}\right\rVert,t)+\gamma(\sup_{s\in\mathbb{N}_{0}}\left\lVert{u_{s}}\right\rVert)+\gamma_{2}(\left\lVert{\Sigma}\right\rVert^{\prime})\bigr{)}\geqslant 1-\varepsilon\;\forall\,t\in\mathbb{N}_{0}$ is comparatively better suited. We shall however stick with the iss in $\mathcal{L}_{1}$ property in this article. The following Proposition can be established with the aid of Proposition 5.2 for $p=\infty$; the proofs for $p=1$ and $2$ are also similar in spirit. ###### Proposition 5.4. Consider the system (2.1), and suppose that Assumptions 3.1 and 5.1 hold. Then the closed-loop system (5.1) is iss in $\mathcal{L}_{1}$ under the policy $\pi^{*}$ in (5.2) for any $1\leqslant N_{c}\leqslant N$. ## 6\. Numerical Examples In this section we present several numerical examples to illustrate the theoretical results in the preceding sections. We start in Example 6.1 by comparing the performance of our policy (3.3) to that of the standard finite horizon LQG controller whenever the control inputs set $\bar{\mathbb{U}}\equiv\mathbb{R}^{m}$, i.e., there are no bounds on the norm of the inputs. Then we compare the performance of our policy (3.3) against a saturated LQG controller in Example 6.2. Finally, in Example 6.3 we illustrate the effectiveness of our policy (3.3) compared to the certainty-equivalent receding horizon control. ###### Example 6.1 (Unconstrained Inputs). A natural question that may arise whenever the control inputs in our setup are not constrained, i.e., $\bar{\mathbb{U}}\equiv\mathbb{R}^{m}$, is the following: How does the policy (3.3) compare to the globally optimal controller, which in this case is the standard finite-horizon LQG controller? One would expect our policy to perform worse on the average since we restrict to a class of feedback policies that may not contain the globally optimal controller. We compared our policy against that of the LQG problem in simulation for two controllable $3$-dimensional single-input linear systems. In each case we solved an unconstrained finite-horizon LQ optimal control problem corresponding to state and control weights $Q_{t}=3\,\mathbf{I}_{3\times 3}$ and $R_{t}=1$ for every $t$. We selected an optimization horizon $N=50$, and simulated the system responses starting from $10^{3}$ different initial conditions $x_{0}$ selected at random uniformly from the cube $[-100,100]^{3}$, and noise sequences $w_{t}$ corresponding to i.i.d Gaussian noise of mean $0$ and (randomly chosen) variance $\Sigma_{w}=\begin{bmatrix}2.830399255&5.491512606&3.612257417\\\ 5.491512606&11.554870229&6.896706270\\\ 3.612257417&6.896706270&4.625993264\end{bmatrix}.$ We selected the nonlinear bounded term ${\mathfrak{e}}(w)$ in our policy $u=\eta+\Theta{\mathfrak{e}}(w)$ to be a vector of scalar sigmoidal functions $\varphi(\xi)\coloneqq 0.2\xi/\mathchoice{{\hbox{$\displaystyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.74889pt,depth=-6.99915pt}}}{{\hbox{$\textstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.74889pt,depth=-6.99915pt}}}{{\hbox{$\scriptstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=6.14998pt,depth=-4.92001pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.7611pt,depth=-3.8089pt}}}$ applied to each coordinate of the vector $w$. The covariance matrices $\Sigma_{{\mathfrak{e}}}$ and $\Sigma_{{\mathfrak{e}}^{\prime}}$ that are required to solve the optimization problem (3.3) were computed empirically via classical Monte Carlo methods [RC04, Section 3.2] using $10^{6}$ i.i.d samples. The first system is described by: (6.1) $x_{k+1}=\begin{bmatrix}0&1&0\\\ 0&0&1\\\ 0.4&0.5&-0.25\end{bmatrix}x_{k}+\begin{bmatrix}0\\\ 0\\\ 1\end{bmatrix}u_{k}+w_{k}.$ The system pair $(A,B)$ is in Brunovsky canonical form, and $A$ has eigenvalues at $0.8642$, and $-0.5571\pm\mathrm{i}0.3905$. The test results showed that the mean of the ratio of the cost corresponding to LQG to the cost corresponding to our policy is $0.99916$, and the standard deviation of this ratio is $0.003619$. The second system is described by: (6.2) $x_{k+1}=\begin{bmatrix}1&1&0\\\ 0&1&1\\\ 0&0&1\end{bmatrix}x_{k}+\begin{bmatrix}0\\\ 0\\\ 1\end{bmatrix}u_{k}+w_{k}.$ This particular system matrix $A$ is in Jordan canonical form and has three eigenvalues at $1$. The test results showed that the mean of the ratio of the cost of LQG against the cost of our policy is $0.99673$ and the corresponding standard deviation is $0.008045$. Computations for determining our policy in the above two cases were carried out in the MATLAB-based software package cvx. In the case of the system (6.2) the solver utilized by cvx reported numerical problems in five different runs, for which it gave values of the aforementioned ratio below $0.96$. Note that we have not discarded these five cases from the mean and variance figures reported above. The close-to-optimal performance of our policy is surprising in view of the fact that the vector-space $\mathcal{H}$ is the linear span of one bounded function, and does not contain the theoretically optimal linear (in the current state) controller. We conjecture that this is due to injectivity of the mapping ${\mathfrak{e}}$, due to which ${\mathfrak{e}}(w_{t})$ retains all information generated by $w_{t}$. Of course, in the absence of control constraints our solution is much more computationally demanding than the LQG controller, and would not be used in practice in this case.$\triangle$ ###### Example 6.2 (Saturated LQG and Receding Horizon). We compare the performance of saturated LQG against our policy (3.3) for the system (6.2) in this example. We fixed the optimization horizon $N=2$, the control horizon $N_{c}=1$, and the weight matrices for the states and the control to be $Q_{t}=\mathbf{I}_{3\times 3}$ and $R_{t}=0.01$ for all $t$, respectively. The control bounds in both cases was $[-2,2]$, the nonlinear bounded term ${\mathfrak{e}}(w_{t})$ in our policy $u=\eta+\Theta{\mathfrak{e}}(w)$ was a vector of scalar standard saturation functions applied to each coordinate of the vector $w_{t}$, and the LQG control input was saturated at $\pm 2$. The covariance matrices $\Sigma_{{\mathfrak{e}}}$ and $\Sigma_{{\mathfrak{e}}^{\prime}}$ required to solve the optimization problem (3.5) were computed empirically via classical Monte Carlo integration methods [RC04, Section 3.2] using $10^{6}$ i.i.d samples. We simulated the system (6.2) starting from the same initial condition $x_{0}=\left[\begin{matrix}0&0&0\end{matrix}\right]^{\mathsf{T}}$ for $100$ different independent realizations of the noise sequence $w_{t}$ over a horizon of $200$. The behavior of the average (over the $100$ realizations) cost corresponding to the two scenarios is shown in Figure 1. The simulations were coded in MATLAB and the optimization programs were coded in the software package cvx. The average total cost incurred at the end of the simulation horizon when using the saturated LQG scheme above was $1.790\times 10^{12}$ units, whereas the average total cost incurred at the end of the simulation horizon ($t=200$) using our policy (3.3) in a receding horizon fashion was $4.486\times 10^{8}$ units.$\triangle$ Figure 1. Plots of average costs corresponding to saturated LQG and our receding horizon scheme for $N_{c}=1$ in Example 6.2. ###### Example 6.3 (Constrained Inputs). Consider the 2-dimensional linear stochastic system: (6.3) $x_{t+1}=\begin{bmatrix}1.23&-0.15\\\ 0.25&1\end{bmatrix}x_{t}+\begin{bmatrix}0.14\\\ 0.12\end{bmatrix}u_{t}+w_{t},$ where $(w_{t})_{t\in\mathbb{N}_{0}}$ is a sequence of i.i.d Gaussian noise with zero mean and (randomly generated) variance $\begin{bmatrix}2.722030613&4.975999693\\\ 4.975999693&9.102559685\end{bmatrix}$. Let the weight matrices corresponding to the states and control be $Q_{t}=\mathbf{I}_{2\times 2}$ and $R_{t}=0.8$ for each $t$. The covariance matrices $\Sigma_{{\mathfrak{e}}}$ and $\Sigma_{{\mathfrak{e}}^{\prime}}$ that are required to solve the optimization problem (3.3) were computed empirically via classical Monte Carlo integration methods [RC04, Section 3.2] using $10^{6}$ samples. We fixed the optimization horizon $N=7$, the nonlinear saturation ${\mathfrak{e}}(w_{t})$ to be a vector of scalar sigmoidal functions $\varphi(\xi)\coloneqq 0.2\xi/\mathchoice{{\hbox{$\displaystyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.74889pt,depth=-6.99915pt}}}{{\hbox{$\textstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=8.74889pt,depth=-6.99915pt}}}{{\hbox{$\scriptstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=6.14998pt,depth=-4.92001pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+0.04\xi^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.7611pt,depth=-3.8089pt}}}$ applied to each coordinate of the vector $w_{t}$, and compared the certainty-equivalent MPC strategy ($N_{c}=1$, $\Theta\equiv 0$, $w_{t}\equiv 0$) against our receding horizon strategy (3.3) with control horizon $N_{c}=4$. The control constraints in both cases were $u_{t}\in[-200,200]$. We simulated the system in both cases starting from the same initial condition $x_{0}=\left[\begin{matrix}0&0\end{matrix}\right]^{\mathsf{T}}$, for $60$ different realizations of the noise sequence $w_{t}$; plots of states, average cost, and standard deviation are shown in Figures 2 and 3. The average cost incurred when using the certainty-equivalent MPC scheme was $7.893\times 10^{5}$ units, whereas the average cost incurred when using our policy (3.3) in a receding horizon fashion was $3.141\times 10^{5}$ units. Therefore, applying our policy in a receding horizon fashion one saves $60.2\%$ of the cost corresponding to the certainty-equivalent MPC controller on the average. This example illustrates that there may be cases where open-loop certainty- equivalent MPC, in the absence of state-constraints, is outperformed by a large margin by a judiciously selected receding-horizon strategy. The simulations were coded in YALMIP and were solved using SDPT-3; the solver-time statistics (in sec.) for the certainty-equivalent MPC and receding horizon schemes were as follows: | certainty-equivalent MPC | receding horizon ---|---|--- Mean | $32.127$ | $59.615$ Standard deviation | $4.610$ | $21.675$ Maximum | $50.590$ | $90.036$ Minimum | $20.240$ | $20.466$ These statistics correspond to the above simulations carried out on an $\text{x}86\\_64$ octa-core machine with 24GB RAM, each processor of which was an Intel${}^{\text{\textregistered}}$ Xeon${}^{\text{\textregistered}}$ CPU E5540 2.53GHz with cache size 8192 KB, running GNU/Linux. Figure 2. Plots of states corresponding to: certainty-equivalent MPC with $N_{c}=1$ (left) and our receding horizon control scheme with $N_{c}=4$ (right) in Example 6.3. (a) Plot of average costs (b) Plot of standard deviations Figure 3. Plots of average cost (left) and standard deviations (right) corresponding to: certainty-equivalent MPC with $N_{c}=1$ and our receding horizon control scheme with $N_{c}=4$ in Example 6.3. We also applied the first four control values of the certainty-equivalent scheme and compared it against our receding horizon scheme using policy (3.3), i.e., $N_{c}=4$ for both controllers. We simulated the system in both cases starting from the same initial condition $x_{0}=\left[\begin{matrix}0&0\end{matrix}\right]^{\mathsf{T}}$, for $60$ different realizations of the noise sequence $w_{t}$; plots of the states, average cost, and standard deviation are shown in Figures 4 and 5. The average cost incurred when using the certainty-equivalent with control horizon $N_{c}=4$ was $4.211\times 10^{5}$ units, whereas the average cost incurred when using our policy (3.3) in a receding horizon fashion was $3.295\times 10^{5}$ units. We see that by applying our policy in a receding horizon fashion one saves $21.7\%$ of the cost corresponding to the certainty equivalence controller on the average. The simulations were coded in YALMIP and were solved using SDPT-3; the solver-time statistics (in sec.) for the certainty-equivalent and receding horizon schemes were as follows: | certainty-equivalent | receding horizon ---|---|--- Mean | $7.537$ | $67.494$ Standard deviation | $0.812$ | $11.845$ Maximum | $9.776$ | $85.232$ Minimum | $6.101$ | $43.601$ These statistics correspond to the above simulations carried out on an $\text{x}86\\_64$ octa-core machine with 24GB RAM, each processor of which was an Intel${}^{\text{\textregistered}}$ Xeon${}^{\text{\textregistered}}$ CPU E5540 2.53GHz with cache size 8192 KB, running GNU/Linux.$\triangle$ Figure 4. Plots of states corresponding to: certainty-equivalent with $N_{c}=4$ (left) and our receding horizon control scheme with $N_{c}=4$ (right) in Example 6.3. (a) Plot of average costs (b) Plot of standard deviations Figure 5. Plots of average cost (left) and standard deviations (right) corresponding to: certainty-equivalent with $N_{c}=4$ and our receding horizon control scheme with $N_{c}=4$ in Example 6.3. ## 7\. Conclusion and Future Directions We provided tractable solutions to a variety of finite-horizon stochastic optimal control problems with quadratic cost, hard control constraints, and unbounded additive noise. These problems arise as parts of solutions to the stochastic receding horizon problems (2.4). The control policy obtained as a result of the finite-horizon optimal control sub-problems may be nonlinear with respect to the previous states, and the policy elements are chosen from a vector space that is largely up to the designer. One of the key features of our approach is that the variance-like matrices employed in the finite-horizon optimal control sub-problems may be computed off-line, and we illustrated this feature with several examples. We demonstrated that applying our obtained policies in a receding horizon fashion results in bounded state variance. Finally, we provided several numerical examples that illustrate the effectiveness of our method with respect to the commonly used certainty- equivalent MPC controllers. The development in this article affords extensions in several directions. One is the incorporation of state constraints. As discussed in §1, hard state constraints do not make sense in the stochastic with additive unbounded noise setting unless one is prepared to artificially relax them once infeasibility is encountered. Probabilistic constraints and integrated chance constraints [Han83] constitute popular alternative methods to impose constraints on the state that are more probabilistic in nature. It will be interesting to see how the approach introduced in this article reacts to state-constraints. A second direction is to consider specific kinds of nonlinear models, particularly those which involve multiplicative noise, in our framework, and a third is to consider different objective functions such as affine functions given by the $\ell_{\infty}$ and the $\ell_{1}$ norms. ## Acknowledgments We are indebted to Soumik Pal for pointing out the possibility of representing policies as elements of a vector space. We thank Colin Jones for some useful discussions on convexity of some of the optimization programs, and the three anonymous reviewers for their valuable suggestions that have led to substantial improvements of the original manuscript. ## References * [ACCL09] M. Agarwal, E. Cinquemani, D. Chatterjee, and J. Lygeros, _On convexity of stochastic optimization problems with constraints_ , European Control Conference, 2009, pp. 2827–2832. * [AM06] P. J. Antsaklis and A. N. Michel, _Linear Systems_ , Birkhäuser Boston Inc., Boston, MA, 2006. * [AS64] M. Abramowitz and I. A. Stegun, _Handbook of Mathematical Functions with Formulas, Graphs, and Mathematical Tables_ , National Bureau of Standards Applied Mathematics Series, vol. 55, Superintendent of Documents, U.S. Government Printing Office, Washington D.C., 1964. * [Bat04] I. Batina, _Model predictive control for stochastic systems by randomized algorithms_ , Ph.D. thesis, Technische Universiteit Eindhoven, 2004. * [BB07] D. Bertsimas and D. B. Brown, _Constrained stochastic LQC: a tractable approach_ , IEEE Transactions on Automatic Control 52 (2007), no. 10, 1826–1841. * [Ber05] D. P. Bertsekas, _Dynamic programming and suboptimal control: a survey from ADP to MPC_ , European Journal of Control 11 (2005), no. 4-5, 310–334. * [Ber09] D. S. Bernstein, _Matrix Mathematics_ , 2 ed., Princeton University Press, 2009. * [Bla99] F. Blanchini, _Set invariance in control_ , Automatica 35 (1999), no. 11, 1747–1767. * [BM99] A. Bemporad and M. Morari, _Robust model predictive control: a survey_ , Robustness in Identification and Control 245 (1999), 207–226. * [Bor00] V. S. Borkar, _Uniform stability of controlled Markov processes_ , System theory: modeling, analysis and control (Cambridge, MA, 1999), Kluwer International Series in Engineering Computer Science, vol. 518, Kluwer Academic Publishers, Boston, MA, 2000, pp. 107–120. * [Bro97] R. W. Brockett, _Minimum attention control_ , Proceedings of the 36th IEEE Conference on Decision and Control, vol. 3, 1997, pp. 2628–2632. * [BSM03] A. Berman and N. Shaked-Monderer, _Completely Positive Matrices_ , World Scientific Publishing Co. Inc., River Edge, NJ, 2003. * [BSW02] I. Batina, A. A. Stoorvogel, and S. Weiland, _Optimal control of linear, stochastic systems with state and input constraints_ , Proceedings of the 41st IEEE Conference on Decision and Control, vol. 2, 2002, pp. 1564–1569. * [BT96] D. Bertsekas and J. Tsitsiklis, _Neuro-Dynamic Programming_ , Athena Scientific, 1996. * [BTGGN04] A. Ben-Tal, A. Goryashko, E. Guslitzer, and A. Nemirovski, _Adjustable robust solutions of uncertain linear programs_ , Mathematical Programming 99 (2004), no. 2, 351–376. * [BV04] S. Boyd and L. Vandenberghe, _Convex Optimization_ , Cambridge University Press, Cambridge, 2004, Sixth printing with corrections, 2008. * [BW07] L. Blackmore and B. C. Williams, _Optimal, robust predictive control of nonlinear systems under probabilistic uncertainty using particles_ , Proceedings of the American Control Conference, 2007, pp. 1759–1761. * [CACL09] E. Cinquemani, M. Agarwal, D. Chatterjee, and J. Lygeros, _On convex problems in chance-constrained stochastic model predictive control_ , http://arxiv.org/abs/0905.3447, 2009. * [CCCL08] D. Chatterjee, E. Cinquemani, G. Chaloulos, and J. Lygeros, _Stochastic optimal control up to a hitting time: optimality and rolling-horizon implementation_ , http://arxiv.org/abs/0806.3008, 2008. * [CKW08] M. Cannon, B. Kouvaritakis, and X. Wu, _Probabilistic constrained MPC for systems with multiplicative and additive stochastic uncertainty_ , IFAC World Congress (Seoul, Korea), 2008. * [CP09] D. Chatterjee and S. Pal, _An excursion-theoretic view of stability of stochastic hybrid systems_ , http://arxiv.org/abs/0901.2269, 2009. * [dFR03] D. P. de Farias and B. Van Roy, _The linear programming approach to approximate dynamic programming_ , Operations Research 51 (2003), no. 6, 850–865. * [Dud02] R. M. Dudley, _Real Analysis and Probability_ , Cambridge Studies in Advanced Mathematics, vol. 74, Cambridge University Press, Cambridge, 2002, Revised reprint of the 1989 original. * [FB05] H. Fukushima and R. R. Bitmead, _Robust constrained predictive control using comparison model_ , Automatica 41 (2005), no. 1, 97–106. * [GB00] M. Grant and S. Boyd, _CVX: Matlab software for disciplined convex programming (web page and software)_ , http://stanford.edu/~boyd/cvx, 2000\. * [GK08] P. J. Goulart and E. C. Kerrigan, _Input-to-state stability of robust receding horizon control with an expected value cost_ , Automatica 44 (2008), no. 4, 1171–1174. * [GKM06] P. J. Goulart, E. C. Kerrigan, and J. M. Maciejowski, _Optimization over state feedback policies for robust control with constraints_ , Automatica 42 (2006), no. 4, 523–533. * [Han83] W. K. Klein Haneveld, _On integrated chance constraints_ , Stochastic programming (Gargnano), Lecture Notes in Control and Inform. Sci., vol. 76, Springer, Berlin, 1983, pp. 194–209. * [HCCL10] P. Hokayem, E. Cinquemani, D. Chatterjee, and J. Lygeros, _Stochastic MPC with output feedback and bounded control inputs_ , 2010, Submitted to the American Control Conference. * [HCL09] P. Hokayem, D. Chatterjee, and J. Lygeros, _On stochastic model predictive control with bounded control inputs_ , http://arxiv.org/abs/0902.3944, 2009\. * [JW01] Z.-P. Jiang and Y. Wang, _Input-to-state stability for discrete-time nonlinear systems_ , Automatica 37 (2001), no. 6, 857–869. * [LH07] E. Lavretsky and N. Hovakimyan, _Stable adaptation in the presence of actuator constraints with flight control applications_ , Journal of Guidance Control and Dynamics 30 (2007), no. 2, 337. * [LHBW07] M. Lazar, W. P. M. H. Heemels, A. Bemporad, and S. Weiland, _Discrete-time non-smooth nonlinear MPC: stability and robustness_ , Lecture Notes in Control and Information Sciences, vol. 358, Springer-Verlag, 2007, pp. 93–103. * [LHC03] E. Lavretsky, N. Hovakimyan, and A. J. Calise, _Upper bounds for approximation of continuous-time dynamics using delayed outputs and feedforward neural networks_ , IEEE Transactions on Automatic Control 48 (2003), no. 9, 1606–1610. * [Löf03] J. Löfberg, _Minimax Approaches to Robust Model Predictive Control_ , Ph.D. thesis, Linköpings Universitet, 2003. * [Löf04] by same author, _YALMIP : A Toolbox for Modeling and Optimization in MATLAB_ , Proceedings of the CACSD Conference (Taipei, Taiwan), 2004. * [LR06] B. Lincoln and A. Rantzer, _Relaxing dynamic programming_ , IEEE Transactions on Automatic Control 51 (2006), no. 8, 1249–1260. * [Lue69] D. G. Luenberger, _Optimization by Vector Space Methods_ , J. Wiley & Sons, 1969. * [Mac01] J. M. Maciejowski, _Predictive Control with Constraints_ , Prentice Hall, 2001. * [MLL05] J. M. Maciejowski, A. Lecchini, and J. Lygeros, _NMPC for complex stochastic systems using Markov Chain Monte Carlo_ , International Workshop on Assessment and Future Directions of Nonlinear Model Predictive Control (Stuttgart, Germany), Lecture Notes in Control and Information Sciences, vol. 358/2007, Springer, 2005, pp. 269–281. * [MRRS00] D. Q. Mayne, J. B. Rawlings, C. V. Rao, and P. O. M. Scokaert, _Constrained model predictive control: stability and optimality_ , Automatica 36 (2000), no. 6, 789–814. * [OJM08] F. Oldewurtel, C.N. Jones, and M. Morari, _A tractable approximation of chance constrained stochastic MPC based on affine disturbance feedback_ , Proceedings of the 47th IEEE Conference on Decision and Control, 2008, pp. 4731–4736. * [Pow07] W. B. Powell, _Approximate Dynamic Programming_ , Wiley Series in Probability and Statistics, Wiley-Interscience [John Wiley & Sons], Hoboken, NJ, 2007. * [PS09] J. A. Primbs and C. H. Sung, _Stochastic receding horizon control of constrained linear systems with state and control multiplicative noise_ , IEEE Transactions on Automatic Control 54 (2009), no. 2, 221–230. * [RC04] C. P. Robert and G. Casella, _Monte Carlo Statistical Methods_ , 2 ed., Springer, 2004. * [RCMA+09] F. Ramponi, D. Chatterjee, A. Milias-Argeitis, P. Hokayem, and J. Lygeros, _Attaining mean square boundedness of a marginally stable noisy linear system with a bounded control input_ , http://arxiv.org/abs/0907.1436, 2009\. * [RH05] A. Richards and J. How, _Robust model predictive control with imperfect information_ , Proceedings of the American Control Conference, 2005, pp. 268–273. * [SB09a] J. Skaf and S. Boyd, _Design of affine controllers via convex optimization_ , http://www.stanford.edu/~boyd/papers/affine_contr.html, 2009, To appear in IEEE Transactions on Automatic Control. * [SB09b] by same author, _Nonlinear Q-design for convex stochastic control_ , IEEE Transactions on Automatic Control 54 (2009), no. 10, 2426–2430. * [SS85] P. J. Schweitzer and A. Seidmann, _Generalized polynomial approximations in Markovian decision processes_ , Journal of Mathematical Analysis and Applications 110 (1985), no. 2, 568–582. * [SSW06] A. A. Stoorvogel, A. Saberi, and S. Weiland, _On external semi-global stochastic stabilization of linear systems with input saturation_ , http://homepage.mac.com/a.a.stoorvogel/subm03.pdf, 2006. * [ST03] J. Spiliotis and J. Tsinias, _Notions of exponential robust stochastic stability, ISS and their Lyapunov characterization_ , International Journal of Robust and Nonlinear Control 13 (2003), no. 2, 173–187. * [vHB03] D. H. van Hessem and O. H. Bosgra, _A full solution to the constrained stochastic closed-loop MPC problem via state and innovations feedback and its receding horizon implementation_ , Proceedings of the 42nd IEEE Conference on Decision and Control, vol. 1, 2003, pp. 929–934. * [vHB06] by same author, _Stochastic closed-loop model predictive control of continuous nonlinear chemical processes_ , Journal of Process Control 16 (2006), no. 3, 225–241. * [YB09] J. Yan and R. Bitmead, _A constrained model-predictive approach to coordinated control_ , To Appear in Automatica, 2009. * [YSS97] Y. D. Yang, E. D. Sontag, and H. J. Sussmann, _Global stabilization of linear discrete-time systems with bounded feedback_ , Systems and Control Letters 30 (1997), no. 5, 273–281. ## Appendix ### A.1. Some identities Recall the following standard special mathematical functions: the _standard error function_ $\operatorname{erf}(z)\coloneqq\frac{2}{\mathchoice{{\hbox{$\displaystyle\sqrt{\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.01389pt,depth=-2.41113pt}}}{{\hbox{$\textstyle\sqrt{\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.01389pt,depth=-2.41113pt}}}{{\hbox{$\scriptstyle\sqrt{\pi\,}$}\lower 0.4pt\hbox{\vrule height=2.10971pt,depth=-1.68779pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\pi\,}$}\lower 0.4pt\hbox{\vrule height=1.50694pt,depth=-1.20557pt}}}}\int_{0}^{z}\mathrm{e}^{-\frac{t^{2}}{2}}\mathrm{d}t$ and the _complementary error function_ [AS64, p. 297] defined by $\operatorname{erfc}(z)\coloneqq 1-\operatorname{erf}(z)$ for $z\in\mathbb{R}$, the _incomplete Gamma function_ [AS64, p. 260] defined by $\Gamma(a,z)\coloneqq\int_{z}^{\infty}t^{a-1}\mathrm{e}^{-t}\mathrm{d}t$ for $z,a>0$, the _confluent hypergeometric function_ [AS64, p. 505] defined by $U(a,b,z)\coloneqq\frac{1}{\Gamma(a)}\int_{0}^{\infty}\mathrm{e}^{-zt}t^{a-1}(1+t)^{b-a-1}\mathrm{d}t$ for $a,b,z>0$, and $\Gamma$ is the standard Gamma function. All of these are implemented as standard functions in Mathematica. The following facts can be found in [AS64] and are collected here for completeness. ###### Facts about Special Functions. For $\sigma^{2}>0$ we have * • $\displaystyle{\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\int_{z}^{\infty}\mathrm{e}^{-\frac{t^{2}}{2\sigma^{2}}}\mathrm{d}t=\frac{1}{2}\Bigl{(}1+\operatorname{erf}\Bigl{(}\frac{z}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\Bigr{)}\Bigr{)}}$ * • $\displaystyle{\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\int_{0}^{\infty}\frac{t^{2}}{1+t^{2}}\mathrm{e}^{-\frac{t^{2}}{2\sigma^{2}}}\mathrm{d}t=\frac{1}{2}\Bigl{(}\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma-\pi\mathrm{e}^{-\frac{1}{2\sigma^{2}}}\operatorname{erfc}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\Bigr{)}\Bigr{)}}$ * • $\displaystyle{\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\int_{0}^{1}t^{2}\mathrm{e}^{-\frac{t^{2}}{2\sigma^{2}}}\mathrm{d}t=\mathchoice{{\hbox{$\displaystyle\sqrt{\frac{\pi}{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.52776pt,depth=-6.02223pt}}}{{\hbox{$\textstyle\sqrt{\frac{\pi}{2}\,}$}\lower 0.4pt\hbox{\vrule height=5.26944pt,depth=-4.21558pt}}}{{\hbox{$\scriptstyle\sqrt{\frac{\pi}{2}\,}$}\lower 0.4pt\hbox{\vrule height=3.76387pt,depth=-3.01111pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\frac{\pi}{2}\,}$}\lower 0.4pt\hbox{\vrule height=3.76387pt,depth=-3.01111pt}}}\sigma^{3}\operatorname{erf}\Bigl{(}\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\Bigr{)}-\sigma^{2}\mathrm{e}^{-\frac{1}{2\sigma^{2}}}}$; * • $\displaystyle{\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\int_{1}^{\infty}t\mathrm{e}^{-\frac{t^{2}}{2\sigma^{2}}}\mathrm{d}t=\frac{\sigma}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}}\operatorname{Gamma}(2\sigma^{2},1)}$ * • $\displaystyle{\frac{1}{\mathchoice{{\hbox{$\displaystyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\pi\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}\sigma}\int_{0}^{\infty}\frac{t^{2}}{\mathchoice{{\hbox{$\displaystyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\textstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=7.95523pt,depth=-6.36421pt}}}{{\hbox{$\scriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=5.59444pt,depth=-4.47557pt}}}{{\hbox{$\scriptscriptstyle\sqrt{1+t^{2}\,}$}\lower 0.4pt\hbox{\vrule height=4.36427pt,depth=-3.49144pt}}}}\mathrm{e}^{-\frac{t^{2}}{2\sigma^{2}}}\mathrm{d}t=\frac{\sigma}{2\mathchoice{{\hbox{$\displaystyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\textstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=6.44444pt,depth=-5.15558pt}}}{{\hbox{$\scriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=4.51111pt,depth=-3.6089pt}}}{{\hbox{$\scriptscriptstyle\sqrt{2\,}$}\lower 0.4pt\hbox{\vrule height=3.22221pt,depth=-2.57779pt}}}}U\Bigl{(}\frac{1}{2},0,\frac{1}{2\sigma^{2}}\Bigr{)}}$. ### A.2. Proof of mean-square boundedness ###### Proof of Proposition 5.2. Fix $x_{0}\in\mathbb{R}^{n}$. For any $n\times n$ matrix $P=P^{\mathsf{T}}>0$, using (5.1) and the fact that $\mathbb{E}\left[{\mathfrak{e}}(w)\right]=0$, we see that for every $\ell=1,\cdots,N_{c}$ $\displaystyle\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}Px_{kN_{c}+l}\bigr{]}$ $\displaystyle=x_{kN_{c}}^{\mathsf{T}}(A^{\ell})^{\mathsf{T}}PA^{\ell}x_{kN_{c}}+2x_{kN_{c}}^{\mathsf{T}}(A^{\ell})^{\mathsf{T}}PB_{\ell}\mathbb{E}_{x_{kN_{c}}}\bigl{[}\pi^{*}_{kN_{c}:kN_{c}+\ell-1}(x_{kN_{c}})\bigr{]}$ $\displaystyle\quad+\mathbb{E}_{x_{kN_{c}}}\bigl{[}\left\lVert{B_{\ell}\pi^{*}_{kN_{c}:kN_{c}+\ell-1}(x_{kN_{c}})+D_{\ell}\tilde{w}_{kN_{c}:kN_{c}+\ell-1}}\right\rVert_{P}^{2}\bigr{]},$ where $\left\lVert{\xi}\right\rVert_{P}\coloneqq\mathchoice{{\hbox{$\displaystyle\sqrt{\xi^{\mathsf{T}}P\xi\,}$}\lower 0.4pt\hbox{\vrule height=8.85777pt,depth=-7.08626pt}}}{{\hbox{$\textstyle\sqrt{\xi^{\mathsf{T}}P\xi\,}$}\lower 0.4pt\hbox{\vrule height=8.85777pt,depth=-7.08626pt}}}{{\hbox{$\scriptstyle\sqrt{\xi^{\mathsf{T}}P\xi\,}$}\lower 0.4pt\hbox{\vrule height=6.22777pt,depth=-4.98224pt}}}{{\hbox{$\scriptscriptstyle\sqrt{\xi^{\mathsf{T}}P\xi\,}$}\lower 0.4pt\hbox{\vrule height=4.83888pt,depth=-3.87112pt}}}$. Using the fact that $\left\lVert{\pi^{*}_{kN_{c}:kN_{c}+\ell-1}(x_{kN_{c}})}\right\rVert_{\infty}\leqslant U_{\rm max}$ by construction, we obtain the following bound: (A.1) $\displaystyle\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}Px_{kN_{c}+\ell}\bigr{]}\leqslant x_{kN_{c}}^{\mathsf{T}}(A^{\ell})^{\mathsf{T}}PA^{\ell}x_{kN_{c}}+2c_{1\ell}\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}+c_{2\ell},$ where $\displaystyle c_{1\ell}$ $\displaystyle\coloneqq m\left\lVert{(A^{\ell})^{\mathsf{T}}PB_{\ell}}\right\rVert_{\infty}U_{\rm max},$ $\displaystyle c_{2\ell}$ $\displaystyle\coloneqq m\left\lVert{B_{\ell}^{\mathsf{T}}PB_{\ell}}\right\rVert_{\infty}U_{\max}^{2}+\mathbf{tr}\\!\left(D_{\ell}^{\mathsf{T}}PD_{\ell}\Sigma_{w}\right)$ $\displaystyle\quad+\max_{\tiny{\left\lVert{\Upsilon(x_{kN_{c}})}\right\rVert_{\infty}\leqslant U_{\max}/\phi_{\max}}}\big{[}\mathbf{tr}\\!\left(\Upsilon(x_{kN_{c}})^{\mathsf{T}}B_{\ell}^{\mathsf{T}}PB_{\ell}\Upsilon(x_{kN_{c}})\Lambda_{1}\right)+2\mathbf{tr}\\!\left(\Upsilon(x_{kN_{c}})^{\mathsf{T}}B_{\ell}^{\mathsf{T}}PD_{\ell}\Lambda_{2}\right)\big{]},$ $\displaystyle\text{and}\quad\Upsilon(x_{kN_{c}})\coloneqq\left[\begin{matrix}\Theta^{*}_{1}(x_{kN_{c}})\\\ \cdots\\\ \Theta^{*}_{N_{c}-1}(x_{kN_{c}})\end{matrix}\right].$ Since $A$ is a Schur stable matrix (and hence so is $A^{\ell}$) there exists [Ber09, Proposition 11.10.5] a matrix $P_{\ell}=P_{\ell}^{\mathsf{T}}>0$ with real-valued entries that satisfies $(A^{\ell})^{\mathsf{T}}P_{\ell}A^{\ell}-P_{\ell}=-\mathbf{I}_{n\times n}$; in particular, we have $x_{kN_{c}}^{\mathsf{T}}(A^{\ell})^{\mathsf{T}}P_{\ell}A^{\ell}x_{kN_{c}}\leqslant x_{kN_{c}}^{\mathsf{T}}P_{\ell}x_{kN_{c}}-x_{kN_{c}}^{\mathsf{T}}x_{kN_{c}}$. Therefore, with $P=P_{\ell}$ in (A.1) we arrive at (A.2) $\displaystyle\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}P_{\ell}x_{kN_{c}+\ell}\bigr{]}\leqslant x_{kN_{c}}^{\mathsf{T}}P_{\ell}x_{kN_{c}}-\left\lVert{x_{kN_{c}}}\right\rVert^{2}+2c_{1\ell}\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}+c_{2\ell}.$ For $\zeta_{\ell}\in\;]\max\\{0,1-\lambda_{\max}(P_{\ell})\\},1[$ let $r_{\ell}\coloneqq\frac{1}{\zeta_{\ell}}\bigl{(}c_{1\ell}+\mathchoice{{\hbox{$\displaystyle\sqrt{c_{1\ell}^{2}+c_{2\ell}\zeta_{\ell}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\textstyle\sqrt{c_{1\ell}^{2}+c_{2\ell}\zeta_{\ell}\,}$}\lower 0.4pt\hbox{\vrule height=6.94444pt,depth=-5.55559pt}}}{{\hbox{$\scriptstyle\sqrt{c_{1\ell}^{2}+c_{2\ell}\zeta_{\ell}\,}$}\lower 0.4pt\hbox{\vrule height=4.8611pt,depth=-3.8889pt}}}{{\hbox{$\scriptscriptstyle\sqrt{c_{1\ell}^{2}+c_{2\ell}\zeta_{\ell}\,}$}\lower 0.4pt\hbox{\vrule height=3.47221pt,depth=-2.77779pt}}}\bigr{)}$. Then elementary properties of the quadratic function $g(y)\coloneqq-\zeta_{\ell}y^{2}+2c_{1\ell}y+c_{2\ell}$ show that $\displaystyle-\zeta_{\ell}\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}^{2}+2c_{1\ell}\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}+c_{2\ell}\leqslant 0\quad\text{whenever }\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}>r_{\ell},$ In view of the above fact, simple manipulations in (A.2) lead to $\displaystyle\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}P_{\ell}x_{kN_{c}+\ell}\bigr{]}\leqslant x_{kN_{c}}^{\mathsf{T}}P_{\ell}x_{kN_{c}}-(1-\zeta_{\ell})\left\lVert{x_{kN_{c}}}\right\rVert^{2}\quad\text{whenever }\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}>r_{\ell},$ from which, letting $\rho_{\ell}\coloneqq\Bigl{(}1-\frac{1-\zeta_{\ell}}{\lambda_{\text{max}}(P_{\ell})}\Bigr{)}$, we arrive at (A.3) $\displaystyle\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}P_{\ell}x_{kN_{c}+\ell}\bigr{]}\leqslant\rho_{\ell}x_{kN_{c}}^{\mathsf{T}}P_{\ell}x_{kN_{c}}\quad\text{whenever }\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}>r_{\ell}.$ Let us define $\displaystyle\rho$ $\displaystyle\coloneqq\max\limits_{\ell=1,\cdots,N_{c}}\rho_{\ell},$ $\displaystyle r^{\prime}$ $\displaystyle\coloneqq\max\limits_{\ell=1,\cdots,N_{c}}r_{\ell},$ $\displaystyle\overline{\lambda}$ $\displaystyle\coloneqq\max\limits_{\ell=1,\dots,N_{c}}\lambda_{\max}(P_{\ell}),$ $\displaystyle\underline{\lambda}$ $\displaystyle\coloneqq\min\limits_{\ell=1,\dots,N_{c}}\lambda_{\min}(P_{\ell}).$ Then we can obtain using (A.3) the conservative bound for every $\ell=1,\ldots,N_{c}$: $\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}P_{N_{c}}x_{kN_{c}+\ell}\bigr{]}\leqslant\rho^{\prime}x_{kN_{c}}^{\mathsf{T}}P_{N_{c}}x_{kN_{c}}\quad\text{whenever }\left\lVert{x_{kN_{c}}}\right\rVert_{\infty}>r^{\prime},$ where $\rho^{\prime}\coloneqq\rho\frac{\overline{\lambda}\lambda_{\max}(P_{N_{c}})}{\underline{\lambda}\lambda_{\min}(P_{N_{c}})}$. It follows immediately that (A.4) $\mathbb{E}_{x_{kN_{c}}}\bigl{[}x_{kN_{c}+\ell}^{\mathsf{T}}P_{N_{c}}x_{kN_{c}+\ell}\bigr{]}\leqslant\rho^{\prime}x_{kN_{c}}^{\mathsf{T}}P_{N_{c}}x_{kN_{c}}+b^{\prime}\mathbf{1}_{K^{\prime}}(x_{kN_{c}}),$ where $K^{\prime}\coloneqq\bigl{\\{}\xi\in\mathbb{R}^{n}\big{|}\left\lVert{\xi}\right\rVert_{\infty}\leqslant r^{\prime}\bigr{\\}}$. Let us define the function $V(\xi)\coloneqq\xi^{\mathsf{T}}P_{N_{c}}\xi$, and fix $k\in\mathbb{N}$ and $\ell=1,\dots,N_{c}$. Let $K_{N_{c}}\coloneqq\bigl{\\{}\xi\in\mathbb{R}^{n}\big{|}\left\lVert{\xi}\right\rVert_{\infty}\leqslant r_{N_{c}}\bigr{\\}}$, $b\coloneqq\sup\limits_{x\in K}\mathbb{E}_{x}\bigl{[}V(x_{N_{c}})\bigr{]}$, and $b^{\prime}\coloneqq\max\limits_{\ell=1,\ldots,N_{c}}\sup\limits_{x\in K^{\prime}}\mathbb{E}_{x}\bigl{[}V(x_{\ell})\bigr{]}$. From (A.4) we get $\displaystyle\mathbb{E}_{x_{0}}\bigl{[}V(x_{kN_{c}+\ell})\bigr{]}$ $\displaystyle=\mathbb{E}_{x_{0}}\bigl{[}\mathbb{E}\bigl{[}V(x_{kN_{c}+\ell})\,\big{|}\,x_{kN_{c}}\bigr{]}\bigr{]}\leqslant\mathbb{E}_{x_{0}}\bigl{[}\rho^{\prime}V(x_{kN_{c}})+b^{\prime}\mathbf{1}_{K^{\prime}}(x_{kN_{c}})\bigr{]}$ $\displaystyle\leqslant\mathbb{E}_{x_{0}}\bigl{[}\rho^{\prime}\mathbb{E}\bigl{[}V(x_{kN_{c}})\,\big{|}\,x_{(k-1)N_{c}}\bigr{]}+b^{\prime}\mathbf{1}_{K^{\prime}}(x_{kN_{c}})\bigr{]}$ $\displaystyle\leqslant\mathbb{E}_{x_{0}}\bigl{[}\rho^{\prime}\rho_{N_{c}}V(x_{(k-1)N_{c}})+b\mathbf{1}_{K_{N_{c}}}(x_{(k-1)N_{c}})+b^{\prime}\mathbf{1}_{K^{\prime}}(x_{kN_{c}})\bigr{]}$ $\displaystyle\cdots$ $\displaystyle\leqslant\rho^{\prime}\rho_{N_{c}}^{k}V(x)+\sum_{i=0}^{k-1}b\rho_{N_{c}}^{k-1-i}\mathbb{E}_{x_{0}}\bigl{[}\mathbf{1}_{K_{N_{c}}}(x_{iN_{c}})\bigr{]}+b^{\prime}\mathbb{E}_{x_{0}}\bigl{[}\mathbf{1}_{K^{\prime}}(x_{kN_{c}})\bigr{]}$ (A.5) $\displaystyle\leqslant\rho^{\prime}\rho_{N_{c}}^{k}V(x)+\frac{b\bigl{(}1-\rho_{N_{c}}^{k}\bigr{)}}{1-\rho_{N_{c}}}+b^{\prime}.$ Note that the conditioning in the first few steps of (A.5) is well-defined because it is performed every $N_{c}$ steps starting from $0$, and the structure of our policy $\pi^{*}$ makes the process $(x_{tN_{c}})_{t\in\mathbb{N}_{0}}$ Markovian. Therefore, it follows from (A.5) that for all $t\coloneqq kN_{c}+\ell$, $\displaystyle\sup\limits_{t\in\mathbb{N}_{0}}\mathbb{E}_{x_{0}}\bigl{[}\left\lVert{x_{t}}\right\rVert^{2}\bigr{]}$ $\displaystyle\leqslant\frac{1}{\lambda_{\min}(P_{N_{c}})}\sup\limits_{t\in\mathbb{N}_{0}}\mathbb{E}_{x_{0}}\bigl{[}V(x_{kN_{c}+\ell})\bigr{]}$ $\displaystyle\leqslant\frac{1}{\lambda_{\min}(P_{N_{c}})}\left(\rho^{\prime}\rho_{N_{c}}^{k}V(x)+\frac{b}{1-\rho_{N_{c}}}+b^{\prime}\right)$ $\displaystyle<\infty,$ where the last step follows from the fact that $\rho_{N_{c}}<1$. This completes the proof. ∎
arxiv-papers
2009-03-31T16:53:46
2024-09-04T02:49:01.545011
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Debasish Chatterjee, Peter Hokayem and John Lygeros", "submitter": "Debasish Chatterjee", "url": "https://arxiv.org/abs/0903.5444" }
0904.0027
11institutetext: Center for Nonlinear Studies Los Alamos National Laboratory, Los Alamos NM 87545, USA 11email: marko@lanl.gov 22institutetext: International and Applied Technology Los Alamos National Laboratory, Los Alamos NM 87545, USA 22email: jhw@lanl.gov # Faith in the Algorithm, Part 2: Computational Eudaemonics Marko A. Rodriguez 11 Jennifer H. Watkins 22 ###### Abstract Eudaemonics is the study of the nature, causes, and conditions of human well- being. According to the ethical theory of eudaemonia, reaping satisfaction and fulfillment from life is not only a desirable end, but a moral responsibility. However, in modern society, many individuals struggle to meet this responsibility. Computational mechanisms could better enable individuals to achieve eudaemonia by yielding practical real-world systems that embody algorithms that promote human flourishing. This article presents eudaemonic systems as the evolutionary goal of the present day recommender system. > [Those who condemn individualism] slur over the chief problems—that of > remaking society to serve the growth of a new type of individual. > > John Dewey, “Individualism Old and New” ## 1 Introduction Eudaemonia is the theory that the highest ethical goal is personal happiness and well-being [1]. This theory holds that an ethical life is one filled with the meaning and satisfaction that arises from living according to one’s values—where everything one does is of great importance to their character. Eudaemonia parallels the notion of Abraham Maslow’s self-actualization [2] and Mihály Csíkszentmihályi’s flow state [3] except that, as an ethical theory, it argues that it is a personal responsibility to strive for this state. As a social theory, eudaemonia holds that the purpose of society is to promote this state in all of its people. The ethical foundation of personal flourishing is grounded in the contention that the purpose of life is to reap satisfaction and fulfillment from an engagement in the world and that such a state is objectively good for society. Thus, learning how to flourish is a form of moral development. Moral development, when used in this sense, extends beyond civility, honesty, and other facets of rectitude. It refers to a personal onus to achieve well- being. One proponent of the ethical theory of eudaemonia, David L. Norton, states that “[…] the broader eudaimonistic thesis is that all virtues subsist in potentia in every person; thus to be a human being is to be capable of manifesting virtues, and the problem of moral development is the problem of discovering the conditions of their manifestation” [4]. Typically, the discovery of the conditions that will manifest virtues in the individual is guided by the recommendations of family, friends, and community—those who know the individual well and the options available to them. Despite this guidance, the achievement of eudaemonia remains elusive for most. Maslow notes that a very small group of people achieve self-actualization and Csíkszentmihályi has shown that very few are able to control their consciousness well enough to reliably reach the state of flow. Given the individual moral imperative to achieve eudaemonia and the resulting societal benefits, resources should be dedicated to guaranteeing this realization for as many people as possible. Eudaemonics is the study of the nature, causes, and conditions of eudaemonia [5]. For Owen Flanagan, the domains of moral and political philosophy, neuroethics, neuroeconomics, and positive psychology are the sources from which a developed understanding of human well-being will spring. In this article, it is posited that computational eudaemonics will make advances to bring eudaemonia to more than a select few in society. Computer and information science can greatly contribute to the eudaemonic endeavor by yielding practical real-world systems that embody algorithms that promote human flourishing. Systems that promote eudaemonia are called eudaemonic systems. Such systems would foster eudaemonia by providing the right conditions for the manifestation of virtues. This article presents a vision of eudaemonic systems as the evolutionary goal of the present day recommender system. ## 2 From Recommender to Eudaemonic Systems The purpose of a eudaemonic system is to produce societies in which the individuals experience satisfaction through a deep engagement in the world. This engagement can be fostered by uniting individuals with those resources that resonate with their nature. Resources can take many forms, a few of which are itemized below. * • activities: vocations, hobbies, gatherings, projects. * • education: universities, lectures, areas of study. * • entertainment: books, movies, music, shows. * • people: friends, work associates, life partners. * • places: to live, to vacation, to dine. There are many ways a eudaemonic system could contribute to individual well- being. Perhaps the most ambitious eudaemonic system is one that supplies the satisfaction of the need for a resource before the need is even felt. For Thomas Hobbes, eudaemonia is encumbered by conation—goals, plans, and desires [6]. Practically speaking, humans seek books and movies to stimulate their cognitive faculties, friends and partners to fulfill their social affinities, art to entice their affective natures, and sports to satiate their physical needs. While every individual longs for varying degrees of these requirements, in general, a flourishing life is one where all these requirements are met through the active process of enacting them [7]. Thus, a Hobbesian eudaemonic system would be one that satisfied requirements before they were felt (pre- conation), so that the experience of need could not disrupt a life of contentment. Through computational mechanisms, it may be possible to produce pre-conate eudaemonic systems. A pre-conate system is one that makes use of indicators of coming discontent and provides avenues to rectify the situation prior to its actualization. Recommender systems [8], when viewed within the context of the eudaemonic thesis, could evolve to become such systems. A recommender system is an information filtering tool that matches individuals to resources of potential interest. Such systems are commonly employed by businesses in an attempt to sell more products. However, this conceptualization of the recommender system trivializes their potential role. The satisfaction one reaps from the world can be represented in terms of one’s interactions with resources. These interactions need not be extraordinary, but are the stuff of everyday life. Norton articulates the importance of everyday activities when he states that “if the development of character is the moral objective, it is obvious that […] the choices of vocation and avocations to pursue, of friends to cultivate, of books to read are moral for they clearly influence such development” [4]. For the techno-social society, this development of character is driven every day, to some extent, by the use of recommender systems. Thus, to the extent that recommender systems influence choices, they already influence moral development. By purposely designing these systems to orient individuals toward life optima, recommender systems can evolve to become eudaemonic systems. The current generation of recommender systems are limited to a particular representational slice of the world (such as movies). This is represented in Figure 1a, where there exists a tight coupling between the data and the application which operates on that data. A eudaemonic system must account not for a single aspect of an individual’s life, but for the multitude of domains in which that individual exists. The emerging Web of Data provides a distributed data structure that cleanly separates the data providers from the application developers. This is represented in Figure 1b. The remainder of this section will discuss recommender systems and their transition to eudaemonic systems through the exploitation of the Web of Data. Figure 1: a.) The current paradigm in which the application and the data upon which it operates are tightly coupled both technically and proprietarily—§2.1. b.) The emerging Web of Data provides a collectively generated, publicly accessible world model that can be leveraged by independent application developers—§2.2. ### 2.1 Recommender Systems Most recommender systems model individual users, resources, and their relationships to one another [8]. For example, in an online store, users may have an ex:hasPurchased relationship to some of the store’s products. If the purchasing behavior of user $x$ and user $y$ has a strong, positive correlation, then any products purchased by only one can be recommended to the other. Purchasing behavior is not the only way in which resources are deemed similar. It is possible to relate resources by shared metadata properties [9]. For example, an online movie rental service can represent movie $a$ as having an ex:directedBy relationship to director $b$ and director $b$ can maintain an ex:directed relationship to movie $c$. The similarity that exists between movies $a$ and $c$ is determined, not by user behavior, but by similarity of metadata—the same person directed both. By building a graph of typed relationships between resources, it is possible to identify different forms of relatedness and utilize these forms to aid an individual in their decision making process regarding the use of such resources. The power of recommender systems is currently limited because they rely on a single silo of data that must be generated before they can provide useful recommendations (see Figure 1a). Due to the data acquisition hurdle, application designers must focus on a particular niche in which to provide recommendations. For example, services either provide recommendations for books,111For example: Amazon.com, Feedbooks.com or for music,222For example: Pandora.com, Last.fm, or for partners,333For example: Match.com, Chemistry.com, eHarmony.com etc. With such a limited worldview, these services do not respect the multi-faceted nature of human beings. If a system only has access to data on movies, then it can never recommend the perfect beach novel. Eudaemonia requires a complete representation of the domains in which one conducts life in order to recommend the right resource at the right time. Therefore, eudaemonic systems require an integrated representation of the world’s resources and the individual’s place within them. ### 2.2 Eudaemonic Systems The recommender system data structure described previously can be conveniently represented as a multi-relational network. The most prevalent multi-relational data model is the Resource Description Framework (RDF) of the Semantic Web initiative. The Semantic Web’s Linked Data community is dedicated to the development of the emerging RDF-based Web of Data. On the Web of Data, all data is represented in the URI address space and interlinked to form a single, global data structure that can be used by both man and machine for various application scenarios (see Figure 1b) [10].444The public exposure of data has stimulated interest in the development of the legal structures for the use of such data. Much like the Open Source movement, the Linked Data community is actively involved in the Open Data movement [11]. The Web of Data provides two significant benefits over the data silos used by recommender systems. First, application developers need not focus on data acquisition and instead can focus directly on algorithm development. This feature ultimately reduces the labor involved in web service deployment. Second, the application developer can create algorithms that make use of a rich world model that incorporates the various ways in which resources relate to each other. Thus, these algorithms have a larger knowledge-base with which to understand the world and the individual’s place within it. Figure 2 presents a visualization of the linking structure of the $89$ data sets currently in the Linked Data cloud.555The Linked Data cloud is a subset of the larger Web of Data that includes those data sets that are directly or indirectly connected to DBpedia and are maintained by the Linked Data community. Each vertex represents a unique data set that exists on an Internet server. The directed relationships denote that the source data set references resources in the sink data set. The current Linked Data cloud maintains approximately $4.5$ billion relationships on data from various domains of interest. Table 1 indicates the domain of interest for each data set. Figure 2: A representation of the $89$ RDF data sets currently in the Linked Data cloud. Table 1: The domains of the $89$ data sets currently in the Linked Data cloud. data set | domain | data set | domain | data set | domain ---|---|---|---|---|--- acm | computer | geospecies | biology | pubchem | biology audioscrobbler | music | govtrack | government | pubguide | books bbcjohnpeel | music | hgnc | biology | pubmed | medical bbclatertotp | music | homologene | biology | qdos | social bbcplaycountdata | music | ibm | computer | rae2001 | computer bbcprogrammes | media | ieee | computer | rdfbookmashup | books budapestbme | computer | interpro | biology | rdfohloh | social cas | biology | irittoulouse | computer | reactome | biology chebi | biology | jamendo | music | resex | computer citeseer | computer | kegg | biology | revyu | reference crunchbase | business | laascnrs | computer | riese | government dailymed | medical | libris | books | semanticweborg | computer dblpberlin | computer | lingvoj | reference | semwebcentral | social dblphannover | computer | linkedct | medical | siocsites | social dblprkbexplorer | computer | linkedmdb | movie | surgeradio | music dbpedia | general | magnatune | music | swconferencecorpus | computer diseasome | medical | mgi | biology | symbol | medical doapspace | social | musicbrainz | music | taxonomy | reference drugbank | medical | myspacewrapper | social | umbel | general ecssouthampton | computer | newcastle | computer | uniparc | biology eprints | computer | omim | biology | uniprot | biology eurecom | computer | opencalais | reference | uniref | biology eurostat | government | opencyc | general | unists | biology flickrexporter | images | openguides | reference | uscensusdata | government flickrwrappr | images | pdb | biology | virtuososponger | reference foafprofiles | social | pfam | biology | w3cwordnet | reference freebase | general | pisa | computer | wikicompany | business geneid | biology | prodom | biology | worldfactbook | government geneontology | biology | projectgutenberg | books | yago | general geonames | geographic | prosite | biology | | By publicly exposing data sets such as Amazon.com’s RDF book mashup, MusicBrainz.org’s metadata archive, the Internet Movie Database’s (IMDB) collection of movie facts, Revyu.com’s user ratings, and the publishing and conference behavior of scholars, the Web of Data hosts a rich model of the world that is not built by a single provider, but by many providers collaboratively integrating their data. Such a massive public data structure can be exploited by a community of developers focused on ensuring that the right resource reaches the right person at the right time. Ultimately, an orchestration of this magnitude could yield virtuous individuals whose lives are filled with experiences tailored to their nature. The Web of Data already includes data sets that are pertinent to modeling individuals and resources; however, the success of a eudaemonic system depends on the availability of data regarding the individual and their past, current, and predicted responses to resources. At the societal level, research has demonstrated that resources relevant to flourishing are those that support life expectancy, nutrition, purchasing power, freedom, equality, education, literacy, access to information, and mental health [12].666The World Database of Happiness provides data concerning the study of well-being worldwide and is available at http://worlddatabaseofhappiness.eur.nl. At the individual level, gathering and maintaining data regarding fluctuations in an individual’s well- being in relation to resources would support the automatic determination of optimal future states for that individual. While the Linked Data community is providing a distributed data structure, they are not providing a distributed process infrastructure [13]. Currently, the Linked Data practice is to mint http-based URIs. These http-based URIs are dereferenced in order to retrieve a collection of RDF statements associated with that URI. The problem with this model is that it relegates the Web of Data to use primarily by man. For a machine to traverse parts of the larger Web of Data, the pull-based mechanism of HTTP greatly reduces the speed of processing. It would be unfortunate to limit the sophistication of the algorithms that can reasonably process this data due to an infrastructure issue that can be solved using distributed computing. Ultimately, once these computational hurdles are overcome, what can emerge is a “society of algorithms” that leverages the Web of Data to support individuals in ways that are not possible given the current recommender system architectures. Through such an undertaking, the niche recommender system is transformed into a eudaemonic system, one that fosters a society of individuals where the vocation one takes, the person one dates, the books one reads, the restaurants one frequents, and so on are chosen not through the advice of one’s family, friends, and community, but through a deep computational understanding of what is required for that individual to live an optimal life. ## 3 Conclusion The evolution of the recommender system to the eudaemonic system will be driven by the public exposure of massive-scale, interlinked, heterogenous data and algorithms that can effectively and efficiently process such data. The goal of a eudaemonic system is to orient people towards those resources that will produce a life that is devoid of pretense, doubt, and ultimately, fear. That is, a eudaemonic system will aid the individual in situating themselves within that area of the world that makes sense to them. A pre-conate eudaemonic system would direct the individual to choose need-mitigating options before the individual becomes aware of their need. In other words, the individual would choose options that they do not perceive as necessary. Without the perception of need, the individual would take on faith that the algorithm knows what is best for them in a resource complex world. Thus, the perfect life is not an aspiration, but a well-computed path. ## Note Faith in the Algorithm is a series of articles that focuses on the intersection of political philosophy, ethics, and computation. ## References * [1] Aristotle: Nicomachean Ethics. (350 B.C.) * [2] Maslow, A.H.: A theory of human motivation. Psychological Review (50) (1943) 370–396 * [3] Csíkszentmihályi, M.: Flow: The Psychology of Optimal Experience. Harper and Row, New York, NY (1990) * [4] Norton, D.L.: Democracy and Moral Development: A Politics of Virtue. University of California Press (1995) * [5] Flanagan, O.: The Really Hard Problem: Meaning in a Material World. MIT Press (2007) * [6] Hobbes, T.: Leviathan. (1651) * [7] Kraut, R.: What is Good and Why: The Ethics of Well-Being. Harvard University Press (2007) * [8] Resnick, P., Varian, H.R.: Recommender systems. Communications of the ACM 40(3) (1997) 56–58 * [9] Pazzani, M., Billsus, D.: Content-Based Recommendation Systems. Lecture Notes in Computer Science. In: The Adaptive Web. Springer (2007) 325–341 * [10] Bizer, C., Heath, T., Idehen, K., Berners-Lee, T.: Linked data on the web. In: Proceedings of the International World Wide Web Conference. Linked Data Workshop, Beijing, China (April 2008) * [11] Miller, P., Styles, R., Heath, T.: Open data commons: A license for open data. In: Workshop on Linked Data on the Web, New York, NY, ACM Press (April 2008) * [12] Heylighen, F., Bernheim, J.: Global progress I: empirical evidence for increasing quality of life. Journal of Happiness Studies 1(3) (200) 323–349 * [13] Rodriguez, M.A.: A distributed process infrastructure for a distributed data structure. Semantic Web and Information Systems Bulletin (2008)
arxiv-papers
2009-04-01T16:28:20
2024-09-04T02:49:01.564476
{ "license": "Public Domain", "authors": "Marko A. Rodriguez and Jennifer H. Watkins", "submitter": "Marko A. Rodriguez", "url": "https://arxiv.org/abs/0904.0027" }
0904.0093
# Electromagnetic response in kinetic energy driven cuprate superconductors: Linear response approach Mateusz Krzyzosiak Department of Physics, Beijing Normal University, Beijing 100875, China Institute of Physics, Wrocław University of Technology, Wybrzeże Wyspiańskiego 27, 50-370 Wrocław, Poland Zheyu Huang and Shiping Feng∗ Department of Physics, Beijing Normal University, Beijing 100875, China Ryszard Gonczarek Institute of Physics, Wrocław University of Technology, Wybrzeże Wyspiańskiego 27, 50-370 Wrocław, Poland ###### Abstract Within the framework of the kinetic energy driven superconductivity, the electromagnetic response in cuprate superconductors is studied in the linear response approach. The kernel of the response function is evaluated and employed to calculate the local magnetic field profile, the magnetic field penetration depth, and the superfluid density, based on the specular reflection model for a purely transverse vector potential. It is shown that the low temperature magnetic field profile follows an exponential decay at the surface, while the magnetic field penetration depth depends linearly on temperature, except for the strong deviation from the linear characteristics at extremely low temperatures. The superfluid density is found to decrease linearly with decreasing doping concentration in the underdoped regime. The problem of gauge invariance is addressed and an approximation for the dressed current vertex, which does not violate local charge conservation is proposed and discussed. ###### pacs: 74.25.Ha, 74.25.Nf, 74.20.Mn Keywords: Electromagnetic response; Magnetic field penetration depth; Cuprate superconductors ## I Introduction Observation of superconductor’s response to a weak external electromagnetic stimulus allows us to collect a number of subtle characteristics schrieffer83 . The way the magnetic field is expelled from a superconducting (SC) sample in the spectacular Meissner effect can be used to infer about many fundamental features of the system. Therefore the phenomena at the length scale of the magnetic field penetration depth $\lambda$, i.e. in the region at the edge of the sample where the induced supercurrents effectively screen the external magnetic field, are subject to intensive studies both on the theoretical and the experimental fronts of the research in cuprate superconductors bonn96 ; tsuei00 . In particular, the magnetic field penetration depth can be used as a probe of the pairing symmetry since it can distinguish between a fully gapped and a nodal quasiparticle excitation spectrum bonn96 ; tsuei00 . The former results in the thermally activated (exponential) temperature dependence of the magnetic field penetration depth, whereas the latter one implies a power law behavior. The magnetic field penetration depth is a basic parameter of superconductors, closely related to the superfluid density schrieffer83 . Earlier on, the linear temperature dependence of the magnetic field penetration depth $\lambda(T)$ was observed for the cuprate superconductor YBa2Cu3O7-y at low temperatures ($T=4$K$\sim$20K) hardy93 , which first provided a strong experimental support for the nodes in the d-wave SC gap function of cuprate superconductors, then confirmed by the angle-resolved photoemission spectroscopy (ARPES) experiments ding9495 ; damascelli03 . Later, this linear temperature dependence of the magnetic field penetration depth has been observed in different families of cuprate superconductors kamal98 ; jackson00 ; panagopoulos99 ; pereg07 . However, at extremely low temperatures ($T<4$K), the linear temperature dependence of the magnetic field penetration depth is modified, and a nonlinearity emerges khasanov04 ; suter04 ; sonier99 . Moreover, some indications of nonlocal effects giving rise to the nonlinearity have been reported in the field dependence of the effective magnetic field penetration depth in cuprate superconductors sonier99 . Furthermore, the doping dependence of the electromagnetic response in cuprate superconductors has been studied in terms of the zero-temperature superfluid density. The superfluid density is proportional to the squared amplitude of the coherent macroscopic wave function describing the SC charge carriers, and therefore it is an important physical quantity and can provide significant information about the SC state. In particular, the superfluid density of cuprate superconductors in the underdoped regime vanishes more or less linearly with decreasing doping concentration uemura8991 ; broun07 ; bernhard01 . This in turn gives rise to the linear relation between the critical temperature $T_{\rm{c}}$ and the superfluid density observed in the underdoped regime uemura8991 . Theoretically, the electromagnetic response in cuprate superconductors has been extensively studied based on the the phenomenological Bardeen-Cooper- Schrieffer (BCS) formalism with the d-wave SC gap function yip92 ; kosztin97 ; franz97 ; li00 ; sheehy04 . It has been shown tsuei00 ; kosztin97 that for a d-wave superconductor in the local limit ($\zeta\ll\lambda$, where $\zeta$ is the coherence length), the simple d-wave pairing state (assuming a tetragonal symmetry and ignoring the dispersion in the c-axis direction) gives the magnetic field penetration depth $\lambda(T)\propto T/\Delta_{0}$, where $\Delta_{0}$ is the zero-temperature value of the d-wave gap amplitude. In particular, it has been argued that this linear temperature dependence of the magnetic field penetration depth is attributed to the excitation of quasiparticles out of the condensate at the nodes of the SC gap function. Furthermore, the fact kamal98 ; jackson00 ; panagopoulos99 ; pereg07 that this linear relation holds down to very low doping concentrations suggests that near the nodes these quasiparticle excitations are well described by a simple BCS-like formalism with the d-wave SC gap function, even for the doping concentration $\delta\to 0$ sheehy04 . This is also consistent with the ARPES experiments matsui . However, this depends sensitively on the quasiparticle scattering. In particular, at extremely low temperatures, the coherence length may diverge at the nodes. This may imply that the local condition no longer holds, and the electromagnetic field varies significantly over the size of a Cooper pair. Consequently, the nonlocal effect emerges suter04 and then plays an important role in the electromagnetic response of cuprate superconductors yip92 ; kosztin97 ; franz97 ; li00 ; sheehy04 . It has been suggested yip92 ; kosztin97 ; franz97 ; li00 ; sheehy04 that nonlocal effects can imply a crossover from the linear temperature dependence of the magnetic field penetration depth at low temperatures to a nonlinear one in the extremely low temperature range. To the best of our knowledge, the electromagnetic response in cuprate superconductors has not been treated starting from a microscopic SC theory, and no explicit calculations of the doping dependence of the superfluid density in the underdoped regime have been made so far. Recently, a kinetic energy driven SC mechanism has been developed feng0306 , where the charge carrier-spin interaction from the kinetic energy term induces a charge carrier pairing state with the d-wave symmetry by exchanging spin excitations. Then the electron Cooper pairs originating from the charge carrier pairing state are due to charge-spin recombination, and their condensation reveals the d-wave SC ground-state. In particular, this SC-state is controlled by both the SC gap function and the quasiparticle coherence, then the maximal SC transition temperature occurs around the optimal doping, and decreases in both underdoped and overdoped regimes. The unique feature of this kinetic energy driven SC mechanism is that the pairing comes out from the kinetic energy by exchanging spin excitations and is not driven by the magnetic superexchange interaction as in the resonant valence bond type theories anderson87 . Within the framework of the kinetic energy driven superconductivity, we have discussed the low energy electronic structure feng07 ; guo07 of cuprate superconductors and the spin response feng0306 ; cheng08 , and qualitatively reproduced some main features of ARPES experiments ding9495 ; damascelli03 and inelastic neutron scattering dai01 ; arai99 measurements on cuprate superconductors. The layered crystal structure gives rise to a strong anisotropy of cuprate superconductors, and it is possible to observe both in-plane and inter-plane electromagnetic responses. The former one is characterized by the ab-plane magnetic field penetration depth, whereas the latter one is related to the magnetic field penetration in the c-axis direction. In this paper we concentrate on the in-plane electromagnetic response based on the kinetic energy driven superconductivity and do not consider c-axis properties, which can be discussed, e.g., by taking into account hopping between adjacent copper-oxides layers within the tunneling Hamiltonian approach sheehy04 . The paper is organized as follows. Within the framework of the kinetic energy driven d-wave superconductivity feng0306 , we discuss the electromagnetic response of cuprate superconductors in Section II, deriving the kernel of the linear response with a purely transverse vector potential. In Section III, based on the specular reflection model landau80 ; tinkham96 , we calculate the temperature and doping dependence of quantitative characteristics of the electromagnetic response, such as the local magnetic field profile, the magnetic field penetration depth, and the superfluid density. Our results show that the electromagnetic response in cuprate superconductors can be understood within the framework of the kinetic energy driven d-wave SC mechanism in the presence of a weak external magnetic field. We conclude the paper with a brief summary in Section IV. In Appendix A we present a method to generalize the approach in order to obtain gauge invariant results. ## II Electromagnetic response in cuprate superconductors A common feature of cuprate superconductors is the presence of two-dimensional CuO2 planes, and it is believed that the unconventional physical properties of these systems are closely related to the doped CuO2 plane damascelli03 . It has been argued that the essential physics of the doped CuO2 plane anderson87 ; damascelli03 is captured by the _t–J_ model on a square lattice. However, for discussions of the electromagnetic response in cuprate superconductors, the _t–J_ model can be extended by including the exponential Peierls factors as, $\displaystyle H$ $\displaystyle=$ $\displaystyle-t\sum_{l\hat{\eta}\sigma}e^{-i({e}/{\hbar}){\bf{A}}(l)\cdot\hat{\eta}}C^{\dagger}_{l\sigma}C_{l+\hat{\eta}\sigma}+\mu\sum_{l\sigma}C^{\dagger}_{l\sigma}C_{l\sigma}$ (1) $\displaystyle+$ $\displaystyle J\sum_{l\hat{\eta}}{\bf S}_{l}\cdot{\bf S}_{l+\hat{\eta}},$ where $\hat{\eta}=\pm\hat{x},\pm\hat{y}$, $C^{\dagger}_{l\sigma}$ ($C_{l\sigma}$) is the electron creation (annihilation) operator, ${\bf S}_{l}=(S^{x}_{l},S^{y}_{l},S^{z}_{l})$ are spin operators, $\mu$ is the chemical potential, and the exponential Peierls factors account for the coupling of electrons to the weak external magnetic field in terms of the vector potential ${\bf{A}}(l)$ hirsch92 ; misawa94 . This $t$-$J$ model is subject to an important local constraint $\sum_{\sigma}C^{\dagger}_{l\sigma}C_{l\sigma}\leq 1$ in order to avoid the double occupancy. The strong electron correlation in the $t$-$J$ model manifests itself by this local constraint anderson87 , which can be treated properly in analytical calculations within the charge-spin separation (CSS) fermion-spin theory feng0304 , where the constrained electron operators are decoupled as $C_{l\uparrow}=h^{\dagger}_{l\uparrow}S^{-}_{l}$ and $C_{l\downarrow}=h^{\dagger}_{l\downarrow}S^{+}_{l}$, with the spinful fermion operator $h_{l\sigma}=e^{-i\Phi_{l\sigma}}h_{l}$ representing the charge degree of freedom together with some effects of spin configuration rearrangements due to the presence of the doped hole itself (charge carrier), while the spin operator $S_{l}$ represents the spin degree of freedom. In particular, it has been shown that under the decoupling scheme, this CSS fermion-spin representation is a natural representation of the constrained electron defined in the Hilbert subspace without double electron occupancy feng07 . The advantage of this CSS fermion-spin approach is that the electron single occupancy local constraint is satisfied in analytical calculations. Furthermore, these charge carriers and spins are gauge invariant, and in this sense, they are real and can be interpreted as the physical excitations laughlin97 . In this CSS fermion-spin representation, the _t–J_ model (1) can be expressed as, $\displaystyle H$ $\displaystyle=$ $\displaystyle t\sum_{l\hat{\eta}}e^{-i({e}/{\hbar}){\bf{A}}(l)\cdot\hat{\eta}}(h^{\dagger}_{l+\hat{\eta}\uparrow}h_{l\uparrow}S^{+}_{l}S^{-}_{l+\hat{\eta}}$ (2) $\displaystyle+$ $\displaystyle h^{\dagger}_{l+\hat{\eta}\downarrow}h_{l\downarrow}S^{-}_{l}S^{+}_{l+\hat{\eta}})$ $\displaystyle-$ $\displaystyle\mu\sum_{l\sigma}h^{\dagger}_{l\sigma}h_{l\sigma}+J_{{\rm eff}}\sum_{l\hat{\eta}}{\bf S}_{l}\cdot{\bf S}_{l+\hat{\eta}},$ where $J_{{\rm eff}}=(1-\delta)^{2}J$, and $\delta=\langle h^{\dagger}_{l\sigma}h_{l\sigma}\rangle=\langle h^{\dagger}_{l}h_{l}\rangle$ is the charge carrier doping concentration. As an important consequence, the kinetic energy term in the _t–J_ model has been transferred as the charge carrier-spin interaction, which reflects that even the kinetic energy term in the _t–J_ Hamiltonian has strong Coulomb contribution due to the restriction of no double occupancy of a given site. In the case of zero magnetic field, we feng0306 have shown in terms of Eliashberg’s strong coupling theory mahan00 that the charge carrier-spin interaction from the kinetic energy term in the _t–J_ model (2) induces a charge carrier pairing state with the d-wave symmetry by exchanging spin excitations in the higher power of the charge carrier doping concentration $\delta$, then the SC transition temperature is identical to the charge carrier pair transition temperature. Moreover, it has been shown that this SC state is the conventional BCS-like with the d-wave symmetry feng07 ; guo07 , so that the basic BCS formalism with the d-wave SC gap function is still valid in quantitatively reproducing all main low energy features of the SC coherence of the quasiparticle peaks in cuprate superconductors, although the pairing mechanism is driven by the kinetic energy by exchanging spin excitations, and other exotic magnetic scattering dai01 ; arai99 is beyond the BCS formalism. Following the previous discussions feng0306 ; feng07 ; guo07 , the full charge carrier diagonal and off-diagonal Green’s functions in the SC state can be obtained explicitly in the Nambu representation as, $\displaystyle\mathbb{G}({\bf{k}},i\omega_{n})=Z_{\rm{hF}}\,\frac{i\omega_{n}\tau_{0}+\bar{\xi}_{\bf{k}}\tau_{3}-\bar{\Delta}_{\rm{hZ}}({\bf{k}})\tau_{1}}{(i\omega_{n})^{2}-E_{{\rm{h}}{\bf{k}}}^{2}},$ (3) where $\tau_{0}$ is the unit matrix, $\tau_{1}$ and $\tau_{3}$ are Pauli matrices, the renormalized charge carrier excitation spectrum $\bar{\xi}_{{\bf k}}=Z_{\rm hF}\xi_{\bf k}$, with the mean-field (MF) charge carrier excitation spectrum $\xi_{{\bf k}}=Zt\chi\gamma_{{\bf k}}-\mu$, the spin correlation function $\chi=\langle S_{i}^{+}S_{i+\hat{\eta}}^{-}\rangle$, $\gamma_{{\bf k}}=(1/Z)\sum_{\hat{\eta}}e^{i{\bf k}\cdot\hat{\eta}}$, $Z$ is the number of the nearest neighbor sites, the renormalized charge carrier d-wave pair gap function $\bar{\Delta}_{\rm hZ}({\bf k})=Z_{\rm hF}\bar{\Delta}_{\rm h}({\bf k})$, where the effective charge carrier d-wave pair gap function $\bar{\Delta}_{\rm h}({\bf k})=\bar{\Delta}_{\rm h}\gamma^{(d)}_{{\bf k}}$ with $\gamma^{(d)}_{{\bf k}}=({\rm cos}k_{x}-{\rm cos}k_{y})/2$, and the charge carrier quasiparticle spectrum $E_{{\rm{h}}{\bf k}}=\sqrt{\bar{\xi}^{2}_{{\bf k}}+|\bar{\Delta}_{\rm hZ}({\bf k})|^{2}}$, while the charge carrier quasiparticle coherent weight $Z_{\rm hF}$ and the effective charge carrier gap parameter $\bar{\Delta}_{\rm h}$ have been determined self-consistently along with another seven quantities and correlation functions feng0306 ; feng07 ; guo07 . Let us emphasize that the quasiparticle coherent weight renormalizing the physical quantities naturally emerges in our formalism (3), and then both the SC gap function and the quasiparticle coherence control the SC state. Therefore in our approach there is no need to introduce any phenomenological charge renormalization factors in order to describe the electromagnetic response sheehy04 . Now we turn to the discussion of the electromagnetic response in the kinetic energy driven cuprate superconductors. The weak external magnetic field applied to the system usually represents a weak perturbation, but the induced field generated by supercurrents cancels this weak external field over most of the volume of the sample. Consequently, the net field acts only very near the surface on a scale of the magnetic field penetration depth and so it can be treated as a weak perturbation on the system as a whole. Therefore the electromagnetic response can be successfully studied within the linear response approach fetter71 ; fukuyama69 , where the averaged value ${\bf{J}}$ of the induced microscopic screening current ${\bf{j}}$ in the presence of the vector potential ${\bf{A}}$ is found as, $J_{\mu}({\bf{q}},\omega)=-\sum\limits_{\nu=1}^{3}K_{\mu\nu}({\bf{q}},\omega)A_{\nu}({\bf{q}},\omega),$ (4) where $K_{\mu\nu}$ is the kernel of the response function and the Greek indices label the axes of the Cartesian coordinate system. Recall that, as always in the linear response method, the thermal average of the supercurrent is calculated with the unperturbed Hamiltonian, i.e. for ${\bf{A}}\equiv 0$ in Eq. (2). Let us also note that the relation (4), which is local in the reciprocal space, in general implies a nonlocal response in the coordinate space. The kernel, which plays a central role in the description of the electromagnetic response, and once known allows us to calculate quantitative characteristics of the electromagnetic response, can be separated into two parts: $K_{\mu\nu}({\bf{q}},\omega)=K^{({\rm{d}})}_{\mu\nu}({\bf{q}},\omega)+K^{({\rm{p}})}_{\mu\nu}({\bf{q}},\omega),$ (5) a diamagnetic part $K^{({\rm{d}})}_{\mu\nu}$ and a paramagnetic one $K^{({\rm{p}})}_{\mu\nu}$. The evaluation of the diamagnetic contribution usually poses no difficulties since it is known almost immediately from the form of the diamagnetic current operator: it turns out to be diagonal and proportional to the average kinetic term. However, the paramagnetic part can only be calculated approximately since it involves evaluation of a retarded current-current correlation function (polarization bubble). As the retarded function is inconvenient for perturbation analysis one usually proceeds with the corresponding imaginary-time-ordered Matsubara function, $P_{\mu\nu}({\bf{q}},\tau)=-\langle T_{\tau}\\{j^{({\rm{p}})}_{\mu}({\bf{q}},\tau)j_{\nu}^{({\rm{p}})}(-{\bf{q}},0)\\}\rangle,$ (6) where the paramagnetic current operator is defined in the imaginary time $\tau$ Heisenberg picture. Hence, the main problem is reduced to the evaluation of a retarded current commutator for the unperturbed system. The retarded current-current correlation function is then obtained in a standard way from the imaginary time Fourier transform $P_{\mu\nu}({\bf{q}},i\omega_{n})$ of the Matsubara function (6) by analytic continuation to real frequencies mahan00 . The vector potential ${\bf{A}}$ (then the weak external magnetic field $B=rot{\bf{A}}$) has been coupled to the electrons, which are now represented by $C_{l\uparrow}=h^{\dagger}_{l\uparrow}S^{-}_{l}$ and $C_{l\downarrow}=h^{\dagger}_{l\downarrow}S^{+}_{l}$ in the CSS fermion-spin representation. However, in the CSS framework, the vector potential ${\bf{A}}$ is coupled to $h^{\dagger}_{l\sigma}$, while the corresponding weak external magnetic field ${\bf B}=rot{\bf{A}}$ is coupled to ${\bf S}_{l}$ by including the Zeeman term zhang09 in the Hamiltonian (1). For cuprate superconductors, the upper critical magnetic field is 50 Tesla or greater around the optimal doping. In this paper, we mainly focus on the case where the applied external magnetic field $B<10$ mT is much less than the upper critical magnetic field. In this case, the Zeeman term zhang09 in the Hamiltonian (1) has been dropped, and then the electron current operator $j_{\mu}=j_{\mu}^{(\rm{d})}+j_{\mu}^{(\rm{p})}$ can be obtained by differentiating the Hamiltonian (2) with respect to the vector potential as, $\displaystyle j_{\mu}^{(\rm{d})}$ $\displaystyle=$ $\displaystyle\frac{\chi e^{2}t}{2\hbar^{2}}\sum\limits_{l\sigma}\left(h_{l+\hat{\mu}\,\sigma}^{\dagger}h_{l\,\sigma}+h_{l\,\sigma}^{\dagger}h_{l+\hat{\mu}\,\sigma}\right)A_{\mu}(l),~{}~{}~{}~{}$ (7a) $\displaystyle j_{\mu}^{(\rm{p})}$ $\displaystyle=$ $\displaystyle-\frac{i\chi et}{2\hbar}\sum\limits_{l\sigma}\left(h_{l+\hat{\mu}\,\sigma}^{\dagger}h_{l\,\sigma}-h_{l\,\sigma}^{\dagger}h_{l+\hat{\mu}\,\sigma}\right),$ (7b) being the diamagnetic and paramagnetic contributions, respectively. Since the diamagnetic current is explicitly proportional to the vector potential, it is straightforward to find the diamagnetic part of the response kernel as, $\displaystyle K_{\mu\nu}^{(\rm{d})}({\bf{q}})$ $\displaystyle=$ $\displaystyle-\frac{Z_{\rm{hF}}\chi e^{2}t}{\hbar^{2}}{1\over N}\sum\limits_{{\bf{k}}}\delta_{\mu\nu}\cos k_{\mu}$ (8) $\displaystyle\times$ $\displaystyle\left(1-\frac{\bar{\xi}_{\bf{k}}}{E_{{\rm{h}}\bf{k}}}\tanh{\frac{\beta E_{{\rm{h}}\bf{k}}}{2}}\right)$ $\displaystyle=$ $\displaystyle-\frac{2\chi\phi e^{2}t}{\hbar^{2}}\,\delta_{\mu\nu}.~{}~{}~{}~{}~{}~{}$ The paramagnetic part of the response kernel is more complicated to calculate, as it involves evaluation of the current-current correlation function (6). In particular, if we want to keep the theory gauge invariant, it is crucial to approximate the correlation function in a way maintaining local charge conservation fukuyama69 ; schrieffer83 ; misawa94 ; arseev06 . Since in the following calculations we will work with a fixed gauge of the vector potential, we postpone the detailed discussion of this problem until Appendix A. Starting with the paramagnetic current operator (7b), we can rewrite its Fourier transform in the notation of Nambu fields $\Psi^{\dagger}_{\bf{k}}=\left(h_{{\bf{k}}\,\uparrow}^{\dagger},h_{-{\bf{k}}\,\downarrow}\right)$ and $\Psi_{{\bf{k}}+{\bf{q}}}=\left(h_{{\bf{k}}+{\bf{q}}\,\uparrow},h_{-{\bf{k}}-{\bf{q}}\,\downarrow}^{\dagger}\right)^{T}$ as $j^{(\rm{p})}_{\mu}({\bf{q}})={1\over N}\sum\limits_{{\bf{k}}}\Psi_{{\bf{k}}}^{\dagger}\left[-\frac{\chi et}{\hbar}\,e^{i\frac{q_{\mu}}{2}}\sin\left(k_{\mu}+\frac{q_{\mu}}{2}\right)\tau_{0}\right]\Psi_{{\bf{k}}+{\bf{q}}}.$ (9) For the purpose of the discussion addressing the gauge invariance problem, presented in Appendix A, it is convenient to find the charge density in the Nambu notation as well. Within the CSS fermion-spin scheme, we first find $\rho({\bf{q}})\approx-({e}/{2N})\sum_{{\bf{k}}}(\delta_{{\bf{q}},0}-h_{{\bf{k}}\,\uparrow}^{\dagger}h_{{\bf{k}}+{\bf{q}}\,\uparrow}-h_{{\bf{k}}\,\downarrow}^{\dagger}h_{{\bf{k}}+{\bf{q}}\,\downarrow})$. Then the paramagnetic four-current operator can be represented in the Nambu form as $j_{\mu}^{\rm{(p)}}({\bf{q}})=\sum\limits_{{\bf{k}}}\Psi_{{\bf{k}}}^{\dagger}\gamma_{\mu}({\bf{k+q}},{\bf{k}})\Psi_{{\bf{k}}+{\bf{q}}}$, where the bare current vertex, ${\mathbf{\gamma}}_{\mu}({\bf{k}}+{\bf{q}},{\bf{k}})=\left\\{\begin{array}[]{ll}-\frac{\chi et}{\hbar}\,e^{i\frac{q_{\mu}}{2}}\sin\left(k_{\mu}+\frac{q_{\mu}}{2}\right)\tau_{0}&{\rm{for}}\ \mu\neq 0\\\ -\frac{e}{2}\,\tau_{3}&{\rm{for}}\ \mu=0.\\\ \end{array}\right.$ (10) It is necessary to be aware that we are calculating the polarization bubble with the paramagnetic current operator (9), i.e., bare current vertices (10), but charge carrier Green functions. Consequently, as in this scenario we do not take into account longitudinal excitations properly schrieffer83 ; misawa94 , the obtained results are valid only in the gauge, where the vector potential is purely transverse, e.g. in the Coulomb gauge. In this case, we can obtain the correlation function (6) in the Matsubara representation as, $\displaystyle P_{\mu\nu}({\bf{q}},i\omega_{n})$ $\displaystyle=$ $\displaystyle\left(\frac{\chi et}{\hbar}\right)^{2}e^{\frac{i}{2}(q_{\mu}-q_{\nu})}{1\over N}\sum\limits_{{\bf{k}}}\sin\left(k_{\mu}+\frac{q_{\mu}}{2}\right)\sin\left(k_{\nu}+\frac{q_{\nu}}{2}\right)\frac{1}{\beta}\sum\limits_{i\nu_{m}}{\rm{Tr}}\,\left[{\mathbb{G}}({\bf{k+q}},i\omega_{n}+i\nu_{m}){\mathbb{G}}({\bf{k}},i\nu_{m})\right].~{}~{}~{}~{}$ (11) Restricting the discussion to the static limit ($\omega\sim 0$) and completing the summation over Matsubara frequencies, we obtain the bare vertex current- current correlation function, and hence the paramagnetic part of the response kernel as, $\displaystyle K_{\mu\nu}^{(\rm{p})}({\bf{q}},0)$ $\displaystyle=$ $\displaystyle-\left(\frac{\chi etZ_{\rm{hF}}}{\hbar^{2}}\right)^{2}e^{\frac{i}{2}(q_{\mu}-q_{\nu})}{1\over N}\sum\limits_{{\bf{k}}}\sin\left(k_{\mu}+\frac{q_{\mu}}{2}\right)\sin\left(k_{\nu}+\frac{q_{\nu}}{2}\right)$ (12) $\displaystyle\times$ $\displaystyle\left\\{\frac{1}{E_{{\rm{h}}{\bf{k}}}+E_{{\rm{h}}{\bf{k+q}}}}\left[1-\frac{\bar{\xi}_{{\bf{k+q}}}\bar{\xi}_{{\bf{k}}}+\bar{\Delta}_{{\rm{hZ}}}({\bf{k+q}})\bar{\Delta}_{{\rm{hZ}}}({\bf{k}})}{E_{{\rm{h}}{\bf{k}}}E_{{\rm{h}}{\bf{k+q}}}}\right]\left[1-n_{\rm{F}}(E_{{\rm{h}}{\bf{k}}})-n_{\rm{F}}(E_{{\rm{h}}{\bf{k+q}}})\right]\right.$ $\displaystyle+$ $\displaystyle\left.\frac{1}{E_{{\rm{h}}{\bf{k}}}-E_{{\rm{h}}{\bf{k+q}}}}\left[1+\frac{\bar{\xi}_{{\bf{k+q}}}\bar{\xi}_{{\bf{k}}}+\bar{\Delta}_{{\rm{hZ}}}({\bf{k+q}})\bar{\Delta}_{{\rm{hZ}}}({\bf{k}})}{E_{{\rm{h}}{\bf{k}}}E_{{\rm{h}}{\bf{k+q}}}}\right]\left[n_{\rm{F}}(E_{{\rm{h}}{\bf{k+q}}})-n_{\rm{F}}(E_{{\rm{h}}{\bf{k}}})\right]\right\\}.~{}~{}~{}~{}~{}$ Note that in the long wavelength limit, when $|{\bf{q}}|\to 0$, the former term in Eq. (12) vanishes, and the latter turns into $-2\left({\chi etZ_{\rm{hF}}}/{N\hbar^{2}}\right)^{2}\sum\limits_{{\bf{k}}}\sin k_{\mu}\sin k_{\nu}\,n_{\rm{F}}(E_{{\rm{h}}{\bf{k}}})[1-n_{\rm{F}}(E_{{\rm{h}}{\bf{k}}})]$, which is equal to zero in the zero-temperature limit. Hence, in this case, the long wavelength electromagnetic response at zero temperature is determined by the diamagnetic part of the kernel only. ## III Quantitative characteristics The way the system reacts to a weak electromagnetic stimulus is entirely described by the linear response kernel, which is calculated within a microscopic model. Once the kernel is known, the effect of a weak external magnetic field can be quantitatively characterized by experimentally measurable quantities such as the magnetic field penetration depth and the local magnetic field profile. Technically, we need to combine one of the Maxwell equations with the relation (4) describing the response of the system and solve them together for the vector potential. This is the step in which a particular gauge of the vector potential—usually implied by the geometry of the system—is set. However, the kernel function derived within the linear response theory describes the response of an _infinite_ system. In order to take into account the confined geometry of cuprate superconductors it is necessary to introduce a surface being the boundary between the environment and the sample. This can be done within the standard specular reflection model landau80 ; tinkham96 with a two-dimensional geometry of the SC plane, in the configuration with external magnetic field perpendicular to the ab plane, as shown in Fig. 1. In the present paper we study magnetic field penetration effects within the ab plane only, so our primary goal is to find and discuss the magnetic field in-plane penetration depth. Figure 1: Geometry of the specular reflection model. The current ${\bf{J}}_{\rm{ext}}$ simulates external magnetic field at the edge of the sample ($x=0$), whereas the induced supercurrent ${\bf{J}}_{\rm{int}}$ is the (linear) reaction of the system. In order to simulate an external magnetic field at the surface of a two- dimensional sample, we introduce an external current sheet $J_{y,\rm{ext}}(x)=-2B_{0}\delta(x)/\mu_{0}$ at the edge $x=0$, where $\mu_{0}$ is the magnetic permeability and $B_{0}$ is the amplitude of the weak external magnetic field at the surface ($x=0$). From the Maxwell equation for the curl of the local magnetic field ${\rm{rot}}\,{{\bf{h}}}=\mu_{0}({\bf{J}}_{\rm{int}}+{\bf{J}}_{\rm{ext}})=\mu_{0}{\bf{J}}_{\rm{int}}+[0,-2B_{0}\delta(x),0]$ and the fact, that the induced supercurrent ${\bf{J}}_{\rm{int}}$ flows along the $y$ axis, we can state that the local magnetic field is of the form ${\bf{h}}({\bf{r}})=[0,0,h_{z}(x)]$. In order to discuss the magnetic field penetration effect, spatial dependence of the local magnetic field has to be found. Let us begin with the identity $\rm{rot}\,\rm{rot}\,{\bf{A}}={\rm{grad}\,\rm{div}\,{\bf{A}}}-\nabla^{2}{\bf{A}}$ and choose the vector potential as ${\bf{A}}({\bf{r}})=[0,A_{y}(x),0]$ setting the Coulomb gauge. In this case, $q_{x}^{2}A_{y}({\bf{q}})=\mu_{0}\left[J_{y,\rm{int}}({\bf{q}})+J_{y,\rm{ext}}({\bf{q}})\right],$ because the vector potential has only non-zero $y$ component. Finally, including the form of the external current, the linear relation (4) between the induced supercurrent and the vector potential $J_{y,\rm{int}}({\bf{q}})=-K_{yy}({\bf{q}})A_{y}({\bf{q}})$, and solving for the vector potential we obtain, $A_{y}({\bf{q}})=-8\pi^{2}B_{0}\,\frac{\delta(q_{y})\delta(q_{z})}{\mu_{0}K_{yy}({\bf{q}})+q_{x}^{2}}.$ (13) Since the vector potential has only the $y$ component, the only non-zero component of the local magnetic field ${\bf{h}}=\rm{rot}\,{\bf{A}}$ is that along the $z$ axis and $h_{z}({\bf{q}})=iq_{x}A_{y}({\bf{q}})$. Substituting the derived form of the vector potential (13), and taking the inverse Fourier transform, the local magnetic field profile can be obtained as, $h_{z}(x)=\frac{B_{0}}{\pi}\int\limits_{-\infty}^{\infty}{\rm{d}}q_{x}\,\frac{q_{x}\sin q_{x}x}{\mu_{0}K_{yy}(q_{x},0,0)+q_{x}^{2}}.$ (14) Local magnetic field profiles can be measured experimentally, e.g. using the muon-spin rotation technique khasanov04 ; suter04 , providing an important tool to investigate the details of magnetic field screening inside the sample. In cuprate superconductors the screening is found to be of exponential character khasanov04 ; suter04 , in support of a local (London-type) nature of the electrodynamics schrieffer83 . For the convenience of the following discussions, we introduce a characteristic length scale $a_{0}=\sqrt{\hbar^{2}a/\mu_{0}e^{2}J}$. Using a reasonably estimative value of $J/k_{\rm{B}}\approx 1000$K and $a\approx 0.383$nm, which is the lattice parameter for the cuprate superconductor YBa2Cu3O7-y, we obtain $a_{0}\approx 97.8$nm. In Fig. 2, we plot the local magnetic field profile (14) as a function of the distance from the surface at temperature $T=0.02J$ for the doping concentration $\delta=0.150$ (solid line), $\delta=0.147$ (dashed line), and $\delta=0.144$ (dotted line) with parameter $t=2.5J$. For comparison, the corresponding experimental result suter04 of the local magnetic field profiles for the high quality YBa2Cu3O7-y sample is also shown in Fig. 2 (inset, bottom). If a weak external field $B_{0}\approx 10$ mT is applied to the system just as it has been done in the experimental measurement suter04 , then the experimental result suter04 for YBa2Cu3O7-y is well reproduced. In particular, our theoretical results perfectly follow an exponential law as expected for the local electrodynamic response. Figure 2: The local magnetic field profile as a function of the distance from the surface at temperature $T=0.02J$ for doping concentration $\delta=0.150$ (solid line), $\delta=0.147$ (dashed line), and $\delta=0.144$ (dotted line) with parameter $t=2.5J$. Inset (top): zoom into the intermediate range of the local magnetic field profile. Inset (bottom): the corresponding experimental result for YBa2Cu3O7-y taken from Ref. suter04, . Figure 3: Temperature dependence of the magnetic field in-plane penetration depth $\Delta\lambda(T)$ for the doping concentration $\delta=0.150$ (solid line), $\delta=0.149$ (dashed line), and $\delta=0.148$ (dotted line) with parameter $t/J=2.5$. Inset: the corresponding experimental data for YBa2Cu3O7-y taken from Ref. kamal98, . The above obtained local magnetic field profile $h_{z}(x)$ allows us to determine the magnetic field in-plane penetration depth $\lambda(T)$ in a straightforward way. According to the definition $\lambda(T)=B_{0}^{-1}\int_{0}^{\infty}h_{z}(x)\,{\rm{d}}x$, the magnetic field in-plane penetration depth can be evaluated as, $\lambda(T)=\frac{2}{\pi}\int\limits_{0}^{\infty}\frac{{\rm{d}}q_{x}}{\mu_{0}K_{yy}(q_{x},0,0)+q_{x}^{2}}.$ (15) In this case, we obtain the zero-temperature magnetic field in-plane penetration depth $\lambda(0)\approx 380.8$nm for the doping concentration $\delta=0.150$ with parameter $t/J=2.5$. This anticipated value is very close to the values of the magnetic field in-plane penetration depth $\lambda\approx 156$nm $\sim 400$nm observed in different families of cuprate superconductors bernhard01 ; khasanov04 ; uemura93 . Furthermore, $\Delta\lambda(T)=\lambda(T)-\lambda(0)$ as a function of temperature $T$ for the doping concentration $\delta=0.150$ (solid line), $\delta=0.149$ (dashed line), and $\delta=0.148$ (dotted line) with parameter $t/J=2.5$ is plotted in Fig. 3 in comparison with the corresponding experimental results kamal98 of YBa2Cu3O7-y (inset). Our theoretical results show linear characteristics of the magnetic field in-plane penetration depth $\Delta\lambda(T)$, except for extremely low temperatures where a strong deviation from the linear characteristics (a nonlinear effect) appears. In particular, this crossover from the linear temperature dependence in the low temperature regime into the nonlinear one at extremely low temperatures is observed experimentally in nominally clean crystals of cuprate superconductors bonn96 ; kamal98 ; jackson00 ; panagopoulos99 ; pereg07 ; khasanov04 ; suter04 ; sonier99 . Apparently, there is a substantial difference between theory and experiment, namely, the value of the difference between $\lambda(T)$ and $\lambda(0)$ calculated theoretically is much smaller than the corresponding value measured in the experiment. However, upon a closer examination one can see immediately that the main difference is due to fact that the calculated $\lambda(T)$ increases slowly with temperature. As for a qualitative discussion in this paper, the overall tendency seen in the theoretical result is consistent with that in the experiment kamal98 . In cuprate superconductors, the values of $J$ and $t$ are believed to vary somewhat from compound to compound damascelli03 . Therefore the quantitative agreement can be reached by adjustments of theory’s parameters $t$ and $J$, or by introducing the next neighbor hopping $t^{\prime}$. Figure 4: Doping dependence of the zero-temperature in-plane superfluid density in the underdoped regime with $t/J=2.5$. Inset: the corresponding experimental result for YBa2Cu3O7-y taken from Ref. broun07, . A quantity which is closely related to the magnetic field in-plane penetration depth $\lambda(T)$ is the in-plane superfluid density $\rho_{\rm s}(T)\equiv\lambda^{-2}(T)$. For a better understanding of the physical properties of cuprate superconductors, we have calculated the doping dependence of the zero-temperature in-plane superfluid density $\rho_{\rm s}(0)$ in the underdoped regime. The result for parameter $t/J=2.5$ is plotted in Fig. 4 in comparison with the corresponding experimental data broun07 for YBa2Cu3O7-y (inset). It is shown that the in-plane superfluid density $\rho_{\rm s}(0)$ in the underdoped regime vanishes more or less linearly with decreasing doping concentration $\delta$, in qualitative agreement with experimental results of cuprate superconductors uemura8991 ; broun07 ; bernhard01 . This result also is a natural consequence of the linear doping dependence of the SC transition temperature $T_{c}\propto\delta$ in the underdoped regime in the framework of the kinetic energy driven SC mechanism feng0306 , where the SC transition temperature $T_{c}$ is set by the charge carrier doping concentration, and then the density of the charge carriers directly determines the in-plane superfluid density in the underdoped regime. The appearance of the nonlinearity in the temperature dependence of the magnetic field in-plane penetration depth in cuprate superconductors at extremely low temperatures, as shown in Fig. 3, can be attributed to the nonlocal effects, which in the case of a pure d-wave cuprate superconductor with nodes in the gap become significant for the electromagnetic response yip92 ; kosztin97 ; franz97 ; li00 ; sheehy04 . In general, the relation between the supercurrent and the vector potential (4) is nonlocal in the coordinate space due to the finite size of charge carrier Cooper pairs. In the framework of the kinetic energy driven d-wave SC mechanism, the size of charge carrier pairs in the clean limit is of the order of the coherence length $\zeta({\bf{k}})=\hbar v_{\rm F}/\pi\Delta_{\rm h}({\bf{k}})$, where $v_{\rm{F}}=\hbar^{-1}\partial\xi_{\bf k}/\partial{\bf k}|_{k_{F}}$ is the charge carrier velocity at the Fermi surface, and therefore the size of charge carrier pairs is momentum dependent. Although the weak external magnetic field decays exponentially on the scale of the magnetic field in-plane penetration length $\lambda(T)$, any nonlocal contributions to measurable quantities are of the order of $\kappa^{-2}$, where $\kappa$, known as the Ginzburg–Landau parameter, is the ratio of the magnetic field in-plane penetration depth $\lambda$ and the coherence length $\zeta$. However, in the d-wave cuprate superconductors, the characteristic feature is the existence of four nodal points $[\pm\pi/2,\pm\pi/2]$ in the Brillouin zone, where the charge carrier gap function vanishes $\Delta_{\rm h}({\bf{k}})|_{[\pm\pi/2,\pm\pi/2]}=\Delta_{\rm h}({\rm cos}k_{x}-{\rm cos}k_{y})/2|_{[\pm\pi/2,\pm\pi/2]}=0$. As a consequence, the coherence length $\zeta({\bf{k}})$ diverges around the nodes. In particular, at extremely low temperatures, the quasiparticles selectively populate the nodal region, and the major contribution to measurable quantities comes from these quasiparticles. In this case, the Ginzburg–Landau ratio $\kappa({\bf{k}})$ around the nodal region is no longer large enough for the system to belong to the class of type-II superconductors, and the condition of the local limit is not fulfilled kosztin97 . On contrary, the system falls then into the extreme nonlocal limit, and therefore the nonlinear characteristic in the temperature dependence of the magnetic field in-plane penetration depth can be observed experimentally in cuprate superconductors at sufficiently low temperatures bonn96 ; khasanov04 ; suter04 ; sonier99 . However, with increasing temperature, the quasiparticles around the nodal region become excited out of the condensate, and the nonlocal effect fades away. In this case, the momentum dependent coherence length $\zeta({\bf{k}})$ can be replaced approximately with the isotropic one $\zeta_{0}=\hbar v_{\rm F}/\pi\Delta_{\rm h}$. Then the Ginzburg–Landau parameter $\kappa_{0}\approx\lambda(0)/\zeta_{0}\approx 180$, and the condition for the local limit is satisfied. This anticipated value of the Ginzburg–Landau parameter $\kappa_{0}\approx 180$ is not too far from the range $\kappa_{0}\approx 150\sim 400$ estimated experimentally for different families of cuprate superconductors bernhard01 ; khasanov04 ; uemura93 . Consequently, the cuprate superconductors at moderately low temperatures turn out to be type-II superconductors, where nonlocal effects are negligible, the electrodynamics is purely local and the magnetic field decays exponentially over a length of the order of a few hundreds nm. In this local limit, the pure d-wave pairing state in the kinetic energy driven SC mechanism gives the magnetic field penetration depth $\lambda(T)\propto T$ tsuei00 ; kosztin97 . This is why the linear temperature dependence of the magnetic field in-plane penetration depth $\lambda(T)$ is observed experimentally bonn96 ; hardy93 ; kamal98 ; jackson00 ; panagopoulos99 ; pereg07 in cuprate superconductors at moderately low temperatures. Finally, we have to note that a deviation from the linear Uemura relation between the in-plane superfluid density $\rho_{\rm s}(0)$ and doping concentration $\delta$ has been observed recently in the underdoped regime broun07 ; pereg07 ; hardy04 . This deviation from the linear Uemura relation suggests a sublinear dependence of the critical temperature $T_{\rm{c}}$ and the superfluid density $\rho_{\rm s}(0)$, since $T_{\rm{c}}$ must fall to zero when $\rho_{\rm s}(0)$ does pereg07 ; hardy04 . The parent compound of doped cuprate superconductors is a Mott insulator with an antiferromagnetic long- range order and superconductivity occurs when the antiferromagnetic long-range order state is suppressed by doped charge carriers. Since these doped charge carriers in cuprate superconductors are induced by the replacement of some ions by other ones with different valences, or the addition of excess oxygens in the block layer, therefore, in principle, all cuprate superconductors have natural impurities damascelli03 . Therefore the impurities play an important role in the electromagnetic response and lead to some subtle differences in the electromagnetic response for different families of cuprate superconductors bonn96 . In this case, the impurity effect on the SC state of cuprate superconductors is also a possible source for the deviation from the linear Uemura relation. In this context we wang08 have discussed the effect of the extended impurity scatterers on the quasiparticle transport of cuprate superconductors in the SC state based on the nodal approximation of the quasiparticle excitations and scattering processes, and predicted that in contrast with the dome shape of the doping dependent SC gap parameter, the minimum of the microwave conductivity occurs around the optimal doping, and then increases in both underdoped and overdoped regimes. However, in this paper we are primarily interested in exploring the general notion of the electromagnetic response in cuprate superconductors in the SC state. The qualitative agreement between the present theoretical results in the clean limit and experimental data for different families of cuprate superconductors provides an important confirmation of the nature of the SC phase of cuprate superconductors as a d-wave BCS-like SC state within the kinetic energy driven SC mechanism. ## IV Conclusions In this paper we have discussed the electromagnetic response in cuprate superconductors within the framework of kinetic energy driven d-wave superconductivity. Following the linear response theory and taking into account the two-dimensional geometry of cuprate superconductors within the specular reflection model, we have reproduced some main features of the electromagnetic response experiments on cuprate superconductors, including the exponential local magnetic field profile, the linear temperature dependence of the in-plane penetration depth in the low temperature range and its nonlinear temperature dependence at extremely low temperatures. Moreover, the linear doping dependence of the zero-temperature in-plane superfluid density in the underdoped regime has been reproduced. In particular, we have clearly identified the limitations of the used approximations, especially with respect to the problem of gauge invariance. Furthermore, we have proposed a method to generalize the discussions in order to make them independent of a particular choice of the vector potential. ###### Acknowledgements. The authors would like to thank Dr. Zhi Wang and Dr. Yu Lan for helpful discussions. This work was supported by the National Natural Science Foundation of China under Grant No. 10774015, and the funds from the Ministry of Science and Technology of China under Grant Nos. 2006CB601002 and 2006CB921300. MK gratefully acknowledges support from a research scholarship funded by Institute of Physics, Wrocław University of Technology. ## Appendix A Gauge-invariant electromagnetic response It is well known that gauge invariance is a direct consequence of local charge conservation fukuyama69 ; schrieffer83 , which is mathematically expressed by the charge density-current continuity equation or its Green function analogue called the generalized Ward identity (GWI) fukuyama69 ; schrieffer83 ; misawa94 ; arseev06 $-2N\sum\limits_{\mu=0}^{3}q_{\mu}\Gamma_{\mu}(k+q,k)=\tau_{3}\mathbb{G}^{-1}(k)-\mathbb{G}^{-1}(k+q)\tau_{3}.$ (16) Here $\Gamma_{\mu}$ is a dressed version of the four-current vertex function, and the four-vector notation $q=({\bf{q}},q_{0}=i\omega)$ along with the metric $(1,1,1,-1)$ has been introduced. Since the local charge conservation requirement is quite universal and fundamental, it should be inherent to any theory of the electromagnetic response which is expected to be gauge invariant. The purpose of this appendix is to propose—within the framework of the kinetic energy driven superconductivity—a method to dress the current vertex in a way, which does not violate the GWI. Once such a method is found, the bare polarization bubble (6) can be replaced with its dressed version presented in Fig. 5, and the resulting kernel of the response function will provide correct results for any gauge of the vector potential. Figure 5: Dressed polarization bubble (Nambu notation). Here both the Green function and the current vertex are dressed with the pairing interaction due to the spin bubble. In the first step we will note that $-2N\sum\limits_{\mu=0}^{3}q_{\mu}\gamma_{\mu}\left(k+q,k\right)=\tau_{3}\mathbb{G}^{(0)-1}(k)-\mathbb{G}^{(0)-1}(k+q)\tau_{3},$ (17) i.e. that the GWI for the bare current vertex is satisfied with the MF charge carrier Green function $\mathbb{G}^{(0)}(k)=[(i\omega_{n})^{2}-\xi_{\bf{k}}^{2}]^{-1}(i\omega_{n}\tau_{0}+\xi_{\bf{k}}\tau_{3})$. Substituting the MF charge carrier Green function, the rhs of Eq. (17) turns into $\tau_{3}\mathbb{G}^{(0)-1}(k)-\mathbb{G}^{(0)-1}(k+q)\tau_{3}=\left(\xi_{\bf{k+q}}-\xi_{{\bf{k}}}\right)\tau_{0}-q_{0}\tau_{3}$. Moreover, in the long wavelength limit, after including the explicit form of the MF charge carrier dispersion relation found within the framework of the kinetic energy driven superconductivity feng07 , it further simplifies to $\tau_{3}\mathbb{G}^{(0)-1}(k)-\mathbb{G}^{(0)-1}(k+q)\tau_{3}\approx\left[-2t\chi(q_{x}\sin k_{x}+q_{y}\sin k_{y})\right]\tau_{0}-q_{0}\tau_{3}.$ Now, recalling the form of the bare vertex (10), we can notice that in the long wavelength limit the scalar product on the left-hand side of Eq. (17) $-q_{0}\gamma_{0}+{\bf{q}}{\bf{\gamma}}=(2N)^{-1}\left(\tau_{3}q_{0}-\tau_{0}\nabla_{\bf{k}}\xi_{\bf{k}}\cdot{\bf{q}}\right)$, which proves the equality (17). It is well known that in order to obtain a dressed vertex function, which does not violate the GWI, a ladder-type approximation can be adapted schrieffer83 ; fukuyama69 ; misawa94 . The nature of the pairing mechanism feng0306 ; feng07 , which originates from the spin bubble, suggests a ladder-like approximation of the form, $\displaystyle\Gamma_{\mu}(k+q,k)$ $\displaystyle=$ $\displaystyle\gamma_{\mu}(k+q,k)+\frac{1}{N}\,\frac{1}{\beta}\sum\limits_{p}\tau_{3}\mathbb{G}(k+p+q)\Gamma_{\mu}(k+p+q,k+p){\mathbb{G}}(k+p)\tau_{3}$ (18) $\displaystyle\times$ $\displaystyle\frac{1}{N}\sum\limits_{{\bf{p}}^{\prime}}\Lambda^{2}_{{\bf{p}}+{\bf{p}}^{\prime}+{\bf{k}}}\Pi({\bf{p}},{\bf{p}}^{\prime};ip_{m}),~{}~{}~{}~{}~{}$ which is graphically presented in Fig. 6. Figure 6: Ladder-type approximation for the dressed vertex. In order to prove that the approximation (18) for the dressed vertex in fact implies a gauge invariant description of the electromagnetic response, it is necessary and sufficient to check whether it does not violate the GWI (16). In order to prove it, we insert the dressed vertex function (18) into the left- hand side of Eq. (16) and use the identity $-2N\sum_{\mu=0}^{3}q_{\mu}\Gamma_{\mu}(s+q,s)=\tau_{3}{\mathbb{G}}^{-1}(s)-{\mathbb{G}}^{-1}(s+q)\tau_{3}$ to obtain $\displaystyle\sum\limits_{\mu=0}^{3}q_{\mu}\Gamma_{\mu}(k+q,k)$ $\displaystyle=$ $\displaystyle\sum\limits_{\mu=0}^{3}q_{\mu}\gamma_{\mu}(k+q,k)+\frac{1}{N}\,\frac{1}{\beta}\sum\limits_{p}\left(-\frac{1}{2N}\right)\left[\tau_{3}{\mathbb{G}}(k+p+q)\tau_{3}-\tau_{3}{\mathbb{G}}(k+p)\tau_{3}\right]$ (19) $\displaystyle\times$ $\displaystyle\frac{1}{N}\sum\limits_{{\bf{p}}^{\prime}}\Lambda^{2}_{{\bf{p}}+{\bf{p}}^{\prime}+{\bf{k}}}\Pi({\bf{p}},{\bf{p}}^{\prime};ip_{m}).~{}~{}~{}~{}~{}$ In the long wavelength limit we use the approximation $\Lambda^{2}_{{\bf{p}}+{\bf{p}}^{\prime}+{\bf{k}}}\approx\Lambda^{2}_{{\bf{p}}+{\bf{p}}^{\prime}+{\bf{k}}+{\bf{q}}}$. Then we can simplify Eq. (19) into $\sum_{\mu=0}^{3}q_{\mu}\Gamma_{\mu}(k+q,k)\approx\sum_{\mu=0}^{3}q_{\mu}\gamma_{\mu}(k+q,k)-\left[\Sigma(k+q)\tau_{3}-\tau_{3}\Sigma(k)\right]/2N.$ Using the fact that the free vertex satisfies the GWI with the MF Green function, as stated in Eq. (17), and arranging the terms with respect to the Pauli matrices, we have $\displaystyle-2N\sum\limits_{\mu=0}^{3}q_{\mu}\Gamma_{\mu}(k+q,k)$ $\displaystyle\approx$ $\displaystyle\tau_{3}[\mathbb{G}^{(0)-1}(k)-\Sigma(k)]$ $\displaystyle-$ $\displaystyle[\mathbb{G}^{(0)-1}(k+q)-\Sigma(k+q)]\tau_{3}.$ Hence, identifying the terms in the square brackets as dressed charge carrier Green functions, we eventually obtain the GWI (16), what proves that the ladder-type approximation (18) for the vertex function in the dressed polarization bubble in Fig. 5 is consistent with the GWI. Consequently, the kernel of the linear response calculated with the dressed polarization bubble is gauge invariant. ## References * (1) To whom correspondence should be addressed, E-mail: spfeng@bnu.edu.cn * (2) See, e.g., J.R. Schrieffer, _Theory of Superconductivity_ (Addison-Wesley, San Francisco, 1964). * (3) See, e.g., B. A. Bonn and W. N. Hardy, in _Physical Properties of High Temperature Superconductors_ V, edited by D.M. Ginsberg (World Scientific, Singapore, 1996). * (4) See, e.g., C.C. Tsuei and J.R. Kirtley, Rev. Mod. Phys. 72 (2000) 969, and references therein. * (5) W.N. Hardy, D.A. Bonn, D.C. Morgan, Ruixing Liang, and Kuan Zhang, Phys. Rev. Lett. 70 (1993) 3999. * (6) H. Ding, J.C. Campuzano, K. Gofron, C. Gu, R. Liu, B. W. Veal, G. Jennings, Phys. Rev. B. 50 (1994) 1333; H. Ding, J.C. Campuzano, A.F. Bellman, T. Yokoya, M.R. Norman, M. Randeria, T. Takahashi, H. Katayama-Yoshida, T. Mochiku, K. Kadowaki, and G. Jennings, Phys. Rev. Lett. 74 (1995) 2784. * (7) See, e.g., A. Damascelli, Z. Hussain, and Z.X. Shen, Rev. Mod. Phys. 75 (2003) 473. * (8) S. Kamal, Ruixing Liang, A. Hosseini, D.A. Bonn, and W.N. Hardy, Phys. Rev. B. 58 (1998) R8933. * (9) T. J. Jackson, T. M. Riseman, E. M. Forgan, H. Glückler, T. Prokscha, E. Morenzoni, M. Pleines, Ch. Niedermayer, G. Schatz, H. Luetkens, and J. Litterst, Phys. Rev. Lett. 84 (2000) 4958; Kuan Zhang, D. A. Bonn, S. Kamal, Ruixing Liang, D. J. Baar, W. N. Hardy, D. Basov, and T. Timusk, Phys. Rev. Lett. 73 (1994) 2484; Jian Mao, D. H. Wu, J. L. Peng, R. L. Greene, and Steven M. Anlage, Phys. Rev. B 51 (1995) 3316. * (10) C. Panagopoulos, B. D. Rainford, J. R. Cooper, W. Lo, J. L. Tallon, J. W. Loram, J. Betouras, Y. S. Wang, and C. W. Chu, Phys. Rev. B. 60 (1999) 14617; T. Jacobs, S. Sridhar, Qiang Li, G. D. Gu, and N. Koshizuka, Phys. Rev. Lett. 75 (1995) 4516; Shih-Fu Lee, D. C. Morgan, R. J. Ormeno, D. M. Broun, R. A. Doyle, J. R. Waldram, and K. Kadowaki, Phys. Rev. Lett. 77 (1996) 735. * (11) T. Pereg-Barnea, P.J. Turner, R. Harris, G.K. Mullins, J.S. Bobowski, M. Raudsepp, Ruixing Liang, D.A. Bonn, and W.N. Hardy, Phys. Rev. B 69 (2004) 184513; C. Panagopoulos, J. R. Cooper, G. B. Peacock, I. Gameson, P. P. Edwards, W. Schmidbauer, and J. W. Hodby, Phys. Rev. B 53 (1996) R2999. * (12) R. Khasanov, D.G. Eshchenko, H. Luetkens, E. Morenzoni, T. Prokscha, A. Suter, N. Garifianov, M. Mali, J. Roos, K. Conder, and H. Keller, Phys. Rev. Lett. 92 (2004) 057602. * (13) A. Suter, E. Morenzoni R. Khasanov, H. Luetkens, T. Prokscha, and N. Garifianov, Phys. Rev. Lett. 92 (2004) 087001\. * (14) J.E. Sonier, J.H. Brewer, R.F. Kiefl, G.D. Morris, R. Miller, D.A. Bonn, J. Chakhalian, R.H. Heffner, W.N. Hardy, and R. Liang, Phys. Rev. Lett. 83 (1999) 4156; M.H.S. Amin, M. Franz, and I. Affleck, Phys. Rev. Lett. 84 (2000) 5864. * (15) Y. Uemura, G. M. Luke, B. J. Sternlieb, J. H. Brewer, J. F. Carolan, W. N. Hardy, R. Kadono, J. R. Kempton, R. F. Kiefl, S. R. Kreitzman, P. Mulhern, T. M. Riseman, D. Ll. Williams, B. X. Yang, S. Uchida, H. Takagi, J. Gopalakrishnan, A. W. Sleight, M. A. Subramanian, C. L. Chien, M. Z. Cieplak, Gang Xiao, V. Y. Lee, B. W. Statt, C. E. Stronach, W. J. Kossler, and X. H. Yu, Phys. Rev. Lett. 62 (1989) 2317; Y. J. Uemura, L. P. Le, G. M. Luke, B. J. Sternlieb, W. D. Wu, J. H. Brewer, T. M. Riseman, C. L. Seaman, M. B. Maple, M. Ishikawa, D. G. Hinks, J. D. Jorgensen, G. Saito, and H. Yamochi, Phys. Rev. Lett. 66 (1991) 2665. * (16) D. M. Broun, W. A. Huttema, P. J. Turner, S. Özcan, B. Morgan, Ruixing Liang, W. N. Hardy, and D. A. Bonn, Phys. Rev. Lett. 99 (2007) 237003. * (17) C. Bernhard, J.L. Tallon, Th. Blasius, A. Golnik, and Ch. Niedermeyer, Phys. Rev. Lett. 86 (2001) 1614. * (18) S.K. Yip and J. Sauls, Phys. Rev. Lett. 69 (1992) 2264\. * (19) I. Kosztin and A.J. Legget, Phys. Rev. Lett. 79 (1997) 135. * (20) M. Franz, I. Affleck, and M. H. S. Amin, Phys. Rev. Lett. 79 (1997) 1555. * (21) Mei-Rong Li, P.J. Hirschfeld, and P. Wölfle, Phys. Rev. B 61 (2000) 648. * (22) D.E. Sheehy, T.P. Davis, and M. Franz, Phys. Rev. B 70 (2004) 054510. * (23) H. Matsui, T. Sato, T. Takahashi, S.C. Wang, H.B. Yang, H. Ding, T. Fujii, T. Watanabe, and A. Matsuda, Phys. Rev. Lett. 90 (2003) 217002; J. C. Campuzano, H. Ding, M. R. Norman, M. Randeira, A. F. Bellman, T. Yokoya, T. Takahashi, H. Katayama-Yoshida, T. Mochiku, and K. Kadowaki Phys. Rev. B 53 (1996) R14737. * (24) Shiping Feng, Phys. Rev. B 68 (2003) 184501; Shiping Feng, Tianxing Ma, and Huaiming Guo, Physica C 436 (2006) 14. * (25) P.W. Anderson, in: Frontiers and Borderlines in Many Particle Physics, edited by R. A. Broglia and J.R. Schrieffer (North-Holland, Amsterdam, 1987), p. 1; Science 235 (1987) 1196. * (26) See, e.g., the review: Shiping Feng, Huaiming Guo, Yu Lan, and Li Cheng, Int. J. Mod. Phys. B 22 (2008) 3757, and references therein. * (27) Huaiming Guo and Shiping Feng, Phys. Lett. A 361 (2007) 382; Shiping Feng and Tianxing Ma, Phys. Lett. A 350 (2006) 138; Yu Lan, Jihong Qin, and Shiping Feng, Phys. Rev. B 76 (2007) 014533; Weifang Wang, Zhi Wang, Jingge Zhang, and Shiping Feng, Phys. Lett. A 374 (2010) 632. * (28) Li Cheng and Shiping Feng, Phys. Rev. B 77 (2008) 054518; Shiping Feng, Tianxing Ma, and Xintian Wu, Phys. Lett. A 352 (2006) 438; Shiping Feng and Tianxing Ma, in Superconductivity Research Horizons, edited by Eugene H. Peterson (Nova Science Publishers, Nrw York, 2007) chapter 5, pp. 129. * (29) P. Dai, H.A. Mook, R.D. Hunt, and F. Dog̃an, Phys. Rev. B 63 (2001) 054525; Ph. Bourges, B. Keimer, S. Pailhés, L.P. Regnault, Y. Sidis, and C. Ulrich, Physica C 424 (2005) 45. * (30) M. Arai, T. Nishijima, Y. Endoh, T. Egami, S. Tajima, K. Tomimoto, Y. Shiohara, M. Takahashi, A. Garret, and S.M. Bennington, Phys. Rev. Lett. 83 (1999) 608; S.M. Hayden, H.A. Mook, P. Dai, T.G. Perring, and F. Dog̃an, Nature 429 (2004) 531; C. Stock, W.J.L. Buyers, R.A. Cowley, P.S. Clegg, R. Coldea, C.D. Frost, R. Liang, D. Peets, D. Bonn, W.N. Hardy, and R.J. Birgeneau, Phys. Rev. B 71 (2005) 024522. * (31) See, e.g., L.D. Landau, L.P. Pitaevskii, _Statistical Physics (Part II)_ (Pergamon Press Ltd., 1980) Sec. 52. * (32) See, e.g., M. Tinkham, _Introduction to Superconductivity_ (McGraw-Hill, 1996) Appendix 3. * (33) J.E. Hirsch and F. Marsiglio, Phys. Rev. B 45 (1992) 4807; D.J. Scalapino, S.R. White, and S. C. Zhang, Phys. Rev. Lett. 68 (1992) 2830; Phys. Rev. B 47 (1993) 7995; T. Kostyrko, R. Micnas, and K.A. Chao, Phys. Rev. B 49 (1994) 6158\. * (34) S. Misawa, Phys. Rev. B 49 (1994) 6305. * (35) Shiping Feng, Jihong Qin, and Tianxing Ma, J. Phys.: Condens. Matter 16 (2004) 343; Shiping Feng, Tianxing Ma, and Jihong Qin, Mod. Phys. Lett. B 17 (2003) 361. * (36) R.B. Laughlin, Phys. Rev. Lett. 79 (1997) 1726; J. Low. Tem. Phys. 99 (1995) 443. * (37) See, e.g., G.D. Mahan, _Many-Particle Physics_ , (Plenum Press, New York, 1981); G.M. Eliashberg, Sov. Phys. JETP 11 (1960) 696; D.J. Scalapino, J.R. Schrieffer, and J.W. Wilkins, Phys. Rev. 148 (1966) 263. * (38) See, e.g., A.L. Fetter and J.D. Walecka, _Quantum Theory of Many-Particle Systems_ (McGraw-Hill, 1971) Sec. 13.52. * (39) H. Fukuyama, H. Ebisawa, and Y. Wada, Prog. Theor. Phys. 42 (1969) 494; H. Fukuyama, Prog. Theor. Phys. 42 (1969) 1284. * (40) Jingge Zhang, Li Cheng, Huaiming Guo, and Shiping Feng, J. Magn. Magn. Mater. 321 (2009) 216. * (41) P.I. Arseev, S.O. Loiko, N.K. Fedorov, Phys.-Usp. 49 (2006) 1. * (42) Y. J. Uemura, A. Keren, L. P. Le, G. M. Luke, W. D. Wu, Y. Kubo, T. Manako, Y. Shimakawa, M. Subramanian, J. L. Cobb, and J. T. Markert, Nature 364 (1993) 605; Ch. Niedermayer, C. Bernhard, U. Binninger, H. Gückler, J. L. Tallon, E. J. Ansaldo, and J. I. Budnick, Phys. Rev. Lett. 71 (1993) 1764; M. Nideröst, R. Frassanito, M. Saalfrank, A. C. Mota, G. Blatter, V. N. Zavaritsky, T. W. Li, and P. H. Kes, Phys. Rev. Lett. 81 (1998) 3231; S. L. Lee, P. Zimmermann, H. Keller, M. Warden, I. M. Savić, R. Schauwecker, D. Zech, R. Cubitt, E. M. Forgan, P. H. Kes, T. W. Li, A. A. Menovsky, and Z. Tarnawski, Phys. Rev. Lett. 71 (1993) 3862; C. Panagopoulos, B. D. Rainford, J. R. Cooper, W. Lo, J. L. Tallon, J. W. Loram, J. Betouras, Y. S. Wang and C. W. Chu, Phys. Rev. B 60 (1999) 14617; L. Fábrega, A. Calleja, A. Sin, S. Piñol, X. Obradors, J. Fontcuberta, and P. J. C. King, Phys. Rev. B 60 (1999) 7579. * (43) J. L. Tallon, J. W. Loram, J. R. Cooper, C. Panagopoulos, and C. Bernhard, Phys. Rev. B 68 (2003) 180501. * (44) Zhi Wang, Huaiming Guo, and Shiping Feng, Physica C 468 (2008) 1078; Zhi Wang and Shiping Feng, Phys. Rev. B 80 (2009) 174507.
arxiv-papers
2009-04-01T08:41:51
2024-09-04T02:49:01.571715
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Mateusz Krzyzosiak, Zheyu Huang, Shiping Feng, and Ryszard Gonczarek", "submitter": "Shiping Feng", "url": "https://arxiv.org/abs/0904.0093" }
0904.0096
# Weibel instability and associated strong fields in a fully 3D simulation of a relativistic shock K.-I. Nishikawa11affiliation: Center for Space Plasma and Aeronomic Research, University of Alabama in Huntsville, NSSTC, 320 Sparkman Drive, Huntsville, AL 35805; ken-ichi.nishikawa-1@nasa.gov , J. Niemiec22affiliation: Institute of Nuclear Physics PAN, ul. Radzikowskiego 152, 31-342 Kraków, Poland , P.E. Hardee33affiliation: Department of Physics and Astronomy, The University of Alabama, Tuscaloosa, AL 35487 , M. Medvedev44affiliation: Department of Physics and Astronomy, University of Kansas, KS 66045 , H. Sol55affiliation: LUTH, Observatore de Paris-Meudon, 5 place Jules Jansen, 92195 Meudon Cedex, France , Y. Mizuno11affiliation: Center for Space Plasma and Aeronomic Research, University of Alabama in Huntsville, NSSTC, 320 Sparkman Drive, Huntsville, AL 35805; ken-ichi.nishikawa-1@nasa.gov , B. Zhang66affiliation: Department of Physics, University of Nevada, Las Vegas, NV 89154 , M. Pohl77affiliation: Department of Physics and Astronomy, Iowa State University, Ames, IA 50011 , M. Oka11affiliation: Center for Space Plasma and Aeronomic Research, University of Alabama in Huntsville, NSSTC, 320 Sparkman Drive, Huntsville, AL 35805; ken-ichi.nishikawa-1@nasa.gov , D. H. Hartmann88affiliation: Department of Physics and Astronomy, Clemson University, Clemson, SC 29634 ###### Abstract Plasma instabilities (e.g., Buneman, Weibel and other two-stream instabilities) excited in collisionless shocks are responsible for particle (electron, positron, and ion) acceleration. Using a new 3-D relativistic particle-in-cell code, we have investigated the particle acceleration and shock structure associated with an unmagnetized relativistic electron-positron jet propagating into an unmagnetized electron-positron plasma. The simulation has been performed using a long simulation system in order to study the nonlinear stages of the Weibel instability, the particle acceleration mechanism, and the shock structure. Cold jet electrons are thermalized and slowed while the ambient electrons are swept up to create a partially developed hydrodynamic (HD) like shock structure. In the leading shock, electron density increases by a factor of $\lesssim 3.5$ in the simulation frame. Strong electromagnetic fields are generated in the trailing shock and provide an emission site. We discuss the possible implication of our simulation results within the AGN and GRB context. ###### Subject headings: relativistic jets: Weibel instability - shock formation - electron-positron plasma, particle acceleration, magnetic field generation - particle-in-cell ††slugcomment: submitted to ApJL ## 1\. Introduction Particle-in-cell (PIC) simulations can shed light on the microphysics within relativistic shocks. Recent PIC simulations show that particle acceleration occurs within the downstream jet (e.g., Frederiksen et al. 2004; Nishikawa et al. 2003, 2005, 2006, 2008, 2009; Hededal et al. 2004; Hededal & Nishikawa 2005; Silva et al. 2003; Jaroschek et al. 2005; Chang, Spitkovsky & Arons 2008; Dieckmann, Shukla, & Drury 2008; Spitkovsky 2008a,b; Martins et al. 2009). In general, these simulations confirm that a relativistic shock in weakly or non magnetized plasma is dominated by the Weibel instability (Weibel 1959). The associated current filaments and magnetic fields (e.g., Medvedev & Loeb 1999) accelerate electrons (e.g., Nishikawa et al. 2006) and cosmic rays, which affect the pre-shock medium (Medvedev & Zakutnyaya 2009). In this paper we present new three-dimensional simulation results for an electron-positron jet injected into an electron-positron plasma using a long simulation grid. A leading and trailing shock system develops with strong electromagnetic fields accompanying the trailing shock. ## 2\. Simulation Setup The code used in this study is an MPI-based parallel version of the relativistic electromagnetic particle (REMP) code TRISTAN (Buneman 1993; Nishikawa et al. 2003, Niemiec et al. 2008). The simulations have been performed using a grid with ($L_{\rm x},L_{\rm y},L_{\rm z})=(4005,131,131)$ cells and a total of $\sim 1$ billion particles (12 particles$/$cell$/$species for the ambient plasma) in the active grid. The electron skin depth, $\lambda_{\rm s}=c/\omega_{\rm pe}=10.0\Delta$, where $\omega_{\rm pe}=(e^{2}n_{\rm a}/\epsilon_{0}m_{\rm e})^{1/2}$ is the electron plasma frequency and the electron Debye length $\lambda_{\rm D}$ is half of the cell size, $\Delta$. This computational domain is six times longer than in our previous simulations (Nishikawa et al. 2006; Ramirez-Ruiz, Nishikawa & Hededal 2007). The jet-electron number density in the simulation reference frame is $0.676~{}n_{\rm a}$, where $n_{\rm a}$ is the ambient electron density, and the jet Lorentz factor is $\gamma_{j}=15$. The jet-electron/positron thermal velocity is $v_{\rm j,th}=0.014~{}c$ in the jet reference frame, where $c=1$ is the speed of light. The electron/positron thermal velocity in the ambient plasma is $v_{\rm a,th}=0.05~{}c$. As in our previous work (e.g., Nishikawa et al. 2006) the jet is injected in a plane across the computational grid located at $x=25\Delta$ in order to eliminate effects associated with the boundary at $x=x_{\min}$. Radiating boundary conditions are used on the planes at $x=x_{\min}$ and $x=x_{\max}$ and periodic boundary conditions on all transverse boundaries (Buneman 1993). The jet makes contact with the ambient plasma at a 2D interface spanning the computational domain. Here the formation and dynamics of a small portion of a much larger shock are studied in a spatial and temporal way that includes the spatial development of nonlinear saturation and dissipation from the injection point to the jet front defined by the fastest moving jet particles. ## 3\. Simulation Results Figure 1a & b show the averaged (in the $y-z$ plane) (a) jet (red), ambient (blue), and total (black) electron density and (b) electromagnetic field energy divided by the total jet kinetic energy ($E^{\rm j}_{\rm t}=\sum_{i=e,p}m_{\rm i}c^{2}(\gamma_{\rm j}-1)$) at $t=3250~{}\omega_{\rm pe}^{-1}$. Here, “e” and “p” denote electron and positron. Positron density profiles are similar to electron profiles. Figure 1.— Averaged values of (a): jet (red), ambient (blue), and total (black) electron density, and (b): electric (red) and magnetic (blue) field energy divided by the jet kinetic energy at $t=3250~{}\omega_{\rm pe}^{-1}$. Panel (c) shows the evolution of the total electron density in time intervals of $\delta t=250~{}\omega_{\rm pe}^{-1}$. Diagonal lines indicate motion of the jet front (blue: $\lesssim c$), predicted contact discontinuity speed (green: $\sim 0.76~{}c$), and trailing density jump (red: $\sim 0.56~{}c$). Ambient particles become swept up after jet electrons pass $x/\Delta\sim 500$. By $t=3250~{}\omega_{\rm pe}^{-1}$, the density has evolved into a two-step plateau behind the jet front. The maximum density in this shocked region is about three times the initial ambient density. The jet-particle density remains nearly constant up to near the jet front. Current filaments and strong electromagnetic fields accompany growth of the Weibel instability in the trailing shock region. The electromagnetic fields are about four times larger than that seen previously using a much shorter grid system ($L_{\rm x}=640\Delta$). At $t=3250~{}\omega_{\rm pe}^{-1}$, the electromagnetic fields are largest at $x/\Delta\sim 1700$, and decline by about one order of magnitude beyond $x/\Delta=2300$ in the shocked region (Nishikawa 2006; Ramirez-Ruiz, Nishikawa & Hededal 2007). Figure 1c shows the total electron density plotted at time intervals of $\delta t=250~{}\omega_{\rm pe}^{-1}$. The jet front propagates with the initial jet speed ($\lesssim c$). Sharp RMHD-simulation shock surfaces are not created (e.g., Mizuno et al. 2009). A leading shock region (linear density increase) moves with a speed between the fastest moving jet particles $\lesssim c$ and a predicted contact discontinuity speed of $\sim 0.76~{}c$ (see §4). A contact-discontinuity region consisting of mixed ambient and jet particles moves at a speed between $\sim 0.76~{}c$ and the trailing density jump speed $\sim 0.56~{}c$. A trailing shock region moves with speed $\lesssim 0.56~{}c$, note the modest density increase just behind the large trailing density jump. Figure 2.— Phase-space distribution of jet (red) and ambient (blue) electrons at $t=3250~{}\omega_{\rm pe}^{-1}$. About 18,600 electrons of both species are selected randomly. Figure 2 shows the phase-space distribution of jet (red) and ambient (blue) electrons at $t=3250~{}\omega_{\rm pe}^{-1}$ and confirms our shock-structure interpretation. The electrons injected with $\gamma_{j}v_{\rm x}\sim 15$ become thermalized due to Weibel instabililty-induced interactions. The swept- up ambient electrons (blue) are heated by interaction with jet electrons. Some ambient electrons are strongly accelerated. Figure 3.— Velocity distributions at $t=3250~{}\omega_{\rm pe}^{-1}$. All jet (red) and all ambient (blue), and at $x/\Delta>2300$ jet (orange) and ambient (green) electrons are also plotted. The small (red) peak indicates jet electrons injected at $\gamma_{j}=15$. Figure 3 shows the velocity distribution of all jet and ambient electrons in the simulation frame. The small peak indicates electrons injected at $\gamma_{j}=15$. Jet electrons are accelerated to a non-thermal distribution. Ambient electrons are also accelerated to speeds above the jet injection velocity. The velocity distributions of jet and ambient electrons near the jet front (at $x/\Delta>2300$) are also plotted. The fastest jet electrons, $\gamma>20$, are located near the jet front. On the other hand, the fastest ambient electrons are located farther behind the jet front (at $x/\Delta<2300$). Thus, strong acceleration of the ambient electrons accompanies the strong fields associated with the Weibel instability. ## 4\. Discussion Our collisionless-shock structure can be compared to 1-D hydrodynamic (HD) shock predictions (e.g., Blandford & McKee 1976; Zhang & Kobayashi 2005). The speed of the contact discontinuity (CD) is given by ram pressure balance in the CD frame. Our initial conditions allow us to set the total energy density $e\equiv\rho c^{2}+p/(\Gamma-1)=\rho c^{2}$ and pressure $p=0$, so that the speed in the ambient frame becomes (Rosen et al. 1999) $\beta_{\rm cd}=[(\gamma_{\rm j}\eta^{1/2})/(\gamma_{\rm j}\eta^{1/2}+1)]\beta_{\rm j},$ (1) where $\eta\equiv\rho_{\rm j}/\rho_{\rm a}(=m_{\rm e}n_{\rm j}/m_{\rm e}n_{\rm a})$ and mass densities are determined in the “jet” and “ambient” proper frames. In the simulation $n_{\rm j}=0.0451n_{\rm a}$ and $\gamma_{\rm j}=15$, and $\beta_{\rm cd}=0.759$ ($\gamma_{\rm cd}=1.54$) is the predicted CD speed. Formally this should represent the average speed of particles in the CD region. The leading shock moves at a speed given by $\gamma_{\rm ls}^{2}={{(\gamma_{\rm cd}+1)[\Gamma_{\rm sa}(\gamma_{\rm cd}-1)+1]^{2}}\over{\Gamma_{\rm sa}(2-\Gamma_{\rm sa})(\gamma_{\rm cd}-1)+2}}$ (2) where $5/3>\Gamma_{\rm sa}>4/3$ is the shocked ambient adiabatic index. Thus the leading shock speed is predicted to be $0.865>\beta_{\rm ls}>0.783$ ($2>\gamma_{\rm ls}>1.6$) where upper and lower limits correspond to upper and lower limits of $\Gamma_{\rm sa}$, respectively. The jump condition at the leading shock is ${n_{\rm sa}\over n_{\rm a}}={\Gamma_{\rm sa}\gamma_{\rm cd}+1\over\Gamma_{\rm sa}-1},$ (3) where $n_{\rm sa}$ is the shocked ambient density in the proper (CD) frame and we find $5.34~{}n_{\rm a}<n_{\rm sa}<9.15~{}n_{a}$, where the lower and upper limits correspond to the upper and lower limits to $\Gamma_{\rm sa}$, respectively. Measured in the ambient (simulation) frame the shocked ambient density should be $8.2~{}n_{\rm a}<\gamma_{\rm cd}n_{\rm sa}<14.1~{}n_{\rm a}$. Formally this should represent the total density of particles in the shocked-ambient region. Computations associated with the trailing shock are most easily performed in the jet rest frame designated below as the “primed” frame. In this frame the CD moves with speed $\beta^{\prime}_{\rm cd}=-(\beta_{\rm j}-\beta_{\rm cd})/(1-\beta_{\rm j}\beta_{\rm cd})=-0.984$ and $\gamma^{\prime}_{\rm cd}=5.60$. The speed of the trailing shock in the jet frame, $\gamma^{\prime}_{\rm ts}$ is given by eq. (2) but with $\gamma_{\rm cd}\rightarrow\gamma^{\prime}_{\rm cd}$ and $\Gamma_{\rm sa}\rightarrow\Gamma_{\rm sj}$ where $\Gamma_{\rm sj}$ is the shocked-jet adiabatic index. In the jet frame $10.4>\gamma^{\prime}_{\rm ts}>7.4$ and $0.995>-\beta^{\prime}_{\rm ts}>0.991$, where upper and lower limits correspond to upper $\Gamma_{\rm sj}=5/3$ and lower $\Gamma_{\rm sj}=4/3$ limits to $\Gamma_{\rm sj}$, respectively. The trailing shock speed in the ambient (simulation) frame is $0.35<\beta_{\rm ts}=(\beta_{\rm j}-\beta^{\prime}_{\rm ts})/(1-\beta_{\rm j}\beta^{\prime}_{\rm ts})<0.61$ where the lower and upper limits correspond to the upper and lower limits of $\Gamma_{\rm sj}$, respectively. The density jump at the trailing shock is given by eq. (3) but with $\gamma_{\rm cd}\rightarrow\gamma^{\prime}_{\rm cd}$ and $\Gamma_{\rm sa}\rightarrow\Gamma_{\rm sj}$ where now $n_{\rm sa}/n_{a}\rightarrow n_{\rm sj}/n_{\rm j}$ where $n_{\rm j}=0.0451~{}n_{\rm a}$ with result that the proper density of shocked jet material is $0.70~{}n_{a}<n_{\rm sj}<1.15~{}n_{\rm a}$ where lower and upper limits correspond to upper and lower limits to $\Gamma_{\rm sj}$, respectively. In the ambient (simulation) frame the shocked jet density should be $1.08~{}n_{\rm a}<\gamma_{\rm cd}n_{\rm sj}<1.76~{}n_{\rm a}$. Formally this should represent the total density of particles in the shocked jet region. In the simulation the speed of the trailing density jump is $\sim 0.56~{}c$, which is in the predicted range $0.35<\beta_{\rm ts}<0.61$, a typical speed within the density-plateau region, $\sim 0.75~{}c$, is close to $\beta_{\rm cd}=0.76$. The poorly defined leading shock structure moves at a speed between $\sim 0.76~{}c$ and $\lesssim c$, consistent with the predicted $0.78<\beta_{\rm ls}<0.86$. In the simulation the maximum density increase observed in the ambient (simulation) frame is $\gamma_{\rm cd}n_{\rm sa}/n_{\rm a}\sim 3.5$ behind the leading shock (see Fig. 1a). This is about a factor of $\sim 3$ smaller than the predicted increase, $8.2<\gamma_{\rm cd}n_{\rm sa}/n_{\rm a}<14.1$, for a fully-developed leading shock. On the other hand, the density increase observed in the ambient (simulation) frame of $\gamma_{\rm cd}n_{\rm sj}/n_{\rm a}\gtrsim 1$ just before the trailing large density jump is comparable to that predicted, $1.08<\gamma_{\rm cd}n_{\rm sj}/n_{\rm a}<1.76$, for a fully developed trailing shock. Our present results can be compared to those found in the 2-D simulations of Chang et al. (2008) (see also Spitkovsky 2008a). Their simulations were performed in the CD frame, and material with proper density, n, moved into the contact discontinuity with a Lorentz factor $\gamma=15$. A shock moved away from the CD with the predicted speed $\beta_{\rm s}=(\Gamma_{\rm s}-1)\left[{\gamma-1\over\gamma+1}\right]^{1/2}=0.47~{},$ (4) and predicted density jump ${n_{\rm s}\over\gamma n}={1\over\gamma}{\Gamma_{\rm s}\gamma+1\over\Gamma_{\rm s}-1}=3.13~{},$ (5) for a shocked adiabatic index of $\Gamma_{\rm s}=3/2$. In our simulation we have two shocks that move away from the CD. For our leading shock, the ambient plasma moves relative to the CD at a speed equal to $\beta_{\rm cd}=0.759$ and $\gamma=\gamma_{\rm cd}=1.54$ in eqs. 4 & 5\. In the CD frame $\beta_{\rm s}=0.23$ and the observed density jump becomes $n_{\rm sa}/\gamma_{\rm cd}n_{a}=4.3$ for $\Gamma_{\rm s}=3/2$. So we see that our leading shock speed would be about 50% less than that in Chang et al. (2008) and our density increase would be about 50% larger for a fully- developed leading shock in the CD frame. For the trailing shock, the jet moves toward the CD at a speed equal to $-\beta^{\prime}_{\rm cd}=0.984$ and $\gamma=\gamma^{\prime}_{\rm cd}=5.60$ in eqs. 4 & 5\. In the CD frame $\beta_{\rm s}=0.417$ and the observed density increase becomes $n_{sj}/\gamma^{\prime}_{\rm cd}n_{j}=3.36$ for $\Gamma_{\rm s}=3/2$. So we see that our trailing shock speed would be about 11% less than that in Chang et al. (2008) and our density increase would be about 7% larger for the fully developed trailing shock in the CD frame. The parameters associated with our trailing shock are similar to those found in Chang et al. (2008), and the Weibel filamentation structures are comparable but now studied in full 3-D. ## 5\. Conclusion The present simulation finds for the first time a relativistic shock system comparable to a predicted relativistic HD shock system consisting of leading and trailing shocks separated by a contact discontinuity, albeit not yet fully developed. One remarkable aspect of this shock system lies in the generation of large electromagnetic fields, up to 30% of the kinetic energy density, associated with the trailing shock. Electromagnetic fields in the leading shock and contact-discontinuity region are over one order of magnitude lower. The large value for $\epsilon_{B}\sim 0.3$ in our trailing shock hints that Poynting-flux-dominated ejecta may not be required to explain some GRB observations (McMahon et al. 2006). Visualization of our dual shock system in the ambient (simulation) frame provides a picture of the shock structure that should exist at the head of a relativistic astrophysical jet, $\gamma_{\rm jt}=15$, that is less dense than the surrounding medium, $n_{\rm jt}/n_{\rm am}=0.045$. Within the AGN context, here we identify our trailing shock with the “jet” shock that decelerates the relativistic jet and we would expect synchrotron emission to originate from the strongly magnetized structure. Little synchrotron emission would originate from the weakly magnetized “bow” shock in front of the contact discontinuity. This in fact is what is observed at the leading edge of extra-galactic jets where synchrotron emission from the bow shock is not typically observed. Visualization of our dual shock system in the “jet” frame provides a picture of the shock structure that would accompany a relativistic blast wave driven by relativistic ejecta. Within the GRB context, here we identify the ambient medium as representing relativistic ejecta moving at $\gamma_{\rm ej}=15$ into a much less dense ISM, $n_{\rm ej}/n_{\rm ism}=22$. Our trailing shock is now identified with the “forward” shock and we would expect synchrotron emission from this strongly magnetized structure. Little synchrotron emission would originate from the low Lorentz factor, weakly-magnetized “reverse” shock moving back into the ejecta. Our present simulation involves an electron-positron jet and ambient medium. We might expect similar shock-structure development in electron-ion simulations, albeit on much longer temporal and spatial scales. This work is supported by AST-0506719, AST-0506666, NASA-NNG05GK73G, NNX07AJ88G, NNX08AG83G, NNX08AL39G, and NNX09AD16G. JN is supported by MNiSW research project N N203 393034, and The Foundation for Polish Science through the HOMING program, which is supported by a grant from Iceland, Liechtenstein, and Norway through the EEA Financial Mechanism. Simulations were performed at the Columbia facility at the NASA Advanced Supercomputing (NAS) and Cobalt at the National Center for Supercomputing Applications (NCSA) which is supported by the NSF. Part of this work was done while K.-I. N. was visiting The Observatoire de Paris, Meudon in summer of 2008. Support from the French Natural Science Research Council is gratefully acknowledged. ## References * Blandford & McKee (1976) Blandford, R.D. & McKee, C.F. 1976, Phys. Fluids, 19, 1130 * Buneman (1993) Buneman, O., 1993, Tristan, in Computer Space Plasma Physics: Simulation Techniques and Software, edited by H. Matsumoto Matsumoto & Y. Omura, p. 67, Terra Scientific Publishing Company, Tokyo * Chang, Spitkovsky, & Arons (2008) Chang, P., Spitkovsky, A., & Arons, J. 2008, ApJ, 674, 378 * Dieckmann, Shukla, & Drury (2008) Dieckmann, M.E., Shukla, P K. & Drury, L.O.C. 2008, ApJ, 675, 586 * Frederiksen et al. (2004) Frederiksen, J.T., Hededal, C.B., Haugbølle, T., & Nordlund, Å. 2004, ApJ, 608, L13 * Hededal & Nishikawa (2005) Hededal, C.B. and Nishikawa, K.-I. 2005, ApJ, 623, L89 * Jaroschek et al. (2005) Jaroschek, C.H., Lesch, H., & Treumann, R.A. 2005, ApJ, 618, 822 * Martins et al. (2009) Martins, S. F., Fonseca, R. A., Silva, L. O., & Mori, W. B. 2009, ApJL, in press * McMahon et al. (2006) McMahon, E., Kumar, P., & Piran, T. 2006, MNRAS, 366, 575 * Medvedev & Loeb (1999) Medvedev, M.V. & Loeb, A. 1999, ApJ, 526, 697 * Medvedev & Zakutnyaya (2009) Medvedev, M.V. & Zakutnyaya, O.V. 2009, ApJ, accepted, (arXiv:0812.1906) * Mizuno et al. (2009) Mizuno, Y., Zhang, B., Giacomazzo, B., Nishikawa, K.-I., Hardee, P., Nagataki, S., & Hartmann, D.H., 2009, ApJ, 690, 47L * Niemiec et al. (2008) Niemiec, J., Pohl, M., Stroman, T. & Nishikawa, K.-I. 2008, ApJ, 684, 1174 * Nishikawa et al. (2003) Nishikawa, K.-I., Hardee, P., Richardson, G., Preece, R., Sol, H., & Fishman, G.J. 2003, ApJ, 595, 555 * Nishikawa et al. (2005a) Nishikawa, K.-I., Hardee, P., Richardson, G., Preece, R., Sol, H., & Fishman, G.J. 2005, ApJ, 622, 927 * Nishikawa et al. (2006a) Nishikawa, K.-I., Hardee, P., Hededal, C.B., & Fishman, G.J. 2006, ApJ, 642, 1267 * Nishikawa et al. (2008d) Nishikawa, K. -I., Niemiec, J., Sol, H., Medvedev, M., Zhang, B., Nordlund, A., Frederiksen, J.T., Hardee, P., Mizuno, Y., Hartmann, D.H., & Fishman, G.J., 2008, AIPCS, submitted (arXiv:astro-ph/0809.5067) * Nishikawa et al. (2009) Nishikawa, K. -I., Medvedev, M., Zhang, B., Hardee, P., Niemiec, J., Nordlund, A., Frederiksen, J.T., Mizuno, Y., Sol, H., & Fishman, G.J., 2009, AIPCS, submitted (arXiv:astro-ph/0901.4058) * Ramirez et al. (2007) Ramirez-Ruiz, E., Nishikawa, K.-I., & Hededal, C.B., 2007, ApJ, 671, 1877 * Rosen et al. (1999) Rosen, A., Hughes, P.A., Duncan, G.C., Hardee, P.E., 1999, ApJ, 516, 729 * Silva et al. (2003) Silva, L.O., Fonseca, R.A., Tonge, J.W., Dawson, J.M., Mori, W.B., & Medvedev, M.V., 2003, ApJ, 596, L121 * Spitkovsky (2008a) Spitkovsky, A. 2008a, ApJ, 673, L39 * Spitkovsky (2008b) Spitkovsky, A. 2008b, ApJ, 682, L5 * Weibel (1959) Weibel, E.S. 1959, Phys. Rev. Lett., 2, 83 * Zhang and Kobayashi (2005) Zhang, B. & Kobayashi, S. 2005, ApJ, 628, 315
arxiv-papers
2009-04-01T08:45:28
2024-09-04T02:49:01.580553
{ "license": "Public Domain", "authors": "K.-I. Nishikawa, J. Niemiec, P.E. Hardee, M. Medvedev, H. Sol, Y.\n Mizuno, B. Zhang, M. Pohl, M. Oka, D. H. Hartmann", "submitter": "Ken-Ichi Nishikawa", "url": "https://arxiv.org/abs/0904.0096" }
0904.0130
# Morphological characterization of shocked porous material Aiguo Xu, Guangcai Zhang, X. F. Pan, Ping Zhang, and Jianshi Zhu National Key Laboratory of Computational Physics, Institute of Applied Physics and Computational Mathematics, P. O. Box 8009-26, Beijing 100088, P.R.China Xu_Aiguo@iapcm.ac.cn ###### Abstract Morphological measures are introduced to probe the complex procedure of shock wave reaction on porous material. They characterize the geometry and topology of the pixelized map of a state variable like the temperature. Relevance of them to thermodynamical properties of material is revealed and various experimental conditions are simulated. Numerical results indicate that, the shock wave reaction results in a complicated sequence of compressions and rarefactions in porous material. The increasing rate of the total fractional white area $A$ roughly gives the velocity $D$ of a compressive-wave-series. When a velocity $D$ is mentioned, the corresponding threshold contour-level of the state variable, like the temperature, should also be stated. When the threshold contour-level increases, $D$ becomes smaller. The area $A$ increases parabolically with time $t$ during the initial period. The $A(t)$ curve goes back to be linear in the following three cases: (i) when the porosity $\delta$ approaches 1, (ii) when the initial shock becomes stronger, (iii) when the contour-level approaches the minimum value of the state variable. The area with high-temperature may continue to increase even after the early compressive-waves have arrived at the downstream free surface and some rarefactive-waves have come back into the target body. In the case of energetic material needing a higher temperature for initiation, a higher porosity is preferred and the material may be initiated after the precursory compressive-waves have scanned all the target body. One may desire the fabrication of a porous body and choose appropriate shock strength according to what needed is scattered or connected hot-spots. With the Minkowski measures, the dependence on experimental conditions is reflected simply by a few coefficients. They may be used as order parameters to classify the maps of physical variables in a similar way like thermodynamic phase transitions. ††: J. Phys. D: Appl. Phys. ## 1 Introduction A porous material contains voids or tunnels of different shapes and sizes. Such materials are commonly found in nature and as industrial materials such as wood, carbon, foams, ceramics, bricks, metals and explosives. They have also been used in surgical implant design to fabricate devices to replace or augment soft and hard tissues, etc. In order to use them effectively, their mechanical and thermodynamical properties must be understood in relation to their mesoscopic structures[1, 2]. In this work we focus on porous materials under shock wave reaction. When a porous material is shocked, the cavities inside the sample may result in jets and influence its back velocity[3]. Cavity nucleation due to tension waves controls the spallation behavior of the material[4]. Cavity collapse plays a prominent role in the initiation of energetic reactions in explosives[5]. In this side, most of previous studies concerned the Hugoniots[6, 7, 8, 9, 10, 11, 12, 13] and the equation of state[14, 15, 16]. It is known that, under strong shocks, the porous material is globally in a nonequilibrium state and show complex dissipative structures. How to describe and pick up information from such a system is still an open problem. In this work we introduce the Minkowski functionals to measure the morphological behaviors of the map of state variable and use them to probe the procedure of shock wave reaction on porous material. This study needs also a powerful simulation tool. The molecular dynamics can discover some atomistic mechanisms of shock-induced void collapse[17, 18], but the spatial and temporal scales it may cover are far from those comparable with experiments. To overcome this scale limitation, we resort to a newly developed mesoscopic particle method, the material-point method(MPM)[19, 20, 21, 22, 23, 24]. The MPM was originally introduced in fluid dynamics by Harlow, et al[19] and extended to solid mechanics by Burgess, et al[20], then developed by various researchers, including us[25, 26, 27]. The other reason for using the MPM is related to the severe difficulties of the traditional Eulerian and Lagrangian methods in treating with shocked porous materials. The material under investigation is generally highly distorted during the collapsing of cavities. The Eulerian description is not convenient for tracking interfaces. When the Lagrangian formulation is used, the original element mesh becomes distorted so significantly that the mesh has to be re- zoned to restore proper shapes of elements. The state fields of mass density, velocities and stresses must be mapped from the distorted mesh to the newly generated one. This mapping procedure is not a straightforward task, and introduces errors. The MPM not only takes advantages of both the Lagrangian and Eulerian algorithms but makes it possible to avoid their drawbacks as well. At each time step, calculations consist of two parts: a Lagrangian part and a convective one. Firstly, the computational mesh deforms with the body, and is used to determine the strain increment, and the stresses in the sequel. Then, the new position of the computational mesh is chosen (particularly, it may be the previous one), and the velocity field is mapped from the particles to the mesh nodes. Nodal velocities are determined using the equivalence of momentum calculated for the particles and for the computational grid. The following part of the paper is planned as follows. Section 2 briefly reviews the Minkowski descriptions. Section 3 presents the theoretical model of the material under consideration. Simulation results are shown and analyzed in section 4. Section 5 makes the conclusion. ## 2 Brief review of morphological characterization A variety of techniques can be used to describe the complex spatial distribution and time evolution of state variables in the shocked porous material. In this study we concentrate on the set of statistics known as Minkowski functionals[28]. A general theorem of integral geometry states that all properties of a $d$-dimensional convex set (or more generally, a finite union of convex sets) which satisfy translational invariance and additivity (called morphological properties) are contained in $d+1$ numerical values [29]. For a pixelized map $\psi(\mathbf{x})$, we consider the excursion sets of the map, defined as the set of all map pixels with value of $\psi$ greater than some threshold $\psi_{th}$ (see, e.g., Refs. [30, 31]), where $\mathbf{x}$ is the position, $\psi$ can be a state variable like temperature $T$, density $\rho$ or pressure $P$; $\psi$ can also be the velocity $\mathbf{v}$ or its components, some specific stress, etc. Then the $d+1$ functionals of these excursion sets completely describe the morphological properties of the underlying map $\psi(\mathbf{x})$. In the case of two or three dimensions, the Minkowski functionals have intuitive geometric interpretations. For a two-dimensional map, the three Minkowski functionals correspond geometrically to the total fractional area $A$ of the excursion set, the boundary length $L$ of the excursion set per unit area, and the Euler characteristic $\chi$ per unit area (equivalent to the topological genus). Such a description has been successfully used to describe patterns in reaction-diffusion system[32], the cosmic microwave background temperature fluctuations[33], and patterns in phase separation of complex fluids[34, 35, 36, 37], etc. In this work we probe the shocked porous material via checking the temperature map $T(\mathbf{x},t)$, where the time $t$ is explicitly denoted. The maps of other physical variables can be analyzed in a similar way. When the temperature $T(\mathbf{x})$ is beyond the threshold value $T_{th}$, the grid node at position $\mathbf{x}$ is regarded as a white (or hot) vertex, else it is regarded as a black (or cold) one. For the square lattice, a pixel possesses four vertices. A region with connected white (hot) or black (cold) pixels is defined as a white (hot) or black (cold) domain. Two neighboring white and black domains present a clear interface or boundary. When we increase the threshold contour-level $T_{th}$ from the lowest temperature to the highest one in the system, the white area $A$ will decrease from $1$ to $0$; the boundary length $L$ first increases from $0$, then arrives at a maximum value, finally decreases to $0$ again. There are several ways to define the Euler characteristic $\chi$. Two simplest ones are $\chi=N_{W}-N_{B}\mathtt{,}$ (1) or $\chi=\frac{N_{W}-N_{B}}{N}\mathtt{,}$ (2) where $N_{W}$ ($N_{B}$) is the number of connected white (black) domains, $N$ is the total number of pixels. The only difference of the two definitions is that the first keeps $\chi$ an integer. In contrast to the white area $A$ and boundary length $L$, the Euler characteristic $\chi$ describes the connectivity of the domains in the lattice. It describes the pattern in a purely topological way, i.e., without referring to any kind of metric. It is negative (positive) if many disconnected black (white) regions dominate the image. A vanishing Euler characteristic indicates a highly connected structure with equal amount of black and white domains. Specifically, for the definition (1), the integer $\chi$ equals $-1$ when one has a black drop in a large white lattice, and $+1$ vice versa, since the surrounding white (black) region does conventionally not count. In this paper, we use the second definition without making any ambiguity. The ratio $\kappa=\frac{N_{W}-N_{B}}{NL}$ (3) describes the mean curvature of the boundary line separating black and white domains. Despite having global meaning, the Euler characteristic $\chi$ can be calculated in a local way using the additivity relation[32]. Figure 1: (in JPG format) Configurations with temperature contours. $\delta=2$ and $v_{init}=1000$m/s. From left to right, t=500ns, 1500ns, 2000ns, and 2500ns, respectively. The length unit here is 10 $\mu$m. Figure 2: (Color online) Minkowski measures for the procedure shown in Fig.1. The contour levels of the temperature increment are shown in the legend. ## 3 Theoretical model of the material In this study the material is assumed to follow an associative von Mises plasticity model with linear kinematic and isotropic hardening[38]. Introducing a linear isotropic elastic relation, the volumetric plastic strain is zero, leading to a deviatoric-volumetric decoupling. So, it is convenient to split the stress and strain tensors, $\boldsymbol{\sigma}$ and $\boldsymbol{\varepsilon}$, as $\displaystyle\boldsymbol{\sigma}$ $\displaystyle=$ $\displaystyle\mathbf{s}-P\mathbf{I},P=-\frac{1}{3}\verb|Tr|(\boldsymbol{\sigma})\mathtt{,}$ (4) $\displaystyle\boldsymbol{\varepsilon}$ $\displaystyle=$ $\displaystyle\mathbf{e}+\frac{1}{3}\theta\mathbf{I},\theta=\frac{1}{3}\verb|Tr|(\boldsymbol{\varepsilon})\mathtt{,}$ (5) where $P$ is the pressure scalar, $\mathbf{s}$ the deviatoric stress tensor, and $\mathbf{e}$ the deviatoric strain. The strain $\mathbf{e}$ is generally decomposed as $\mathbf{e}=\mathbf{e}^{e}+\mathbf{e}^{p}$, where $\mathbf{e}^{e}$ and $\mathbf{e}^{p}$ are the traceless elastic and plastic components, respectively. The material shows a linear elastic response until the von Mises yield criterion, $\sqrt{\frac{3}{2}}\left\|\mathbf{s}\right\|=\sigma_{Y}\mathtt{,}$ (6) is reached, where $\sigma_{Y}$ is the plastic yield stress. The yield $\sigma_{Y}$ increases linearly with the second invariant of the plastic strain tensor $\mathbf{e}^{p}$, i.e., $\sigma_{Y}=\sigma_{Y0}+E_{\tan}\left\|\mathbf{e}^{p}\right\|\mathtt{,}$ (7) where $\sigma_{Y0}$ is the initial yield stress and $E_{\tan}$ the tangential module. The deviatoric stress $\mathbf{s}$ is calculated by $\mathbf{s}=\frac{E}{1+\nu}\mathbf{e}^{e}\mathtt{,}$ (8) where $E$ is the Yang’s module and $\nu$ the Poisson’s ratio. Denote the initial material density and sound speed by $\rho_{0}$ and $c_{0}$, respectively. The shock speed $U_{s}$ and the particle speed $U_{p}$ after the shock follows a linear relation, $U_{s}=c_{0}+\lambda U_{p}$, where $\lambda$ is a characteristic coefficient of material. The pressure $P$ is calculated by using the Mie-Grüneissen state of equation which can be written as $P-P_{H}=\frac{\gamma(V)}{V}[E-E_{H}(V_{H})]$ (9) In Eq.(9), $P_{H}$, $V_{H}$ and $E_{H}$ are pressure, specific volume and energy on the Rankine-Hugoniot curve, respectively. The relation between $P_{H}$ and $V_{H}$ can be estimated by experiment and can be written as $P_{H}=\left\\{\begin{array}[]{ll}\frac{\rho_{0}c_{0}^{2}(1-\frac{V_{H}}{V_{0}})}{(\lambda-1)^{2}(\frac{\lambda}{\lambda-1}\times\frac{V_{H}}{V_{0}}-1)^{2}},&V_{H}\leq V_{0}\\\ \rho_{0}c_{0}^{2}(\frac{V_{H}}{V_{0}}-1),&V_{H}>V_{0}\end{array}\right.$ (10) In this paper, the transformation of specific internal energy $E-E_{H}(V_{H})$ is taken as the plastic energy. Both the shock compression and the plastic work cause the increasing of temperature. The increasing of temperature from shock compression can be calculated as: $\frac{\mathrm{d}T_{H}}{\mathrm{d}V_{H}}=\frac{c_{0}^{2}\cdot\lambda(V_{0}-V_{H})^{2}}{c_{v}\big{[}(\lambda-1)V_{0}-\lambda V_{H}\big{]}^{3}}-\frac{\gamma(V)}{V_{H}}T_{H}.$ (11) where $c_{v}$ is the specific heat. Eq.(11) can be derived from thermal equation and the Mie-Grüneissen state of equation[39]. The increasing of temperature from plastic work can be calculated as: $\mathrm{d}T_{p}=\frac{\mathrm{d}W_{p}}{c_{v}}$ (12) Both the Eq.(11) and the Eq.(12) can be written as the form of increment. In this paper we choose aluminum as the sample material. The corresponding parameters are $\rho_{0}=2700$ kg/m3, $E=69$ Mpa, $\nu=0.33$, $\sigma_{Y0}=120$ Mpa, $E_{\tan}=384$ MPa, $c_{0}=5.35$ km/s, $\lambda=1.34$, $c_{v}=880$ J/(Kg$\cdot$K), $k=237$ W/(m$\cdot$K) and $\gamma_{0}=1.96$ when the pressure is below $270$ GPa. The initial temperature of the material is 300 K. Figure 3: (in JPG format) Configurations with temperature contours. $\delta=1.4$ and $v_{init}=1000$m/s. From left to right, t=500ns, 1100ns, 1400ns, and 1700ns, respectively. The length unit here is 10 $\mu$m. Figure 4: (Color online) Minkowski measures for cases with various porosities. $T_{th}=400$K. The values of porosity are shown in the legend. Figure 5: (Color online) Minkowski measures for cases with various porosities. $T_{th}$=500K. The values of porosity are shown in the legend. Figure 6: (Color online) Minkowski measures for cases with various porosities. $T_{th}$=600K. The values of porosity are shown in the legend. ## 4 Simulation results and physical interpretation In our numerical experiments the porous material is fabricated by a solid material body with an amount of voids randomly embedded. We denote the mean density of the porous body as $\rho$ and the density of the solid portion as $\rho_{0}$. The porosity is defined as $\delta=\rho_{0}/\rho$. The present work concentrates on two-dimensional case and the porosity $\delta$ is controlled by the total number $N_{void}$ and mean size $r_{void}$ of voids embedded. The shock wave reacting on the target porous body is loaded via a colliding by a rigid wall with the same material. We choose the coordinate system where the rigid wall is horizontal and keeps static at the position $y=0$, the target porous body is on the upper side of the rigid wall and moves towards the rigid wall at a velocity $-v_{init}$. The porous body begins to touch the rigid wall at the time $t=0$. The simulated porous body is initially 1 mm in width and 5 mm in height, as shown in Fig. 1. Periodic boundary conditions are set in the horizontal directions, which means the real system under consideration is composed of many of the simulated ones aligned periodically in the horizontal direction. Figure 7: (in JPG format) Configurations with temperature contours. $\delta=1.4$ and $v_{init}=500$m/s. From left to right, t = 500 ns, 1500 ns, 2000 ns, and 2500 ns, respectively. The length unit here is 10 $\mu$m. Figure 8: (Color online) Minkowski measures for the case of $\delta=1.4$ and $v_{init}=500$m/s. The values of contour level are shown in the legend. Figure 9: (Color online) Minkowski measures for the case of $\delta=1.4$ and $v_{init}=400$m/s. The values of contour level are shown in the legend. Figure 10: (Color online) Minkowski measures for the case of $\delta=1.4$ and $v_{init}=300$m/s. The values of contour level are shown in the legend. ### 4.1 Case with $\delta=2$ and $v_{init}=1000$m/s Figure 1 shows a set of snapshots for a procedure that a shock wave is reacting on a porous body, where the contours denote temperature. From blue to red, the temperature increases. The porosity $\delta=2$, $v_{init}=1000$m/s. The time t=500ns, 1500ns, 2000ns, 2500ns for the four snapshots from left to right. It is clear that, different from the case with uniform material, the original shock wave is scattered and dispersive in the porous body. The first two snapshots show the loading procedure. When $t=500$ ns, the early compressive waves arrive at about $y=1$ mm; when $t=1500$ ns, they arrive at about $y=3.1$ mm. The last two snapshots show the procedure of downloading. When compressive waves arrive at the upper free surface, rarefactive waves are reflected back into the target porous body. Under the tension wave, the height of the porous body increases with time. In fact, before the compressive waves arrive at the upper free surface, a large number of local downloading phenomena have occurred within the porous body. When the initial shock wave or a compressive wave encounters a void, rarefactive waves are reflected back and propagate within the compressed portion, which destroys the original possible equilibrium state there. Since the details of wave series are very complex, when we mention the value of a state variable, for example the density, we refer to its local mean value. To perform the Minkowski functional analysis for the temperature map, we can choose a threshold temperature $T_{th}$ and pixelize the map into white regions (with $T\geq T_{th}$) and black regions (with $T<T_{th}$ ). Figure 2 shows the Minkowski measures for the same procedure as in Fig.1. “$DT$ ” in the legend means $T_{th}-300$. The unit of temperature is K. The time unit is ns. When $DT$ is very small, the wave front is nearly a plane, which is similar to the case with shock reacting on uniform solid material. When $DT=10$K, the total fractional white area $A$ increases up to be nearly $1$ at the time $t=1600$ ns and keeps this value until the time $t=2600$ns, then has a slight decreasing. This means the early compressive wave arrives at the upper free surface at about, in fact before, the time $t=1600$ ns, nearly all material particles in the target body have a temperature beyond $310$ K during the following $1000$ns. In the downloading procedure the rarefactive waves make a very small fraction of material particles decrease their temperature to below $310$ K. With the increase of $DT$, the white area $A$ decreases. For the case with $DT=100$ K, when $t=1900$ ns, the white area arrives at a steady value $0.96$, which means $4\%$ of the material particles could not get a temperature higher than $400$ K in the whole procedure shown here. Compared with the case of $DT=10$K, we can get another piece of information, the temperature increase in shocked portion of porous material is much slower than in shocked uniform solid material. We can find the physical reason for this by considering the void effects in shocked porous body. When the compressive wave arrives at a void, it is decomposed of many components. The components in the solid portion move forwards more quickly, while the portion facing the void may result in jet phenomenon. When jetted material hit the downstream wall of the void, new compressive waves are created. At the same time, the void reflects rarefactive wave back to the compressed region. A large number of similar processes exist in the shocked porous system. Thus, the shock loading procedure in the porous body is manifested as successive reactions of many compressive and rarefactive waves. In the shock-loading procedure, the compressive waves dominate. Each plastic deformation makes a temperature increment. The curve for the case of $DT=200$ K can be interpreted in a similar way. When $DT$ increases from $200$K to $300$K, the curve of white area has a significant variation. For the case of $DT=400$K, the white area arrives at $0.2$ at the time $t=3000$ns, which means $80\%$ of material particles could not get a temperature higher than $700$ K up to this time. When $DT=500$K, the white area keeps nearly zero during the whole procedure shown here, which means no local temperature is higher than $800$K in the system up to the time $t=3000$ns. For cases with $DT=300$K, $330$K, $360$K and $400$K, after the initial slow increasing period, the white (hot) area has a quick increasing period. The latter indicates that a large amount of “hot- spots” in the previously compressed region coalesced during that period. After that the increasing of $A$ with $t$ shows a slowing-down. The slope of the $A(t)$ curve approximately corresponds to the mean propagation speed of some components of the compressive waves. Therefore, the first Minkowski measure indicates that, in porous material, when a velocity $D$ of the compressive- wave-series mentioned, the corresponding contour-level of a state variable like temperature should also be stated. From this figure, it is clear that $D(T_{th})$ decreases with the increasing of $T_{th}$; The total fractional white (hot) area $A(t)$ shows a parabolic behavior during the initial period; When $DT$ approaches $0$, $A(t)$ behavior goes back to be linear. Now we go to the second Minkowski measure, the boundary length $L$. To understand this measure, we can consider the three-dimensional plot of $T(x,y)$ as a mountain. In the case where the mountain has only one peak, when we increase the contour level $T_{th}$, the white area $A$ decreases, and the boundary length $L$ decreases, too. But in the case where the mountain has more than one peaks, the situation will not be so simple: the white area $A$ may decrease while the boundary length $L$ increases. For the case of $DT=10$K, after the initial increase corresponding to the getting contact of the target body with the rigid wall, the boundary length $L$ keeps a small constant for a long time until about $t=2600$ns. The fact that the boundary length $L$ keeps constant while the white area $A$ increase means also that the compressive wave is propagating towards the upper free surface and the wave front is nearly a plane in the pixelized temperature map. The increasing of boundary length $L$ after the time $t=2600$ns is companying with the decreasing of white area $A$, which means some small black (cold) spots occur. The curves for $DT=100$ K and $DT=200$K show similar information. They first increase with time due to the appearance of more “hot-spots”, then decreases due to the coalesce of “hot-spot”, finally increase, companied by the slight decrease of the total fractional white area $A$. When $DT=300$K, during the period with $1500$ns $<t<2500$ns, the white area $A$ increases, while the total fractional boundary length $L$ is nearly a constant. Considering that the wave front has not been a plane any more for this threshold temperature, this result indicates the following information: during this period, the compressive waves propagate forwards, more scattered “hot-spots” appeare in the newly compressed region; at the same time, some previous scattered “hot- spots” coalesce. From $2500$ns to $3000$ns, the white area $A$ increases very slowly, but the boundary length $L$ decreases quickly. This result show that the increasing of white area $A$ is mainly due to coalesce of previous scattered “hot-spots”. The curves for $DT=330$K and $DT=360$K can be understood in the similar way. For the present shock strength, only very few material particles can get a temperature beyond $700K$ before the time $t=2000$ns. Therefore, the boundary length $L$ for the case with $DT=400$K has a meaningful increase only after $t=2000$ns. When $DT$ is small, $T>T_{th}$ in (nearly) all of the compressed portion and $T<T_{th}$ in the uncompressed part of the material body. The temperature map shows a highly connected structure with (nearly) equal and very small amount of black and white domains. So, the Euler characteristic $\chi$ keeps close to zero in the whole shock-loading procedure and the mean curvature $\kappa$ is nearly zero. The value of $\chi$ decreases to be evidently less than zero in the downloading procedure, which indicates that the number of domains with $T<T_{th}$ increases. (See the $\chi(t)$ curves for cases with $DT=10$, $DT=100$ and $DT=200$ in Fig.2.) With the increasing of the contour level $T_{th}$, more regions changes their color from white ($T>T_{th}$) to black ($T<T_{th}$). The pattern evolution in the shock-loading procedure can be regarded as that scattered white domains appear gradually with time in the black background. So the Euler characteristic $\chi$ is positive and increasing with time. (See the $\chi(t)$ curves for cases with $DT=300$, $DT=330$ and $DT=360$ in Fig.2.) When the contour level $T_{th}$ is further increased up to $700$K, a meaningful fraction of material particles could not get a temperature higher than the contour level $T_{th}$. The saturation phenomenon in the $\chi$ curve during the period, $550$ns $<t<2100$ ns, indicates that the numbers of connected “hot” and “cold” domains vary with time in a similar way. The increase of $\chi$ in the period, $2100$ns $<t<2500$ns, is due to that the rarefactive waves make mean-temperature decrease, correspondingly, some connected “hot-domains” are disconnected as scattered “hot-spots” again. For the case of $DT=500$K, the pixelized temperature map is nearly in black. So, the Euler characterization $\chi$ is nearly zero. ### 4.2 Effects of porosity Figure 3 shows a set of snapshots for the case with a lower porosity, $\delta=1.4$. The other conditions are the same as in Fig.1. From left to right, the four configurations correspond to the times, $t=500$ns, $1100$ns, $1400$ns and $1700$ns. Compared with the snapshots in Fig.1, it is clear that the propagation velocity of compressive wave increases with the decreasing of porosity. At time $t=500$ns, in the system with $\delta=1.4$, the compressive wave arrives at about $y=1750\mu$m; while in the system with $\delta=2$, the compressive wave only arrives at about $y=1000\mu$m. In the case of $\delta=1.4$, the compressive wave has arrived the top free surface and the rarefactive wave has been reflected back to the target body before the time $t=1400$ns; while in the case of $\delta=2$, the shock-loading procedure has not been finished up to $t=1500$ns. Figure 4 shows the Minkowski measures for cases with various porosities, where $T_{th}=400$K and the values of porosity, $\delta=2.45$, $2$, $1.7$, $1.4$, $1.22$, $1.15$, $1.1$ are shown in the legend. In the subfigure for white area $A$, the initial shock-loading part presents meaningful information: the velocity $D$ of the compressive-wave-series is smaller for a higher porosity $\delta$. The most significant property in the subfigure for boundary length $L$ is that the largest boundary length $L_{max}$ increases as $\delta$ decreases. When $\delta=1.1$, the total boundary length $L$ gets the maximum value at about $t=1250$ns. This result indicates that the highest temperature in shocked porous material decreases when the porosity approaches $1$. The Euler characteristic $\chi$ becomes more negative when the porosity $\delta$ decreases from $2.45$ to $1.1$, which means the disconnected “cold” domains with $T<400$K dominate more the image. Figures 5 and 6 show the Minkowski measures for the same porosities but higher temperature thresholds, $T_{th}=500$K and $T_{th}=600$K. They present supplementary information to Fig. 4. For cases with $\delta=1.4$, $1.22$, $1.15$ and $1.1$, only $88\%$, $55\%$, $36\%$ and $15\%$ of the material particles get the temperature higher than $500$K. For cases with $\delta=1.4$ and $1.22$, and only $16\%$ and $6\%$ get the temperature higher than $600$K in the shock-loading procedure. When $T_{th}=500$K, the case with $\delta=1.15$ has the maximum boundary length and the case with $\delta=1.1$ has the maximum Euler characteristic. When $T_{th}=600$K, the case with $\delta=1.4$ has the maximum boundary length and maximum Euler characteristic, which means the “hot-spots” with $T>600$K are scatteredly distributed in the “cold” background with $T<600$K. ### 4.3 Effects of initial shock-wave-strength Figure 11: (Color online) Minkowski measures for cases with various shock strengths. $\delta=1.4$. The values of initial impacting speed $v_{init}$ are shown in the legend. We now study the effects of different initial impacting speeds. Figure 7 shows a set of snapshots for the case with $\delta=1.4$ and $v_{init}=500$m/s. From left to right, the four configurations are for the times $t=500$ns, $1500$ns, $2000$ns and $2500$ns. From the first two, we observe the upward propagation of compressive wave in the target body. From the last two, we observe the downward rarefactive effects. Compared with Fig.3, it is clear that the velocity $D$ of compressive-wave-series and the highest temperature $T_{\max}$ decreased. The Minkowski meansures for this procedure is shown in Fig. 8. Such a shocking procedure could not produce “hot-spot” with $T=500$K. High- temperature “Hot-area” continue to increase even after some precursory compressive waves have scanned all the target body and some rarefactive waves have come into the target body from the upper free surface. Up to the time $t=3000$ns, the fractional area of “Hot-spots” with $T>400$K reaches $40\%$, the fractional area for $T>380$K reaches $74\%$, that for $T>360$K reaches $91\%$. The contour-level with $T=380K$ has the largest boundary length at about $t=1500$ns when the “hot-spots” mainly distribute scatteredly in the “cold” background. Figures 9 and 10 show the Minkowski measures for cases with the same porosity but lower initial impacting speeds. $v_{init}=400$m/s in Fig.9 and $v_{init}=300$m/s in Fig.10. With the decrease of initial impact speed, the highest temperature $T_{\max}$ in the system further decreases; the total fractional white area $A$ for low contour-level, for example $DT=10$K, increases with time in a more linear way. We compare Minkowski measures for different initial impacting speeds in Fig. 11, where $\delta=1.4$, $DT=50$K, $v_{init}=1000$ms, $500$m/s, $400$m/s, $300$m/s, and $200$m/s. It is clear that the higher the initial impacting speed, the closer to be linear the $A(t)$ curve. The case of $v_{init}=400$m/s has the longest total boundary separating the “hot” and “cold” domains. For this case, disconnected “hot” regions dominate the image from the topology side in the shock-loading procedure; disconnected “cold” regions dominate in the downloading procedure. ## 5 Conclusions Under shock wave reaction, the porous material is globally in a nonequilibrium state and shows complex dissipative structures. We pixelize the map of temperature into Turing patterns and introduce morphological measures for it. Relevance of the total fractional white area $A$, boundary length $L$ and the Euler characteristic $\chi$ to the thermodynamical properties of material is revealed. Various experimental conditions are simulated via the material-point method. Numerical results indicate that, the shock wave reaction results in a complicated sequence of compressions and rarefactions in porous material. The increasing rate of $A$ roughly gives the velocity $D$ of a compressive-wave- series. When a velocity $D$ is mentioned, the corresponding threshold contour- level of the temperature should also be stated. When the threshold contour- level increases, $D$ becomes smaller. The area $A$ increases parabolically with time $t$ during the initial period. The $A(t)$ curve goes back to be linear in the following three cases: (i) when the porosity $\delta$ approaches 1, (ii) when the initial shock becomes stronger, (iii) when the contour-level approaches the minimum value of the temperature. The area with high- temperature may continue to increase even after the early compressive-waves have arrived at the downstream free surface and some rarefactive-waves have come back into the target body. In the case of energetic material needing a higher temperature for initiation, a higher porosity is preferred and the material may be initiated after the precursory compressive-waves have scanned all the target body. One may desire the fabrication of a porous body and choose the appropriate shock strength according to what needed is scattered or connected hot-spots. The same measures can also be used to analyze the maps of other physical variables, like the density, velocity, or various stresses. With the Minkowski measures, the dependence on experimental conditions is reflected simply by a few coefficients. They may be used as order parameters to classify the maps of state variable in a similar way like thermodynamic phase transitions. We warmly thank Jianguo Wang, Hua Li, Yangjun Ying for helpful discussions on shock waves and porous material. A.Xu is grateful to Drs. G. Gonnella and A. Lamura for constructive discussions on Minkowski functionals. This work is supported by Science Foundations of LCP and CAEP, national Science Foundation of China (under Grant Nos. 10702010,10775018 and 10604010). ## References ## References * [1] M. Lundberg, B. Skårman, F. Cesar, L. R. Wallenberg, Microporous and Mesoporous Materials, 54 97 (2002). * [2] G. Lu, G.Q.M. Lu, and Z.M. Xiao, J. Porous Materials 6, 359 (1999). * [3] D.B.Reisman, W.G.Wolfer, A. Elsholz, and M.D. Furnish, J. Appl. Phys. 93, 8952 (2003). * [4] E. Dekel, S. Eliezer, Z. Henis, E. Moshe, A. Ludmirsky, and I. B. Goldberg, J. Appl. Phys. 84, 4851 (1998); R. W. Minich, J. U. Cazamias, M. Kumar, and A. J. Schwartz, Metall. Mater. Trans. A 35, 2663 (2004). * [5] N. K. Bourne, Shock Waves 11, 447 (2002). * [6] R. K. Linde and D. N. Schmidt, J. Appl. Phys. 37, 3259 (1966). * [7] R. R. Boade, J. Appl. Phys. 40, 3781 (1969). * [8] B. M. Butcher, J. Appl. Phys. 45, 3864 (1974). * [9] S. Bonnan, P. L. Hereil, and F. Collombet, J. Appl. Phys. 83, 5741 (1998). * [10] G. T. Gray III, N. K. Bourne and J. C. F. Milett, J. Appl. Phys. 94, 6430 (2003). * [11] A. D. Resnyansky, N. K. Bourne, J. Appl. Phys. 95, 1760 (2004). * [12] D. J. Pastine, M. Lombardi, A. Chatterjee and W. Tchen, J. Appl. Phys. 41, 3144 (1970). * [13] L. Boshoff-Mostert and H. J. Viljoen, J. Appl. Phys. 86, 1245 (1999). * [14] Q. Wu and F. Jing, Appl. Phys. Lett. 67, 49 (1995). * [15] Q. Wu and F. Jing, J. Appl. Phys. 80, 4343 (1996). * [16] H. Geng, Q. Wu, H. Tan, L. Cai and F. Jing, J. Appl. Phys. 92, 5924 (2002). * [17] P. Erhart, E. M. Bringa, M. Kumar, and K. Albe, Phys. Rev. B 72, 052104 (2005). * [18] Q. Yang, Guangcai Zhang, Aiguo Xu, Y. Zhao, Y. Li, Acta Phys. Sini. 57, 940 (2008) (in Chinese). * [19] F. H. Harlow, 1964 Methods for Computational Physics, Vol. 3, 319-343, Adler B, Fernbach S, Rotenberg M (eds). Academic Press: New York . * [20] D. Burgess, D. Sulsky, J. U. Brackbill, J. Comput. Phys. 103, 1 (1992). * [21] S. Bardenhagen, J. Brackbill, and D. Sulsky, Comput. Methods Appl. Mech. Eng. 187, 529 (2000). * [22] Y. J. Guo and J.A. Nairn, Computer Modeling in Engineering & Sciences 1, 11 (2006). * [23] N. P. Daphalapurkar, H Lu, D. Coker, R. Komanduri, Int. J. Fract. 143, 79 (2007). * [24] S. Ma, X. Zhang, X.M. Qiu, Int. J. Impact Eng. 36 272 (2009). * [25] Aiguo Xu, X F Pan, Guangcai Zhang and Jianshi Zhu, J. Phys.: Condens. Matter 19, 326212(2007). * [26] X. F. Pan, Aiguo Xu, Guangcai Zhang, et al, Commun. Theor. Phys. 49, 1129 (2008). * [27] X. F. Pan, AiguoXu ,Guangcai Zhang and Jianshi Zhu, J. Phys. D: Appl. Phys. 41, 015401 (2008). * [28] H. Minkowski, Mathematische Annalen, 57 447(1903). * [29] H. Hadwiger, Abh. Math. Sem. Univ. Hamburg 20, 136 (1956); Math. Z. 71, 124 (1959). * [30] D. H. Weinberg, J. R. Gott, A. L. Melott, Astrophys. J, 321, 2 (1987). * [31] A. L. Melott, Phys. Rep., 193, 1 (1990). * [32] K. R. Mecke, Phys. Rev. E 53, 4794 (1996). * [33] S. Winitzki and A. Kosowsky, arXiv: astro-ph/9710164v1. * [34] A. Aksimentiev, K. Moorthi, R. Holyst, J. Chem. Phys. 112, 1 (2000). * [35] K. R. Mecke and V. Sofonea, Phys. Rev. E 56, R3761 (1997). * [36] Aiguo Xu, G. Gonnella and A. Lamura, Phys. Rev. E 67, 056105(2003); Phys. Rev. E 74, 011505(2006); Physica A 331, 10 (2004); Physica A 344, 750 (2004); Physica A 362, 42 (2006); Aiguo Xu, G. Gonnella, A. Lamura, G. Amati and F. Massaioli, Europhys. Lett., 71, 651 (2005). * [37] W. T. Góźdź and R. Holyst, Phys. Rev. E 54, 5012 (1996); Phys. Rev. Lett. 76, 2726 (1996). * [38] F. Auricchio, L. B. da Veiga, Int. J. Numer. Meth. Engng 56 1375 (2003). * [39] B. Zhang, et al. Explosion physics, Ordance Industry Press of China, 1997 Beijing.
arxiv-papers
2009-04-01T11:34:23
2024-09-04T02:49:01.586936
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Aiguo Xu, Guangcai Zhang, X. F. Pan, Ping Zhang, and Jianshi Zhu", "submitter": "Aiguo Xu Dr.", "url": "https://arxiv.org/abs/0904.0130" }
0904.0135
# Simulation study of shock reaction on porous material Aiguo Xu, Guangcai Zhang, X. F. Pan, and Jianshi Zhu National Key Laboratory of Computational Physics, Institute of Applied Physics and Computational Mathematics, P. O. Box 8009-26, Beijing 100088, P.R.China ###### Abstract Direct modeling of porous materials under shock is a complex issue. We investigate such a system via the newly developed material-point method. The effects of shock strength and porosity size are the main concerns. For the same porosity, the effects of mean-void-size are checked. It is found that, local turbulence mixing and volume dissipation are two important mechanisms for transformation of kinetic energy to heat. When the porosity is very small, the shocked portion may arrive at a dynamical steady state; the voids in the downstream portion reflect back rarefactive waves and result in slight oscillations of mean density and pressure; for the same value of porosity, a larger mean-void-size makes a higher mean temperature. When the porosity becomes large, hydrodynamic quantities vary with time during the whole shock- loading procedure: after the initial stage, the mean density and pressure decrease, but the temperature increases with a higher rate. The distributions of local density, pressure, temperature and particle-velocity are generally non-Gaussian and vary with time. The changing rates depend on the porosity value, mean-void-size and shock strength. The stronger the loaded shock, the stronger the porosity effects. This work provides a supplement to experiments for the very quick procedures and reveals more fundamental mechanisms in energy and momentum transportation. ###### pacs: 05.70.Ln, 05.70.-a, 05.40.-a, 62.50.Ef ## I Introduction Porous materials have extensive applications in industrial and military fields as well as in our daily life. For example, people have long been using porous material to shield delicate objects, to protect things from impact. The porosity characteristics of the material may significantly influences its dynamical and thermodynamical behaviors. When a porous material is shocked, the cavities inside the sample may result in jets and influence its back velocityn1 . Cavity nucleation due to tension waves controls the spallation behavior of the materialn3 . Cavity collapse plays a prominent role in the initiation of energetic reactions in explosivesB2002 . Most studies on shocked porous materials in literature were experimentalP1 ; Porous1 ; Porous2 ; Porous4 ; Gray2003 ; Porous8 and theoretical investigationsPastine1970 ; Porous3 ; Porous5 ; Porous6 ; Porous8 ; WuJing1995 ; WuJing1996 ; GengWuTanCaiJing . Most of them were focused on the Hugoniots and equations of state. Due to the inhomogeneities of the material, the underlying thermodynamical processes in the shocked body are very complex and far from well-understanding. Understanding these processes plays a fundamental role in the field and may present helpful information in material preparation. From the simulation side, molecular dynamics can discover some atomistic mechanisms of shock-induced void collapsePorous7 ; Yang , but the spatial and temporal scales it may cover are too small compared with experimentally measurable ones. When treating with the dynamics of structured and/or porous materials, traditional simulation methods, both the Eulerian and Lagrangian ones, encountered severe difficulties. The material under investigation is generally highly distorted during the collapsing of cavities. The Eulerian description is not convenient to tracking interfaces. When the Lagrangian formulation is used, the original element mesh becomes distorted so significantly that the mesh has to be re-zoned to restore proper shapes of elements. The state fields of mass density, velocities and stresses must be mapped from the distorted mesh to the newly generated one. This mapping procedure is not a straightforward task, and introduces errors. In this study, we will use a newly developed mixed method, material-point method, to investigate the shock properties of porous materials. The material-point method was originally introduced in fluid dynamics by Harlow, et alH1964 and extended to solid mechanics by Burgess, et al MPM , then developed by various researchers, including usJPCM2007 ; CTP2008 ; JPD2008 . At each time step, calculations consist of two parts: a Lagrangian part and a convective one. Firstly, the computational mesh deforms with the body, and is used to determine the strain increment, and the stresses in the sequel. Then, the new position of the computational mesh is chosen (particularly, it may be the previous one), and the velocity field is mapped from the particles to the mesh nodes. Nodal velocities are determined using the equivalence of momentum calculated for the particles and for the computational grid. The method not only takes advantages of both the Lagrangian and Eulerian algorithms but makes it possible to avoid their drawbacks as well. The following part of the paper is planned as follows. Section II presents the theoretical model of the material under consideration. Section III describes briefly the numerical scheme. Simulation results are shown and analyzed in section IV. Section V makes the conclusion. ## II Theoretical model of the material In this study the material is assumed to follow an associative von Mises plasticity model with linear kinematic and isotropic hardeningCModel . Introducing a linear isotropic elastic relation, the volumetric plastic strain is zero, leading to a deviatoric-volumetric decoupling. So, it is convenient to split the stress and strain tensors, $\bm{\sigma}$ and $\bm{\varepsilon}$, as $\displaystyle\bm{\sigma}$ $\displaystyle=$ $\displaystyle\mathbf{s}-P\mathbf{I},P=-\frac{1}{3}\verb|Tr|(\bm{\sigma})\mathtt{,}$ (1) $\displaystyle\bm{\varepsilon}$ $\displaystyle=$ $\displaystyle\mathbf{e}+\frac{1}{3}\theta\mathbf{I},\theta=\frac{1}{3}\verb|Tr|(\bm{\varepsilon})\mathtt{,}$ (2) where $P$ is the pressure scalar, $\mathbf{s}$ the deviatoric stress tensor, and $\mathbf{e}$ the deviatoric strain. The strain $\mathbf{e}$ is generally decomposed as $\mathbf{e}=\mathbf{e}^{e}+\mathbf{e}^{p}$, where $\mathbf{e}^{e}$ and $\mathbf{e}^{p}$ are the traceless elastic and plastic components, respectively. The material shows a linear elastic response until the von Mises yield criterion, $\sqrt{\frac{3}{2}}\left\|\mathbf{s}\right\|=\sigma_{Y}\mathtt{,}$ (3) is reached, where $\sigma_{Y}$ is the plastic yield stress. The yield $\sigma_{Y}$ increases linearly with the second invariant of the plastic strain tensor $\mathbf{e}^{p}$, i.e., $\sigma_{Y}=\sigma_{Y0}+E_{\tan}\left\|\mathbf{e}^{p}\right\|\mathtt{,}$ (4) where $\sigma_{Y0}$ is the initial yield stress and $E_{\tan}$ the tangential module. The deviatoric stress $\mathbf{s}$ is calculated by $\mathbf{s}=\frac{E}{1+\nu}\mathbf{e}^{e}\mathtt{,}$ (5) where $E$ is the Yang’s module and $\nu$ the Poisson’s ratio. Denote the initial material density and sound speed by $\rho_{0}$ and $c_{0}$, respectively. The shock speed $U_{s}$ and the particle speed $U_{p}$ after the shock follows a linear relation, $U_{s}=c_{0}+\lambda U_{p}$, where $\lambda$ is a characteristic coefficient of material. The pressure $P$ is calculated by using the Mie-Grüneissen state of equation which can be written as $P-P_{H}=\frac{\gamma(V)}{V}[E-E_{H}(V_{H})]$ (6) This description consults the Rankine-Hugoniot curve. In Eq.(6), $P_{H}$, $V_{H}$ and $E_{H}$ are pressure, specific volume and energy on the Rankine- Hugoniot curve, respectively. The relation between $P_{H}$ and $V_{H}$ can be estimated by experiment and can be written as $P_{H}=\left\\{\begin{array}[]{ll}\frac{\rho_{0}c_{0}^{2}(1-\frac{V_{H}}{V_{0}})}{(\lambda-1)^{2}(\frac{\lambda}{\lambda-1}\times\frac{V_{H}}{V_{0}}-1)^{2}},&V_{H}\leq V_{0}\\\ \rho_{0}c_{0}^{2}(\frac{V_{H}}{V_{0}}-1),&V_{H}>V_{0}\end{array}\right.$ (7) In this paper, the transformation of specific internal energy $E-E_{H}(V_{H})$ is taken as the plastic energy. Both the shock compression and the plastic work cause the increasing of temperature. The increasing of temperature from shock compression can be calculated as: $\frac{\mathrm{d}T_{H}}{\mathrm{d}V_{H}}=\frac{c_{0}^{2}\cdot\lambda(V_{0}-V_{H})^{2}}{c_{v}\big{[}(\lambda-1)V_{0}-\lambda V_{H}\big{]}^{3}}-\frac{\gamma(V)}{V_{H}}T_{H}.$ (8) where $c_{v}$ is the specific heat. Eq.(8) can be resulted with thermal equation and the Mie-Grüneissen state of equationexplosion . The increasing of temperature from plastic work can be calculated as: $\mathrm{d}T_{p}=\frac{\mathrm{d}W_{p}}{c_{v}}$ (9) Both the Eq.(8) and the Eq.(9) can be written as the form of increment. In this paper the sample material is aluminum. The corresponding parameters are $\rho_{0}=2700$ kg/m3, $E=69$ Mpa, $\nu=0.33$, $\sigma_{Y0}=120$ Mpa, $E_{\tan}=384$ MPa, $c_{0}=5.35$ km/s, $\lambda=1.34$, $c_{v}=880$ J/(Kg$\cdot$K), $k=237$ W/(m$\cdot$K) and $\gamma_{0}=1.96$ when the pressure is below $270$ GPa. The initial temperature of the material is 300 K. ## III Outline of the numerical scheme As a particle method, the material point method discretizes the continuum bodies with $N_{p}$ material particles. Each material particle carries the information of position $\mathbf{x}_{p}$, velocity $\mathbf{v}_{p}$, mass $m_{p}$, density $\rho_{p}$, stress tensor $\bm{\sigma}_{p}$ , strain tensor $\bm{\varepsilon}_{p}$ and all other internal state variables necessary for the constitutive model, where $p$ is the index of particle. At each time step, the mass and velocities of the material particles are mapped onto the background computational mesh. The mapped momentum at node $i$ is obtained by $m_{i}\mathbf{v}_{i}=\sum_{p}m_{p}\mathbf{v}_{p}N_{i}(\mathbf{x}_{p})$, where $N_{i}$ is the element shape function and the nodal mass $m_{i}$ reads $m_{i}=\sum_{p}m_{p}N_{i}(\mathbf{x}_{p}).$ Suppose that a computational mesh is constructed of eight-node cells for three-dimensional problems, then the shape function is defined as $N_{i}=\frac{1}{8}(1+\xi\xi_{i})(1+\eta\eta_{i})(1+\varsigma\varsigma_{i})\mathtt{,}$ (10) where $\xi$,$\eta$,$\varsigma$ are the natural coordinates of the material particle in the cell along the x-, y-, and z-directions, respectively, $\xi_{i}$,$\eta_{i}$,$\varsigma_{i}$ take corresponding nodal values $\pm 1$. The mass of each particle is equal and fixed, so the mass conservation equation, $\mathrm{d}\rho/\mathrm{d}t+\rho\nabla\cdot\mathbf{v}=0$, is automatically satisfied. The momentum equation reads, $\rho\mathrm{d}\mathbf{v/}\mathrm{d}t=\nabla\cdot\bm{\sigma}+\rho\mathbf{b}\mathtt{,}$ (11) where $\rho$ is the mass density, $\mathbf{v}$ the velocity, $\bm{\sigma}$ the stress tensor and $\mathbf{b}$ the body force. Equation (11) is solved on a finite element mesh in a lagrangian frame. Its weak form is $\begin{array}[]{ll}&\int_{\Omega}{\rho\delta\mathbf{v}\cdot\mathrm{d}\mathbf{v/}\mathrm{d}t\mathrm{d}\Omega}+\int_{\Omega}{\delta(\mathbf{v}\nabla)\cdot\bm{\sigma}\mathrm{d}\Omega}-\int_{\Gamma_{t}}{\ \delta\mathbf{v}\cdot\mathbf{t}\mathrm{d}\Gamma}\\\ &-\int_{\Omega}{\ \rho\delta\mathbf{v}\cdot\mathbf{b}\mathrm{d}\Omega}=0\mathtt{.}\end{array}$ (12) Since the continuum bodies is described with the use of a finite set of material particles, the mass density can be written as $\rho(\mathbf{x})=\sum_{p=1}^{N_{p}}{\ m_{p}\delta(\mathbf{x}-\mathbf{x}_{p})}$, where $\delta$ is the Dirac delta function with dimension of the inverse of volume. The substitution of $\rho(\mathbf{x})$ into the weak form of the momentum equation converts the integral to the sums of quantities evaluated at the material particles, namely, $m_{i}\mathrm{d}\mathbf{v}_{i}/\mathrm{d}t=(\mathbf{f}_{i})^{\mathrm{int}}+(\mathbf{f}_{i})^{\mathrm{ext}}\mathtt{,}$ (13) where the internal force vector is given by $\mathbf{f}_{i}{}^{\mathrm{int}}=-\sum_{p}^{N_{p}}{m_{p}\bm{\sigma}}_{p}{\cdot(\nabla N_{i})/\rho_{p}}$, and the external force vector reads $\mathbf{f}_{i}{}^{\mathrm{ext}}=\sum_{p=1}^{N_{p}}{N_{i}\mathbf{b}_{p}+\mathbf{f}_{i}^{c}}$, where the vector $\mathbf{f}_{i}^{c}$ is the contacting force between two bodies. In present paper, all colliding bodies are composed of the same material, and $\mathbf{f}_{i}^{c}$ is treated with in the same way as the internal force. The nodal accelerations are calculated by Eq. (13) with an explicit time integrator. The critical time step satisfying the stability conditions is the ratio of the smallest cell size to the wave speed. Once the motion equations are solved on the cell nodes, the new nodal values of acceleration are used to update the velocity of the material particles. The strain increment for each material particle is determined using the gradient of nodal basis function evaluated at the position of the material particle. The corresponding stress increment can be found from the constitutive model. The internal state variables can also be completely updated. The computational mesh may be the original one or a newly defined one, choose for convenience, for the next time step. More details of the algorithm is referred to JPD2008 ; CTP2008 . Figure 1: (in JPG format) Snapshots of the shocked porous metal. $\delta=1.03$, t=250 ns. (a) Contour of pressure, (b) contour of temperature. The unit of length in this figure is 10 $\mu$m. From blue to red, the contour value increases. The unit of contour is Mpa in (a) and is K in (b). The initial velocities of the flyer and target are $\pm v_{init}=\pm 1000$ m/s in this case. Figure 2: (Color online) Variations of mean density, pressure, temperature and particle velocity with time. The height of the measured domain are h= 800 $\mu$m, 400$\mu$m and 100 $\mu$m, respectively, as shown in the legends. “B" and “T" in the legends means the measured domains are at the bottom and top of the target body, respectively. The units of density, pressure, temperature, particle velocity and time are g/cm3, Gpa, K, m/s and ns, respectively. Figure 3: (in JPG format) Configuration with temperature contour at time t=1.15 $\mu$s. Other parameters are referred to Fig.1 and Fig.2. The unit of temperature is K. ## IV Results of numerical experiments In the present study the porous material is fabricated by a solid material body with an amount of voids randomly embedded. The porosity $\delta$ is defined as $\delta=\rho_{0}/\rho$, where $\rho_{0}$ is the original density of the solid body and $\rho$ is the mean density of porous material. The porosity $\delta$ in the simulated system is controlled by the total number $N_{void}$ and mean size $r_{void}$ of voids embedded. The shock wave to the target porous metal is loaded via colliding by a second body. For the convenience of analysis, we set the configurations and velocities of the two colliding porous bodies symmetric about their impact interface. The initial velocities of the two colliding bodies are along the vertical direction and denoted as $\pm v_{init}$. The impact interface is set at $y=0$. Periodic boundary conditions are used in the horizontal directions, which means the investigated real system is composed of many of the simulated ones aligned periodically in the horizontal direction. We regarded the upper porous body as the target, the lower one as the flyer. Compared with experiments where the target is initially static, the initial velocity of the flyer is $2v_{init}$. In this study we focus on the two-dimensional case. The computational unit is 2 mm in width, as shown in Fig.1. When we are mainly interested in the loading procedure of shock wave to porous body, we require that each simulated body has an enough height so that the rarefactive waves from the upper and lower free surfaces do not affect the physical procedure within the time scale under investigation. Figure 1 shows two snapshots of such a process, where Fig.1(a) shows the contour of pressure and Fig.1(b) shows the contour of temperature. The snapshots show clearly that, different from the case with perfect solid material, there is no stable shock wave in the porous materials. When the compressive waves arrive at a cavity, rarefactive waves are reflected back and propagate within the compressed portion, which destroys the original possible equilibrium state there. Even thus, for the convenience of description, we still refer the compressive waves to shock waves. Correspondingly, the values of physical quantities, such as the particle velocity, density, pressure, temperature, etc, are corresponding mean values calculated in a region $\Omega$ with $y_{1}\leq y\leq y_{2}$. We will investigate the effects of initial shock strength and porosity value. ### IV.1 Cases with porosity $\delta$=1.03 We first study the case with $r_{void}$ =50 $\mu$m and the velocity $v_{init}$ = 1000 m/s, which means the flyer velocity relative to the target is 2000 m/s. The flyer begins to contact the target at the time t = 0. Figure 2 shows the variations of mean density, pressure, temperature and particle velocity with time. These values are dynamically measured in a bottom and a top domains, respectively. The height of the target body is 5 mm in this case. The height of the measured domains are h=800 $\mu$m, 400 $\mu$m and 100 $\mu$m, respectively. For the bottom domain, we choose $y_{1}=100\mu$m. For the top domain, $y_{2}$ takes the y-coordinate of the highest material-particle. The lines with solid symbols are measured values from the bottom and the lines with empty symbols are measured values from the top. From the figure, we get the following information: When the shock waves propagate within the bottom domain $\Omega_{b}$, the measured mean density, pressure and temperature increase nearly linearly with time, up to about t= 150 ns for the case of h=800 $\mu$m, then further to increase with a decreasing changing rate. The three quantities arrive at their first maximum values, 3.14g/cm3, 16.7GPa, and 432K, at the time t=250 ns. At this time the shock front has passed the downstream boundary, $y=810\mu$m, of the measured domain. (See Fig. 1.) The time delay is due to dispersion of shock wave in porous media. The followed concave in either of the $\rho$-,P-,T-curves at about t = 450 ns shows a downloading phenomenon. The phenomenon is resulted from rarefactive waves reflected back from the cavities downstream neighboring to the measured domain. The values of $\rho$ and P increase and recover to their steady values after that, but the temperature get a higher value. The secondary loading- phenomenon is due to the colliding of the upstream and downstream walls during the collapsing of cavities. Within the following period the density and pressure keep nearly constants, while the temperature still increases very slowly. The weak fluctuations in the $\rho$, P, T curves after $t=650$ ns result from the putting-in of compressive and rarefactive waves from the two boundaries of the measured domain $\Omega_{b}$. The visco-plastic work by these wave series makes the temperature increase slowly. Since the configurations and velocities of the flyer and target are symmetric about the plane $y=0$, the vertical component of particle velocity, $u_{y}$, is about 0 m/s, the horizontal component $u_{x}$ first increases with time, then oscillates around a small value which is nearly zero. The lines with empty symbols show that the shock waves arrive at the top free surface at about t= 800 ns, then rarefactive waves are reflected back into the target body. Within the time scale shown in the figure, for the cases with h=800 $\mu$m and 400 $\mu$m, the density (or pressure) recovers to a value being slightly larger than its initial one, but the remained temperature is about 60K higher than the initial temperature and is still increasing; for the case with h=100 $\mu$m, evident oscillations are found in the curve of density after t=900 ns. To understand this, we show in Fig.3 the top portion of the configuration with temperature contour for the time t=1.15 $\mu$s, from which we can find jetting phenomena at the upper free surface. During the downloading procedure, the top of the porous body moves upwards with a velocity being about 877 m/s. From the same data used in Fig.1, we can get the mutual dependence of the hydrodynamical quantities. The initial transient stage and the final oscillatory steady state are clearly observable. Due to existence of the randomly distributed voids, waves with various wave vectors and frequencies propagate within the shocked sample material. When the measured domain becomes smaller, more detailed wave structures may be found. Figure 2 shows clearly this trend. It is interesting to check more carefully the procedure of approaching steady state. Figure 4 shows the standard deviations of the above four quantities versus time measured in the bottom domains. It is found that they increase quickly with time at the very beginning stage, then decrease nearly exponentially to their steady values. The standard deviation of $u_{y}$ is larger than that of $u_{x}$. The finite sizes of these steady values confirm our analysis above: what the system arrives is a steady state with local dynamical oscillations. When the height of the measured domain increases, the standard deviations of measured quantities become larger, at least in the transient period. Figure 4: (Color online) Standard deviations(Std) of the local quantities averaged in various spatial scales. The heights of the measured domains are shown in the legends where “B" means the measured domains are at the bottom of the target body. The length and time units are $\mu$m and ns, respectively. Figure 5: (Color online) Variations of the mean values squared of local rotation, divergence and strain rate with time. <…> in the legends denote the mean value of the corresponding quantity and “B" means the measured domains are at the bottom of the target body. The length and time units are $\mu$m and ns, respectively. Figure 6: (in JPG format) Configurations with density contour (a), pressure contour (b), temperature contour (c) and velocity field (d) at time t=750 ns. The size of particle velocity is denoted by the length of arrow timed by 50. The units are the same as in Fig.2. For the case with perfect crystal material, the increase of entropy result from only from the non-equilibrium procedure of the front of the shock waves. When cavities exist, the high plastic distortion of the materials surrounding the collapsed cavities contribute extra entropy increment. So the local rotation, Rot= $|\nabla\times\mathbf{u}|$, and divergence, Div= $|\nabla\cdot\mathbf{u}|$, make significance sense in describing shocked porous media. The local rotation $|\nabla\times\mathbf{u}|$ describes the circular flow and/or turbulence. The divergence $|\nabla\cdot\mathbf{u}|$ describes the changing rate of volume. They show important mechanisms of entropy and temperature increase in porous material. The former reflects the turbulence dissipation and the latter reflects the shock compression. Figure 5 shows the variations of their mean values squared with time. The behavior of strain rate $\bm{\dot{\varepsilon}}$ is plotted as a comparison. It is found that all the three quantities decrease nearly exponentially to their steady state values when shock waves pass the measured domain $\Omega$. The amplitude of steady strain rate is very close to that of the rotation. The amplitude of the divergence is a little larger for this case. Cavity collapse and new cavitation by the rarefactive waves are the main contributors to the local divergence. To understand better the fluctuations of the local density, pressure, temperature, particle velocity and the finite values of the rotation, divergence, we show in Fig.6 a portion of the configuration with density contour, pressure contour, temperature contour and velocity field at time $t=750$ns. In this case, there is a void around the position (510$\mu$m, 280$\mu$m). We now checking the effects of the void size. Results for different void sizes are compared. There is no evident difference in the steady values of mean density, pressure and particle velocity. But larger voids contribute to a higher mean temperature. (See Fig.7.) As for effects on the mean value squared of the local rotation and divergence, the void size affect only the transient period, but not the steady values. See Fig.8, where the two cases correspond to different mean-void-sizes but the same value of porosity, $\delta=1.03$. Figure 7: (Color online) Effects of the mean void size on the mean temperature. The mean void size $r$, position and height of the measured domain are shown in the legend. “B" and “T" means the measured domains are at the bottom and top of the target body, respectively. The length and time units are $\mu$m and ns, respectively. Figure 8: (Color online) Effects of mean void size on the mean values squared of local rotation, divergence. The mean sizes of void are shown in the legends. The length and time units are $\mu$m and ns, respectively. ### IV.2 Cases with porosity $\delta=1.4$ In this section we study the case with a higher porosity, $\delta$=1.4. For this case, the mean void size is r=10 $\mu$m. Figure 9 shows the variations of mean density, pressure, temperature and particle velocity with time. The initial velocity of the flyer and the target are $\pm v_{init}=1000$m/s. The physical quantities are averaged in a bottom and a top domains. Only the case with h=800 $\mu$m is shown. An evident difference from the low-porosity case with $\delta=1.03$ is that the mean density and pressure decrease with time after the initial stage. Correspondingly, the mean temperature increase with a higher rate. This is due to the rarefactive waves reflected back from the downstream voids. The reflected rarefactive waves make the shocked material a little looser and result in a relatively higher local divergence. The latter transforms more kinetic energy into heat. At the same time, a higher porosity means more voids embedded in the material, more jetting phenomena occur when being shocked. The jetting phenomena and the hitting of jetted material to the downstream walls of the voids make a significant increase of local temperature, local divergence and local rotation. The mean values squared of the local rotation, divergence and strain rate are shown in Fig.10. These quantities are measured in the bottom domain with h=800 $\mu$m. During the initial transient period, the turbulence dissipation makes the most significant contribution to temperature-increase in this case. In the later steady state, the three kinds of dissipation makes nearly the same contribution. To understand better the inhomogeneity effects in the shocked portion of the porous body, we show the distributions of density, pressure, temperature and particle velocity at times t=1200ns, 1250ns and 1300ns in Fig.11. It is clear that these distributions generally deviate from the Gaussian distribution and vary with time. In Fig.12 we study the effects of initial impact velocity on the mean values of the density, pressure and temperature. It is clear that the decreasing rate of the mean density and the increasing rate of mean temperature increase when the initial shock wave becomes stronger. This means that the porosity effects become more significant when the loaded shock wave becomes stronger. We now study porosity effects for a fixed shock strength. Figure 13 shows the mean density, and temperature versus time for various porosities. The initial velocity of the flyer and target are $\pm v_{init}$ = 1000m/s. When the porosity is very small, the decreasing rate with time of the mean density becomes higher as the porosity increases. But when the porosity becomes large, the mean density show more complex behavior. Figure 9: (Color online) Variations of mean density, pressure, temperature and particle velocity with time. Here the porosity $\delta=1.4$ and initial flyer velocity relative to the target is $2v_{init}=2000$ m/s. The meanings of “B", “T" and units are the same as in Fig.2. Figure 10: (Color online) Variations of the mean values squared of local rotation, divergence and strain rate with time. The unit of time is ns. Figure 11: (Color online) Distribution of local density, pressure, temperature, particle velocity at various times. The units are the same as in Fig.2. Figure 12: (Color online) Mean density and temperature versus time for various shock strengths. The initial velocity $v_{init}$ are shown in the legend. The units are the same as in Fig.2. Figure 13: (Color online) Mean density and temperature versus time for various porosities. The values of porosity, 1.01,1.02,1.1,1.4,1.7 are shown in the legends. In the left figure, the lines for cases with $\delta=$1.1,1.4 and 1.7 are moved upwards by 0.01,0.1, and 0.15, respectively. The units are the same as in Fig.2. ## V Conclusion Thermodynamic properties of porous material under shock-reaction is studied via a direct simulation. The effects of shock strength, porosity value and the mean-void-size are checked carefully. It is found that, when the porosity is very small, the shocked portion will arrive at a dynamic steady state; the voids in the downstream portion reflect back rarefactive waves and result in slight oscillations of mean density and pressure; for the same value of porosity, a larger mean-void-size makes a higher mean temperature. When the porosity becomes larger, after the initial stage, the mean density and pressure decrease significantly with time. The distributions of local density, pressure, temperature and particle-velocity are generally non-Gaussian and vary with time. Different from the case with perfect solid material, local turbulence mixing and volume dissipation exist in the whole loading procedure and make the system temperature continuously increase. The changing rates depend on the porosity value, mean-void-size and shock strength. The stronger the loaded shock, the stronger the porosity effects. This work is supplementary to experimental investigations for the very quick procedures and reveals more fundamental mechanisms in energy and momentum transportation. ###### Acknowledgements. We warmly thank Ping Zhang, Jun Chen, Yangjun Ying for helpful discussions. We acknowledge support by Science Foundations of Laboratory of Computational Physics, China Academy of Engineering Physics, and National Science Foundation of China (under Grant Nos. 10702010 and 10775018). ## References * (1) D.B.Reisman, W.G.Wolfer, A. Elsholz, and M.D. Furnish, J. Appl. Phys. 93, 8952 (2003). * (2) E. Dekel, S. Eliezer, Z. Henis, E. Moshe, A. Ludmirsky, and I. B. Goldberg, J. Appl. Phys. 84, 4851 (1998); R. W. Minich, J. U. Cazamias, M. Kumar, and A. J. Schwartz, Metall. Mater. Trans. A 35, 2663 (2004). * (3) N. K. Bourne, Shock Waves 11, 447 (2002). * (4) R. K. Linde and D. N. Schmidt, J. Appl. Phys. 37, 3259 (1966). * (5) R. R. Boade, J. Appl. Phys. 40, 3781 (1969). * (6) B. M. Butcher, J. Appl. Phys. 45, 3864 (1974). * (7) S. Bonnan and P. L. Hereil, J. Appl. Phys. 83, 5741 (1998). * (8) G. T. Gray III, N. K. Bourne and J. C. F. Milett, J. Appl. Phys. 94, 6430 (2003). * (9) A. D. Resnyansky, N. K. Bourne, J. Appl. Phys. 95, 1760 (2004). * (10) D. J. Pastine, M. Lombardi, A. Chatterjee and W. Tchen, J. Appl. Phys. 41, 3144 (1970). * (11) Z. P. Wang, J. Appl. Phys. 81, 7213 (1997). * (12) J. Massoni, R. Saurel, G. Baudin and G. Demol, Phys. Fluid 11, 710 (1999). * (13) L. Boshoff-Mostert and H. J. Viljoen, J. Appl. Phys. 86, 1245 (1999). * (14) Q. Wu and F. Jing, Appl. Phys. Lett. 67, 49 (1995). * (15) Q. Wu and F. Jing, J. Appl. Phys. 80, 4343 (1996). * (16) H. Geng, Q. Wu, H. Tan, L. Cai and F. Jing, J. Appl. Phys. 92, 5924 (2002). * (17) P. Erhart, E. M. Bringa, M. Kumar, and K. Albe, Phys. Rev. B 72, 052104 (2005). * (18) Q. Yang, Guangcai Zhang, Aiguo Xu, Y. Zhao, Y. Li, Acta Phys. Sini. 57, 940 (2008) (in Chinese). * (19) F. H. Harlow, 1964 Methods for Computational Physics, Vol. 3, 319-343, Adler B, Fernbach S, Rotenberg M (eds). Academic Press: New York . * (20) D. Burgess, D. Sulsky, J. U. Brackbill, J. Comput. Phys. 103, 1 (1992). * (21) Aiguo Xu, X F Pan, Guangcai Zhang and Jianshi Zhu, J. Phys.: Condens. Matter 19, 326212(2007). * (22) X. F. Pan, Aiguo Xu, Guangcai Zhang, et al, Commun. Theor. Phys. 49, 1129 (2008). * (23) X. F. Pan, AiguoXu ,Guangcai Zhang and Jianshi Zhu, J. Phys. D: Appl. Phys. 41, 015401 (2008). * (24) F. Auricchio, L. B. da Veiga, Int. J. Numer. Meth. Engng 56 1375 (2003). * (25) B. Zhang, et al. Explosion physics, Ordance Industry Press of China, 1997 Beijing.
arxiv-papers
2009-04-01T11:55:42
2024-09-04T02:49:01.594343
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Aiguo Xu, Guangcai Zhang, X. F. Pan, and Jianshi Zhu", "submitter": "Aiguo Xu Dr.", "url": "https://arxiv.org/abs/0904.0135" }
0904.0226
# Coding versus ARQ in Fading Channels: How reliable should the PHY be? Peng Wu and Nihar Jindal University of Minnesota, Minneapolis, MN 55455 Email: {pengwu,nihar}@umn.edu ###### Abstract This paper studies the tradeoff between channel coding and ARQ (automatic repeat request) in Rayleigh block-fading channels. A heavily coded system corresponds to a low transmission rate with few ARQ re-transmissions, whereas lighter coding corresponds to a higher transmitted rate but more re- transmissions. The optimum error probability, where optimum refers to the maximization of the average successful throughput, is derived and is shown to be a decreasing function of the average signal-to-noise ratio and of the channel diversity order. A general conclusion of the work is that the optimum error probability is quite large (e.g., $10\%$ or larger) for reasonable channel parameters, and that operating at a very small error probability can lead to a significantly reduced throughput. This conclusion holds even when a number of practical ARQ considerations, such as delay constraints and acknowledgement feedback errors, are taken into account. ## I Introduction In contemporary wireless communication systems, ARQ (automatic repeat request) is generally used above the physical layer (PHY) to compensate for packet errors: incorrectly decoded packets are detected by the receiver, and a negative acknowledgement is sent back to the transmitter to request a re- transmission. In such an architecture there is a natural tradeoff between the transmitted rate and ARQ re-transmissions. A high transmitted rate corresponds to many packet errors and thus many ARQ re-transmissions, but each successfully received packet contains many information bits. On the other hand, a low transmitted rate corresponds to few ARQ re-transmissions, but few information bits are contained per packet. Thus, a fundamental design challenge is determining the transmitted rate that maximizes the rate at which bits are successfully delivered. Since the packet error probability is an increasing function of the transmitted rate, this is equivalent to determining the optimal packet error probability, i.e., the optimal PHY reliability level. We consider a wireless channel where the transmitter chooses the rate based only on the fading statistics because knowledge of the instantaneous channel conditions is not available (e.g., high velocity mobiles in cellular systems). The transmitted rate-ARQ tradeoff is interesting in this setting because the packet error probability depends on the transmitted rate in a non-trivial fashion; on the other hand, this tradeoff is somewhat trivial when instantaneous channel state information at the transmitter (CSIT) is available (see Remark 1). We begin by analyzing an idealized system, for which we find that making the PHY too reliable can lead to a significant penalty in terms of the achieved goodput (long-term average successful _throughput_), and that the optimal packet error probability is decreasing in the average SNR and in the fading selectivity experienced by each transmitted codeword. We also see that for a large level of system parameters, choosing an error probability of $10\%$ leads to near-optimal performance. We then consider a number of important practical considerations, such as a limit on the number of ARQ re- transmissions and unreliable acknowledgement feedback. Even after taking these issues into account, we find that a relatively unreliable PHY is still preferred. Because of fading, the PHY can be made reliable only if the transmitted rate is significantly reduced. However, this reduction in rate is not made up for by the corresponding reduction in ARQ re-transmissions. ### I-A Prior Work There has been some recent work on the joint optimization of packet-level erasure-correction codes (e.g., fountain codes) and PHY-layer error correction [1, 2, 3, 4]. The fundamental metric with erasure codes is the product of the transmitted rate and the packet success probability, which is the same as in the idealized ARQ setting studied in Section III. Even in that idealized setting, our work differs in a number of ways. References [1, 3, 4] study multicast (i.e., multiple receivers) while [2] considers unicast assuming no diversity per transmission, whereas our focus is on the unicast setting with diversity per transmission. Furthermore, our analysis provides a general explanation of how the PHY reliability should depend on both the diversity and the average SNR. In addition, we consider a number of practical issues specific to ARQ, such as acknowledgement errors (Section IV), as well as hybrid-ARQ (Section V). ## II System Model We consider a Rayleigh block-fading channel where the channel remains constant within each block but changes independently from one block to another. The $t$-th ($t=1,2,\cdots$) received channel symbol in the $i$-th ($i=1,2,\cdots$) fading block $y_{t,i}$ is given by $\displaystyle y_{t,i}=\sqrt{\mbox{\scriptsize\sf SNR}}~{}h_{i}x_{t,i}+z_{t,i},$ (1) where $h_{i}\sim\mathcal{CN}(0,1)$ represents the channel gain and is i.i.d. across fading blocks, $x_{t,i}\sim\mathcal{CN}(0,1)$ denotes the Gaussian input symbol constrained to have unit average power, and $z_{t,i}\sim\mathcal{CN}(0,1)$ models the additive Gaussian noise assumed to be i.i.d. across channel uses and fading blocks. Although we focus on single antenna systems and Rayleigh fading channel, our model can be easily extended to multiple-input and multiple-output (MIMO) systems and other fading distributions as commented upon in Remark 2. Each transmission (i.e., codeword) is assumed to span $L$ fading blocks, and thus $L$ represents the time/frequency selectivity experienced by each codeword. In analyzing ARQ systems, the packet error probability is the key quantity. If a strong channel code (with suitably long blocklength) is used, it is well known that the packet error probability is accurately approximated by the mutual information outage probability [5, 6, 7, 8]. Under this assumption (which is examined in Section IV-A), the packet error probability for transmission at rate $R$ bits/symbol is given by [9, eq (5.83)]: $\displaystyle\varepsilon(\mbox{\scriptsize\sf SNR},L,R)=\mathbb{P}\left[\frac{1}{L}\sum_{i=1}^{L}\log_{2}(1+\mbox{\scriptsize\sf SNR}|h_{i}|^{2})\leq R\right].$ (2) Here we explicitly denote the dependence of the error probability on the average signal-to-noise ratio SNR, the selectivity order $L$, and the transmitted rate $R$. We are generally interested in the relationship between $R$ and $\varepsilon$ for particular (fixed) values of SNR and $L$. When SNR and $L$ are constant, $R$ can be inversely computed given some $\varepsilon$; thus, throughout the paper we replace $R$ with $R_{\varepsilon}$ wherever the relationship between $R$ and $\varepsilon$ needs to be explicitly pointed out. The focus of the paper is on simple ARQ, in which packets received in error are re-transmitted and decoding is performed only on the basis of the most recent transmission.111 _Hybrid_ -ARQ, which is a more sophisticated and powerful form of ARQ, is considered in Section V. More specifically, whenever the receiver detects that a codeword has been decoded incorrectly, a NACK is fed back to the transmitter. On the other hand, if the receiver detects correct decoding an ACK is fed back. Upon reception of an ACK, the transmitter moves on to the next packet, whereas reception of a NACK triggers re- transmission of the previous packet. ARQ transforms the system into a variable-rate scheme, and the relevant performance metric is the rate at which packets are successfully received. This quantity is generally referred to as the long-term average _goodput_ , and is clearly defined in each of the relevant sections. And consistent with the assumption of no CSIT (and fast fading), we assume fading is independent across re-transmissions. ## III OPTIMAL PHY Reliability in the Ideal Setting In this section we investigate the optimal PHY reliability level under a number of idealized assumptions. Although not entirely realistic, this idealized model yields important design insights. In particular, we make the following key assumptions: * • Channel codes that operate at the mutual information limit (i.e., packet error probability is equal to the mutual information outage probability). * • Perfect error detection at the receiver. * • Unlimited number of ARQ re-transmissions. * • Perfect ACK/NACK feedback. In Section IV we relax these assumptions, and find that the insights from this idealized setting generally also apply to real systems. In order to characterize the long-term goodput in this idealized setting. In order to do so, we must quantify the number of transmission attempts/ARQ rounds needed for successful transmission of each packet. If we use $X_{i}$ to denote the number of ARQ rounds for the _i_ -th packet, then a total of $\sum_{i=1}^{J}X_{i}$ ARQ rounds are used for transmitting $J$ packets; note that the $X_{i}$’s are i.i.d. due to the independence of fading and noise across ARQ rounds. Each codeword is assumed to span $n$ channel symbols and to contain $b$ information bits, corresponding to a transmitted rate of $R=b/n$ bits/symbols. The average rate at which bits are successfully delivered is the ratio of the bits delivered to the total number of channel symbols required. The goodput $\eta$ is the long-term average at which bits are successfully delivered, and by taking $J\rightarrow\infty$ we get [10]: $\displaystyle\eta=\lim_{J\rightarrow\infty}\frac{Jb}{n\sum_{i=1}^{J}X_{i}}=\lim_{J\rightarrow\infty}\frac{\frac{b}{n}}{\frac{1}{J}\sum_{i=1}^{J}X_{i}}=\frac{R}{\mathbb{E}[X]},$ (3) where $X$ is the random variable describing the ARQ rounds required for successful delivery of a packet. Because each ARQ round is successful with probability $1-\varepsilon$, with $\varepsilon$ defined in (2), and rounds are independent, $X$ is geometric with parameter $1-\varepsilon$ and thus $\mathbb{E}[X]=1/(1-\varepsilon)$. Based upon (3), we have $\displaystyle\eta\triangleq R_{\varepsilon}(1-\varepsilon),$ (4) where the transmitted rate is denoted as $R_{\varepsilon}$ to emphasize its dependence on $\varepsilon$. Based on this expression, we can immediately see the tradeoff between the transmitted rate, i.e. the number of bits per packet, and the number of ARQ re-transmissions per packet: a large $R_{\varepsilon}$ means many bits are contained in each packet but that many re-transmissions are required, whereas a small $R_{\varepsilon}$ corresponds to fewer bits per packet and fewer re- transmissions. Our objective is to find the optimal (i.e., goodput maximizing) operating point on this tradeoff curve for any given parameters SNR and $L$. Because $R_{\varepsilon}$ is a function of $\varepsilon$ (for SNR and $L$ fixed), this one-dimensional optimization can be phrased in terms of $R_{\varepsilon}$ or $\varepsilon$. We find it most insightful to consider $\varepsilon$, which leads to the following definition: ###### Definition 1 The optimal packet error probability, where optimal refers to goodput maximization with goodput defined in (3), for average signal-to-noise ratio SNR and per-codeword selectivity order $L$ is: $\displaystyle\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},L)\triangleq\arg\max_{\varepsilon}~{}R_{\varepsilon}(1-\varepsilon).$ (5) By finding $\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},L)$, we thus determine the optimal PHY reliability level and how this optimum depends on channel parameters SNR and $L$, which are generally static over the timescale of interest.222Note that in this definition we assume all possible code rates are possible; nonetheless, this formulation provides valuable insight for systems in which the transmitter must choose from a finite set of code rates. For $L=1$, a simple calculation shows 333The expression for $L=1$ is also derived in [2]. However, authors in [2] only consider $L=1$ case rather than $L>1$ scenarios, which are further investigated in our work. $\displaystyle\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},1)=1-e^{\left(1-\mbox{\scriptsize\sf SNR}\right)/\left(\mbox{\scriptsize\sf SNR}\cdot W(\mbox{\scriptsize\sf SNR})\right)},$ (6) where $W(\cdot)$ is the Lambert W function [11]. Unfortunately, for $L>1$ it does not seem feasible to find an exact analytical solution because a closed- form expression for the outage probability exists only for $L=1$. However, the optimization in (5) can be easily solved numerically (for arbitrary $L$). In addition, an accurate approximation to $\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},L)$ can be solved analytically, as we detail in the next subsection. In order to provide a general understanding of $\varepsilon^{\star}$, Fig. 1 contains a plot of goodput $\eta$ (numerically computed) versus outage probability $\varepsilon$ for $L=2$ and $L=5$ at $\mbox{\scriptsize\sf SNR}=0$ and $10$ dB. For each curve, the goodput-maximizing value of $\varepsilon$ is circled. From this figure, we make the following observations: * • Making the physical layer too reliable or too unreliable yields poor goodput. * • The optimal outage probability decreases with SNR and $L$. These turn out to be the key behaviors of the coding-ARQ tradeoff, and the remainder of this section is devoted to analytically explain these behaviors through a Gaussian approximation. ###### Remark 1 Throughput the paper we consider the setting _without_ channel state information at the transmitter (CSIT). If there is CSIT, which generally is the case when the fading is slow relative to the delay in the channel feedback loop, the optimization problem in _Definition 1_ turns out to be trivial. When CSIT is available, the channel is essentially AWGN with an instantaneous SNR that is determined by the fading realization but is known to the TX. If a capacity-achieving code with infinite codeword block-length is used in the AWGN channel, the relationship between error and rate is a step-function: $\displaystyle\varepsilon=$ $\displaystyle 0,$ if $R<\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h|^{2}\right)$ (7a) $\displaystyle\varepsilon=$ $\displaystyle 1,$ if $R\geq\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h|^{2}\right)$. (7b) Thus, it is optimal to choose a rate very slightly below the instantaneous capacity $\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h|^{2}\right)$. For realistic codes with finite blocklength, the $\varepsilon$-$R$ curve is not a step function but nonetheless is very steep. For example, for turbo codes the waterfall characteristic of error vs. SNR curves (for fixed rate) translates to a step-function-like error vs. rate curve for fixed SNR. Therefore, the transmitted rate should be chosen close to the bottom of the step function. ### III-A Gaussian Approximation The primary difficulty in finding $\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},L)$ stems from the fact that the outage probability in (2) can only be expressed as an $L$-dimensional integral, except for the special case $L=1$. To circumvent this problem, we utilize a Gaussian approximation to the outage probability used in prior work [12, 13, 14]. The random variable $\frac{1}{L}\sum_{i=1}^{L}\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h_{i}|^{2}\right)$ is approximated by a $\mathcal{N}\left(\mu(\mbox{\scriptsize\sf SNR}),\sigma^{2}(\mbox{\scriptsize\sf SNR})/L\right)$ random variable, where $\mu(\mbox{\scriptsize\sf SNR})$ and $\sigma^{2}(\mbox{\scriptsize\sf SNR})$ are the mean and the variance of $\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h|^{2}\right)$, respectively: $\displaystyle\mu(\mbox{\scriptsize\sf SNR})$ $\displaystyle=$ $\displaystyle\mathbb{E}_{|h|}\left[\log_{2}(1+\mbox{\scriptsize\sf SNR}|h|^{2})\right],$ (8) $\displaystyle\sigma^{2}(\mbox{\scriptsize\sf SNR})$ $\displaystyle=$ $\displaystyle\mathbb{E}_{|h|}\left[\log_{2}(1+\mbox{\scriptsize\sf SNR}|h|^{2})\right]^{2}-\mu^{2}(\mbox{\scriptsize\sf SNR}).$ (9) Closed forms for these quantities can be found in [15, 16]. Based on this approximation we have $\displaystyle\varepsilon$ $\displaystyle\approx$ $\displaystyle Q\left(\frac{\sqrt{L}}{\sigma(\mbox{\scriptsize\sf SNR})}(\mu(\mbox{\scriptsize\sf SNR})-R_{\varepsilon})\right),$ (10) where $Q(\cdot)$ is the tail probability of a standard normal. Solving this equation for $R_{\varepsilon}$ and plugging into (4) yields the following approximation for the goodput, which we denote as $\eta_{g}$: $\displaystyle\eta_{g}=\left(\mu(\mbox{\scriptsize\sf SNR})-Q^{-1}(\varepsilon)\frac{\sigma(\mbox{\scriptsize\sf SNR})}{\sqrt{L}}\right)(1-\varepsilon),$ (11) where $Q^{-1}(\varepsilon)$ is the inverse of the $Q$ function. ### III-B Optimization of Goodput Approximation The optimization of $\eta_{g}$ turns out to be more tractable. We first rewrite $\eta_{g}$ as $\displaystyle\eta_{g}=\mu(\mbox{\scriptsize\sf SNR})\left(1-\kappa\cdot Q^{-1}(\varepsilon)\right)(1-\varepsilon),$ (12) where the constant $\kappa\in(0,1)$ is the $\mu$-normalized standard deviation of the received mutual information: $\kappa\triangleq\frac{\sigma(\mbox{\scriptsize\sf SNR})}{\mu(\mbox{\scriptsize\sf SNR})\sqrt{L}}.$ (13) We can observe that $\kappa$ decreases in SNR and $L$. We now define $\varepsilon_{g}^{\star}$ as the $\eta_{g}$-maximizing outage probability: $\displaystyle\varepsilon_{g}^{\star}(\mbox{\scriptsize\sf SNR},L)\triangleq\arg\max_{\varepsilon}~{}\left(1-\kappa\cdot Q^{-1}(\varepsilon)\right)(1-\varepsilon),$ (14) where we have pulled out the constant $\mu(\mbox{\scriptsize\sf SNR})$ from (12) because it does not affect the maximization. ###### Proposition 1 The PHY reliability level that maximizes the Gaussian approximated goodput is the unique solution to the following fixed point equation: $\displaystyle\left(Q^{-1}(\varepsilon_{g}^{\star})-(1-\varepsilon_{g}^{\star})\cdot\left(Q^{-1}(\varepsilon)\right)^{\prime}\mid_{\varepsilon=\varepsilon_{g}^{\star}}\right)^{-1}=\kappa.$ (15) Furthermore, $\varepsilon_{g}^{\star}$ is increasing in $\kappa$. ###### Proof: See Appendix A. ∎ We immediately see that $\varepsilon_{g}^{\star}$ depends on the channel parameters only through $\kappa$. Furthermore, because $\kappa$ is decreasing in SNR and $L$, we see that $\varepsilon_{g}^{\star}$ decreases in $L$ (i.e., the channel selectivity) and SNR. Straightforward analysis shows that $\varepsilon_{g}^{\star}$ tends to zero as $L$ increases approximately as $1/\sqrt{L\log L}$, while $\varepsilon_{g}^{\star}$ tends to zero with SNR approximately as $1/\sqrt{\log\mbox{\scriptsize\sf SNR}}$. In Fig. 2, the exact optimal $\varepsilon^{\star}$ and the approximate-optimal $\varepsilon_{g}^{\star}$ are plotted vs. SNR (dB) for $L=2,5,$ and $10$. The Gaussian approximation is seen to be reasonably accurate, and most importantly, correctly captures behavior with respect to $L$ and SNR. In order to gain an intuitive understanding of the optimization, in Fig. 3 the success probability $1-\varepsilon$ (left) and the goodput $\eta=R_{\varepsilon}(1-\varepsilon)$ (right) are plotted versus the transmitted rate $R$ for $\mbox{\scriptsize\sf SNR}=10$ dB. For each $L$ the goodput-maximizing operating point is circled. First consider the curves for $L=5$. For $R$ up to approximately $1.5$ bits/symbol the success probability is nearly one, i.e., $\varepsilon\approx 0$. As a result, the goodput $\eta$ is approximately equal to $R$ for $R$ up to $1.5$. When $R$ is increased beyond $1.5$ the success probability begins to decrease non-negligibly but the goodput nonetheless increases with $R$ because the increased transmission rate makes up for the loss in success probability (i.e., for the ARQ re- transmissions). However, the goodput peaks at $R=2.3$ because beyond this point the increase in transmission rate no longer makes up for the increased re-transmissions; visually, the optimum rate (for each value of $L$) corresponds to a point beyond which the success probability begins to drop off sharply with the transmitted rate. To understand the effect of the selectivity order $L$, notice that increasing $L$ leads to a steepening of the success probability-rate curve. This has the effect of moving the goodput curve closer to the transmitted rate, which leads to a larger optimum rate and a larger optimum success probability ($1-\varepsilon^{\star}$). To understand why $\varepsilon^{\star}$ decreases with SNR, based upon the rewritten version of $\eta_{g}$ in (12) we see that the governing relationship is between the success probability $1-\varepsilon$ and the normalized, rather than absolute, transmission rate $R/\mu(\mbox{\scriptsize\sf SNR})$. Therefore, increasing SNR steepens the success probability-normalized rate curve (similar to the effect of increasing $L$) and thus leads to a smaller value of $\varepsilon^{\star}$. Is is important to notice that the optimum error probabilities in Fig. 2 are quite large, even for large selectivity and at high SNR levels. This follows from the earlier explanation that decreasing the error probability (and thus the rate) beyond a certain point is inefficient because the decrease in ARQ re-transmissions does not make up for the loss in transmission rate. To underscore the importance of not operating the PHY too reliably, in Fig. 4 goodput is plotted versus SNR (dB) for $L=2$ and $10$ for the optimum error probability $\eta(\varepsilon^{\star})$ as well as for $\varepsilon=0.1$, $0.01$, and $0.001$. Choosing $\varepsilon=0.1$ leads to near-optimal performance for both selectivity values. On the other hand, there is a significant penalty if $\varepsilon=0.01$ or $0.001$ when $L=2$; this penalty is reduced in the highly selective channel ($L=10$) but is still non- negligible. Indeed, the most important insight from this analysis is that making the PHY too reliable can lead to a significant performance penalty; for example, choosing $\varepsilon=0.001$ leads to a power penalty of approximately $10$ dB for $L=2$ and $2$ dB for $L=10$. ###### Remark 2 _Proposition 1_ shows $\varepsilon_{g}^{\star}$ is only determined by $\kappa$, which is completely determined by the statistics of the received mutual information per packet. This implies our results can be easily extended to different fading distributions and to MIMO by appropriately modifying $\mu(\mbox{\scriptsize\sf SNR})$ and $\sigma(\mbox{\scriptsize\sf SNR})$. ## IV OPTIMAL PHY Reliability in the Non-ideal Setting While the previous section illustrated the need to operate the PHY at a relatively unreliable level under a number of idealized assumptions, a legitimate question is whether that conclusion still holds when the idealizations of Section III are removed. Thereby motivated, in this section we begin to carefully study the following scenarios one by one: * • Finite codeword block-length. * • Imperfect error detection. * • Limited number of ARQ rounds per packet. * • Imperfect ACK/NACK feedback. As we shall see, our basic conclusion is upheld even under more realistic assumptions. ### IV-A Finite Codeword Block-length Although in the previous section we assumed operation at the mutual information of infinite blocklength codes, real systems must use finite blocklength codes. In order to determine the effect of finite blocklength upon the optimal PHY reliability, we study the mutual information outage probability in terms of the information spectrum, which captures the block error probability for finite blocklength codes. In [17], it was shown that actual codes perform quite close to the information spectrum-based outage probability. By extending the results of [18, 17], the outage probability with blocklength $n$ (symbols) is $\displaystyle\varepsilon(n,\mbox{\scriptsize\sf SNR},L,R)=\mathbb{P}\left[\frac{1}{L}\sum_{i=1}^{L}\log\left(1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}\right)+\frac{1}{n}\sum_{i=1}^{L}\left(\sqrt{\frac{|h_{i}|^{2}\mbox{\scriptsize\sf SNR}}{1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}}}\cdot\sum_{j=1}^{n/L}\omega_{ij}\right)\leq R\right],$ (16) where $R$ is the transmitted rate in nats/symbol, and $\omega_{i,j}$’s are i.i.d. Laplace random variables [18], each with zero mean and variance two. The first term in the sum is the standard infinite blocklength mutual information expression, whereas the second term is due to the finite blocklength, and in particular captures the effect of atypical noise realizations. This second term goes to zero as $n\rightarrow\infty$ (i.e., atypical noise does not occur in the infinite blocklength limit), but cannot be ignored for finite $n$. The sum of i.i.d. Laplace random variables has a Bessel-K distribution, which is difficult to compute for large $n$ but can be very accurately approximated by a Gaussian as verified in [17]. Thus, the mutual information conditioned on the $L$ channel realizations is approximated by a Gaussian random variable: $\displaystyle\mathcal{N}\left(\frac{1}{L}\sum_{i=1}^{L}\log\left(1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}\right),\frac{1}{L}\sum_{i=1}^{L}\frac{2|h_{i}|^{2}\mbox{\scriptsize\sf SNR}}{n\left(1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}\right)}\right)$ (17) (This is different from Section III-A, where the Gaussian approximation is made with respect to the fading realizations). Therefore, we can approximate the outage probability with finite block-length $n$ by averaging the cumulative distribution function (CDF) of (17) over different channel realizations: $\displaystyle\varepsilon(n,\mbox{\scriptsize\sf SNR},L,R)\approx\mathbb{E}_{|h_{1}|,\ldots,|h_{L}|}Q\left(\frac{\frac{1}{L}\sum_{i=1}^{L}\log\left(1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}\right)-R}{\sqrt{\frac{1}{L}\sum_{i=1}^{L}\frac{2|h_{i}|^{2}\mbox{\scriptsize\sf SNR}}{n\left(1+|h_{i}|^{2}\mbox{\scriptsize\sf SNR}\right)}}}\right).$ (18) In Fig. 5, we compare finite and infinite blocklength codes by plotting success probability $1-\varepsilon$ vs. $R_{\varepsilon}$ (bits/symbol) for $L=10$ at $\mbox{\scriptsize\sf SNR}=0$ and $10$ dB. It is clearly seen that the steepness of the success-rate curve is reduced by the finite blocklength; this is a consequence of atypical noise realizations. We can now consider goodput maximization for a given blocklength $n$: $\displaystyle\varepsilon^{\star}(\mbox{\scriptsize\sf SNR},L,n)\triangleq~{}\arg\max_{\varepsilon}R_{\varepsilon}(1-\varepsilon),$ (19) where both $R_{\varepsilon}$ and $\varepsilon$ are computed (numerically) in the finite codeword block-length regime. In Fig. 6, the optimal $\varepsilon$ vs. SNR (dB) is plotted for both finite block-length coding and infinite block-length coding. We see that the optimal error probability becomes larger, as expected by success-rate curves with reduced steepness in Fig. 5. At high SNR, the finite block-length coding curve almost overlaps the infinite block-length coding curve because the unusual noise term in the mutual information expression is negligible for large values of SNR. As expected, the optimal reliability level with finite blocklength codes does not differ significantly from the idealized case. ### IV-B Non-ideal Error Detection A critical component of ARQ is error detection, which is generally performed using a cyclic redundancy check (CRC). The standard usage of CRC corresponds to appending $k$ parity check bits to $b-k$ information bits, yielding a total of $b$ bits that are then encoded (by the channel encoder) into $n$ channel symbols. At the receiver, the channel decoder (which is generally agnostic to CRC) takes the $n$ channel symbols as inputs and produces an estimate of the $b$ bits, which are in turn passed to the CRC decoder for error detection. A basic analysis in [19] shows that if the channel decoder is in error (i.e., the $b$ bits input to the channel encoder do not match the $b$ decoded bits), the probability of an undetected error (i.e., the CRC decoder signals correct even though an error has occurred) is roughly $2^{-k}$. Therefore, the overall probability of an undetected error is well approximated by $\varepsilon\cdot 2^{-k}$. Undetected errors can lead to significant problems, whose severity depends upon higher network layers (e.g., whether or not an additional layer of error detection is performed at a higher layer) and the application. However, a general perspective is provided by imposing a constraint $p$ on the undetected error probability, i.e., $\varepsilon\cdot 2^{-k}\leq p$. Based on this constraint, we see that the constraint can be met by increasing $k$, which comes at the cost of overhead, or by reducing the packet error probability $\varepsilon$, which can significantly reduce goodput (Section III). The question most relevant to this paper is the following: does the presence of a stringent constraint on undetected error probability motivate reducing the PHY packet error probability $\varepsilon$? The relevant quantity, along with the undetected error probability, is the rate at which information bits are correctly delivered, which is: $\displaystyle\eta=\frac{b-k}{n}\cdot(1-\varepsilon)=\left(R_{\varepsilon}-\frac{k}{n}\right)\cdot(1-\varepsilon),$ (20) where $R_{\varepsilon}-\frac{k}{n}$ is the effective transmitted rate after accounting for the parity check overhead. It is then relevant to maximize this rate subject to the constraint on undetected error:444For the sake of compactness, the dependence of $\varepsilon^{\star}$ and $k^{\star}$ upon SNR, $L$ and $n$ is suppressed henceforth, except where explicit notation is required.: $\displaystyle\left(\varepsilon^{\star},k^{\star}\right)\triangleq$ $\displaystyle\arg\max_{\varepsilon,k}~{}\left(R_{\varepsilon}-\frac{k}{n}\right)\cdot(1-\varepsilon)$ $\displaystyle\text{subject to}~{}~{}\varepsilon\cdot 2^{-k}\leq p$ Although this optimization problem (nor the version based on the Gaussian approximation) is not analytically tractable, it is easy to see that the solution corresponds to $k^{\star}=\lceil-\log_{2}(p/\varepsilon^{\star})\rceil$, where $\varepsilon^{\star}$ is roughly the optimum packet error probability assuming perfect error detection (i.e. the solution from Section III). In other words, the undetected error probability constraint should be satisfied by choosing $k$ sufficiently large while leaving the PHY transmitted rate nearly untouched. To better understand this, note that reducing $k$ by a bit requires reducing $\varepsilon$ by a factor of two. The corresponding reduction in CRC overhead is very small (roughly $1/n$), while the reduction in the transmitted rate is much larger. Thus, if we consider the choices of $\varepsilon$ and $k$ that achieve the constraint with equality, i.e., $k=-\log_{2}(p/\varepsilon)$, goodput decreases as $\varepsilon$ is decreased below the packet error probability which is optimal under the assumption of perfect error detection. In other words, operating the PHY at a more reliable point is not worth the small reduction in CRC overhead. ### IV-C End-to-End Delay Constraint In certain applications such as Voice-over-IP (VoIP), there is a limit on the number of re-transmissions per packet as well as a constraint on the fraction of packets that are not successfully delivered within this limit. If such constraints are imposed, it may not be clear how aggressively ARQ should be utilized. Consider a system where any packet that fails on its $d$-th attempt is discarded (i.e., at most $d-1$ re-transmissions are allowed), but at most a fraction $q$ of packets can be discarded, where $q>0$ is a reliability constraint. Under these conditions, the probability a packet is discarded is $\varepsilon^{d}$, i.e., the probability of $d$ consecutive decoding failures, while the long-term average rate at which packets are successfully delivered still is $R_{\varepsilon}(1-\varepsilon)$. To understand why the goodput expression is unaffected by the delay limit, note that the number of successfully delivered packets is equal to the number of transmissions in which decoding is successful, regardless of which packets are transmitted in each slot. The delay constraint only affects which packets are delivered in different slots, and thus does not affect the goodput.555The goodput expression can alternatively be derived by computing the average number of ARQ rounds per packet (accounting for the limit $d$), and then applying the renewal-reward theorem [20]. Since the discarded packet probability is $\varepsilon^{d}$, the reliability constraint requires $\varepsilon\leq q^{1/d}$. We can thus consider maximization of goodput $R_{\varepsilon}(1-\varepsilon)$ subject to the constraint $\varepsilon\leq q^{1/d}$. Because the goodput is observed to be concave in $\varepsilon$, only two possibilities exist. If $q^{\frac{1}{d}}$ is larger than the optimal value of $\varepsilon$ for the unconstrained problem, then the optimal value of $\varepsilon$ is unaffected by $q$. In the more interesting and relevant case where $q^{\frac{1}{d}}$ is smaller than the optimal unconstrained $\varepsilon$, then goodput is maximized by choosing $\varepsilon$ equal to the upper bound $q^{\frac{1}{d}}$. Thus, a strict delay and reliability constraint forces the PHY to be more reliable than in the unconstrained case. However, amongst all allowed packet error probabilities, goodput is maximized by choosing the largest. Thus, although strict constraints do not allow for very aggressive use of ARQ, nonetheless ARQ should be utilized to the maximum extent possible. ### IV-D Noisy ACK/NACK Feedback We finally remove the assumption of perfect acknowledgements, and consider the realistic scenario where ACK/NACK feedback is not perfect and where the acknowledgement overhead is factored in. The main issue confronted here is the joint optimization of the reliability level of the forward data channel and of the reverse acknowledgement (feedback/control) channel. As intuition suggests, reliable communication is possible only if some combination of the forward and reverse reliability levels is sufficiently large; thus, it is not clear if operating the PHY at a relatively unreliable level as suggested in earlier sections is appropriate. The effects of acknowledgement errors can sometimes be reduced through higher-layer mechanisms (e.g., sequence number check), but in order to shed the most light on the issue of forward/reverse reliability, we focus on an extreme case where acknowledgement errors are most harmful. In particular, we consider a setting with delay and reliability constraints as in Section IV-C, and where any NACK to ACK error leads to a packet missing the delay deadline. We first describe the feedback channel model, and then analyze performance. #### IV-D1 Feedback Channel Model We assume ACK/NACK feedback is performed over a Rayleigh fading channel using a total of $f$ symbols which are distributed on $L_{\textrm{fb}}$ independently faded subchannels; here $L_{\textrm{fb}}$ is the diversity order of the feedback channel, which need not be equal to $L$, the forward channel diversity order. Since the feedback is binary, BPSK is used with the symbol repeated on each sub-channel $f/L_{\textrm{fb}}$ times. For the sake of simplicity, we assume that the feedback channel has the same average SNR as the forward channel, and that the fading on the feedback channel is independent of the fading on the forward channel. After maximum ratio combining at the receiver, the effective SNR is $(f/L_{\textrm{fb}})\cdot\mbox{\scriptsize\sf SNR}\cdot\sum_{i=1}^{L_{\textrm{fb}}}|h_{i}|^{2}$, where $h_{1},\cdots,h_{L_{\textrm{fb}}}$ are the feedback channel fading coefficients. The resulting probability of error (denoted by $\varepsilon_{\textrm{fb}}$), averaged over the fading realizations, is [21]: $\displaystyle\varepsilon_{\textrm{fb}}=\left(\frac{1-\nu}{2}\right)^{L_{\textrm{fb}}}\cdot\sum_{j=0}^{L_{\textrm{fb}}-1}{L_{\textrm{fb}}-1+j\choose j}\left(\frac{1+\nu}{2}\right)^{j},$ (22) where $\nu=\sqrt{\frac{(f/L_{\textrm{fb}})\cdot\mbox{\scriptsize\sf SNR}}{1+(f/L_{\textrm{fb}})\cdot\mbox{\scriptsize\sf SNR}}}$. Clearly, $\varepsilon_{\textrm{fb}}$ is decreasing in $f$ and SNR.666Asymmetric decision regions can be used, in which case $0\rightarrow 1$ and $1\rightarrow 0$ errors have unequal probabilities. However, this does not significantly affect performance and thus is not considered. #### IV-D2 Performance Analysis In order to analyze performance with non-ideal feedback, we must first specify the rules by which the transmitter and receiver operate. The transmitter takes precisely the same actions as in Section IV-C: the transmitter immediately moves on to the next packet whenever an ACK is received, and after receiving $d-1$ consecutive NACK’s (for a single packet) it attempts that packet one last time but then moves on to the next packet regardless of the acknowledgement received for the last attempt. Of course, the presence of feedback errors means that the received acknowledgement does not always match the transmitted acknowledgement. The receiver also operates in the standard manner, but we do assume that the receiver can always determine whether or not the packet being received is the same as the packet received in the previous slot, as can be accomplished by a simple correlation; this reasonable assumption is equivalent to the receiver having knowledge of acknowledgement errors. In this setup an ACK$\rightarrow$NACK error causes the transmitter to re- transmit the previous packet, instead of moving on to the next packet. The receiver is able to recognize that an acknowledgement error has occurred (through correlation of the current and previous received packets), and because it already decoded the packet correctly it does not attempt to decode again. Instead, it simply transmits an ACK once again. Thus, each ACK$\rightarrow$NACK error has the relatively benign effect of wasting one ARQ round. On the other hand, NACK$\rightarrow$ACK errors have a considerably more deleterious effect because upon reception of an ACK, the transmitter automatically moves on to the next packet. Because we are considering a stringent delay constraint, we assume that such a NACK$\rightarrow$ACK error cannot be recovered from and thus we consider it as a lost packet that is counted towards the reliability constraint. This is, in some sense, a worst- case assumption that accentuates the effect of NACK$\rightarrow$ACK errors; some comments related to this point are put forth at the end of this section. To more clearly illustrate the model, the complete ARQ process is shown in Fig. 7 for $d=3$. Each branch is labeled with the success/failure of the transmission as well as the acknowledgement (including errors). Circle nodes refer to states in which the receiver has yet to successfully decode the packet, whereas triangles refer to states in which the receiver has decoded correctly. A packet loss occurs if there is a decoding failure followed by a NACK$\rightarrow$ACK error in the first two rounds, or if decoding fails in all three attempts. All other outcomes correspond to cases where the receiver is able to decode the packet in some round, and thus successful delivery of the packet. In these cases, however, the number of ARQ rounds depends on the first time at which the receiver can decode and when the ACK is correctly delivered. (If an ACK is not successfully delivered, it may take up to $d$ rounds before the transmitter moves on to the next packet.) Notice that after the $d$-th attempt, the transmitter moves on to the next packet regardless of what acknowledgement is received; this is due to the delay constraint that the transmitter follows. Based on the figure and the independence of decoding and feedback errors across rounds, the probability that a packet is lost (i.e., it is not successfully delivered within $d$ rounds) is: $\displaystyle\xi_{d}=\varepsilon\cdot\varepsilon_{\textrm{fb}}+\varepsilon^{2}(1-\varepsilon_{\textrm{fb}})\varepsilon_{\textrm{fb}}+\cdots+\varepsilon^{d-1}(1-\varepsilon_{\textrm{fb}})^{d-2}\varepsilon_{\textrm{fb}}+\varepsilon^{d}(1-\varepsilon_{\textrm{fb}})^{d-1},$ (23) where the first $d-1$ terms represent decoding failures followed by a NACK$\rightarrow$ACK error (more specifically, the $l$-th term corresponds to $l-1$ decoding failures and $l-1$ correct NACK transmissions, followed by another decoding failure and a NACK$\rightarrow$ACK error), and the last term is the probability of $d$ decoding failures and $d-1$ correct NACK transmissions. If we alternatively compute the success probability, we get the following different expression for $\xi_{d}$: $\displaystyle\xi_{d}=1-\sum_{i=1}^{d}(1-\varepsilon)\cdot\varepsilon^{i-1}\cdot(1-\varepsilon_{\textrm{fb}})^{i-1},$ (24) where the $i$-th summand is the probability that successful forward transmission occurs in the $i$-th ARQ round. Based upon (23) and (24) we see that $\xi_{d}$ is increasing in both $\varepsilon$ and $\varepsilon_{\textrm{fb}}$. Thus, a desired packet loss probability $\xi_{d}$ can be achieved by different combinations of the forward channel reliability and the feedback channel reliability: a less reliable forward channel requires a more reliable feedback channel, and vice versa. As in Section IV-C we impose a reliability constraint $\xi_{d}\leq q$, which by (23) translates to a joint constraint on $\varepsilon$ and $\varepsilon_{\textrm{fb}}$. The relatively complicated joint constraint can be accurately approximated by two much simpler constraints. Since we must satisfy $\varepsilon\leq q^{\frac{1}{d}}$ even with perfect feedback ($\varepsilon_{\textrm{fb}}=0$), for any $\varepsilon_{\textrm{fb}}>0$ we also must satisfy $\varepsilon\leq q^{\frac{1}{d}}$ (this ensures that $d$ consecutive decoding failures do not occur too frequently). Furthermore, by examining (23) it is evident that the first term is dominant in the packet loss probability expression. Thus the constraint $\xi_{d}\leq q$ essentially translates to the simplified constraints $\displaystyle\varepsilon\cdot\varepsilon_{\textrm{fb}}\leq q\textrm{~{}~{}~{}and~{}~{}~{}}\varepsilon\leq q^{\frac{1}{d}}.$ (25) These simplified constraints are very accurate for values of $\varepsilon$ not too close to $q^{\frac{1}{d}}$. On the other hand, as $\varepsilon$ approaches $q^{\frac{1}{d}}$, $\varepsilon_{\textrm{fb}}$ must go to zero very rapidly (i.e. much faster than $q/\varepsilon$) in order for $\xi_{d}\leq q$. The first constraint in (25) reveals a general design principle: the combination of the forward and feedback channel must be sufficiently reliable. This is because $\varepsilon\cdot\varepsilon_{\textrm{fb}}$ is precisely the probability that a packet is lost because the initial transmission is decoded incorrectly and is followed by a NACK$\rightarrow$ACK error. Having established the reliability constraint, we now proceed to maximizing goodput while taking acknowledgement errors and ARQ overhead into account. With respect to the long-term average goodput, by applying the renewal-reward theorem again we obtain: $\displaystyle\eta$ $\displaystyle=$ $\displaystyle\frac{n}{n+f}\cdot\frac{R_{\varepsilon}(1-\xi_{d})}{\mathbb{E}[X]}.$ (26) where random variable $X$ is the number of ARQ rounds per packet, and $\mathbb{E}[X]$ is derived in Appendix B. Here, $\frac{n}{n+f}$ is the feedback overhead penalty because each packet spanning $n$ symbols is followed by $f$ symbols to convey the acknowledgement. We now maximize goodput with respect to both the forward and feedback channel error probabilities: $\displaystyle\left(\varepsilon^{\star},\varepsilon_{\textrm{fb}}^{\star}\right)\triangleq$ $\displaystyle\arg\max_{\varepsilon,\varepsilon_{\textrm{fb}}}~{}~{}~{}\frac{n}{n+f}\cdot\frac{R_{\varepsilon}(1-\xi_{d})}{\mathbb{E}[X]}$ $\displaystyle\text{subject to}~{}~{}\xi_{d}\leq q$ noting that $\varepsilon_{\textrm{fb}}$ is a decreasing function of the number of feedback symbols $f$, according to (22). This optimization is not analytically tractable, but can be easily solved numerically and can be understood through examination of the dominant relationships. The overhead factor $n/(n+f)$ clearly depends only on $\varepsilon_{\textrm{fb}}$ (i.e., $f$). Although the second term $R_{\varepsilon}(1-\xi_{d})/\mathbb{E}[X]$ depends on both $\varepsilon$ and $\varepsilon_{\textrm{fb}}$, the dependence upon $\varepsilon_{\textrm{fb}}$ is relatively minor as long as $\varepsilon_{\textrm{fb}}$ is reasonably small (i.e. less than $10\%$). Thus, it is reasonable to consider the perfect feedback setting, in which case the second term is $R_{\varepsilon}(1-\varepsilon)$. Therefore, the challenge is balancing the feedback channel overhead factor $\frac{n}{n+f}$ with the efficiency of the forward channel, approximately $R_{\varepsilon}(1-\varepsilon)$, while satisfying the constraint in (25). If $f$ is chosen small, the feedback errors must be compensated with a very reliable, and thus inefficient, forward channel; on the other hand, choosing $f$ large incurs a large feedback overhead penalty but allows for a less reliable, and thus more efficient, forward channel. In Fig. 8, the jointly optimal ($\varepsilon^{\star},\varepsilon_{\textrm{fb}}^{\star}$) are plotted for a conservative set of forward channel parameters ($L=3$ with $\mbox{\scriptsize\sf SNR}=5$ or $10$ dB, and $n=200$ data symbols per packet), stringent delay and reliability constraints (up to $d=3$ ARQ rounds and a reliability constraint $q=10^{-6}$), and different diversity orders ($L_{\textrm{fb}}=1,2$ and $5$) for the feedback channel. Also plotted is the curve specifying the ($\varepsilon,\varepsilon_{\textrm{fb}}$) pairs that achieve the reliability constraint $\xi_{d}=q$. As discussed earlier, this curve has two distinct regions: for $\varepsilon<0.008$ it is essentially the straight line $\varepsilon\cdot\varepsilon_{\textrm{fb}}=q$, whereas $\varepsilon_{\textrm{fb}}$ must go to zero very quickly as $\varepsilon$ approaches $q^{1/d}=10^{-2}$. When $L_{\textrm{fb}}=2$, the optimal point corresponds to the transition between these two regions. Moving to the right of the optimal corresponds to making the PHY more reliable while making the control channel less reliable (i.e., decreasing $\varepsilon$ and $f$), but this is suboptimal because the overhead savings do not compensate for the loss incurred by a more reliable PHY. On the other hand, moving to the left is suboptimal because only a very modest increase in $\varepsilon$ is allowed, and this increase comes at a large expense in terms of control symbols. If $L_{\textrm{fb}}=5$, the optimal point is further to the left because the feedback overhead required to achieve a desired error rate is reduced. However, the behavior is quite different if there is no diversity on the feedback channel ($L_{\textrm{fb}}=1$). Without diversity, the feedback error probability decreases extremely slowly with $f$ (at order $1/f$), and thus a very large $f$ is required to achieve a reasonable feedback error probability. In this extreme case, it is optimal to sacrifice significant PHY efficiency and choose $\varepsilon$ quite a bit smaller than $q^{1/d}=10^{-2}$. Notice that increasing SNR moves the optimal to the left for all values of $L_{\textrm{fb}}$ because a larger SNR improves the feedback channel reliability while not significantly changing the behavior of the forward channel. This behavior is further explained in Fig. 9, where goodput $\eta$ (optimized with respect to $\varepsilon_{\textrm{fb}}$) is plotted versus forward error probability $\varepsilon$ for the parameters of the previous figure, with $\mbox{\scriptsize\sf SNR}=5$ dB and $L_{\textrm{fb}}=1$ and $2$ here. The figure illustrates the stark contrast with respect to feedback channel diversity: with diversity (even for $L_{\textrm{fb}}=2$), the goodput increases monotonically up to a point quite close to $q^{1/d}$, while without diversity the goodput peaks at a point far below $q^{1/d}$. This is due to the huge difference in the feedback channel reliability with and without diversity: in order to achieve $\varepsilon_{\textrm{fb}}=10^{-3}$, at $\mbox{\scriptsize\sf SNR}=5$ dB without diversity $f=79$ symbols are required, whereas $f=9$ suffices for $L_{\textrm{fb}}=2$. To more clearly understand why the optimal point with diversity is so close to $q^{1/d}$, let us contrast two different choices of $\varepsilon$ for $L_{\textrm{fb}}=2$. At the optimal $\varepsilon=8\times 10^{-3}$, we require $\varepsilon_{\textrm{fb}}=6.3\times 10^{-5}$ and thus $f=34$. On the other hand, at the suboptimal $\varepsilon=10^{-3}$ we require $\varepsilon_{\textrm{fb}}=10^{-3}$ and thus $f=9$. Reducing the forward error probability by a factor of $8$ reduces the feedback overhead from $\frac{34}{234}$ to $\frac{9}{209}$, but reduces the transmitted rate by about $50\%$. The takeaway message of this analysis is clear: as long as the feedback channel has at least some diversity (e.g., through frequency or antennas), stringent post-ARQ reliability constraints should be satisfied by increasing the reliability of the feedback channel instead of increasing the forward channel reliability. This is another consequence of the fact that decreasing the forward channel error probability requires a huge backoff in terms of transmitted rate, which in this case is not compensated by the corresponding decrease in feedback overhead. ## V Hybrid-ARQ While up to now we have considered simple ARQ, contemporary wireless systems often utilize more powerful hybrid-ARQ (HARQ) techniques. When incremental redundancy (IR) HARQ, which is the most powerful type of HARQ, is implemented, a NACK triggers the transmission of extra parity check bits instead of re- transmission of the original packet, and the receiver attempts to decode a packet on the basis of all previous transmissions related to that packet. This corresponds to accumulation of mutual information across HARQ rounds, and thus essentially matches the transmitted rate to the instantaneous channel conditions without requiring CSI at the transmitter [10, 14]. The focus of this section is understanding how the PHY transmitted rate should be chosen when HARQ is used. Unlike simple ARQ, HARQ requires the receiver to keep information from previous rounds in memory; partly for this reason, HARQ is generally implemented in a two-layered system (e.g., in 4G cellular networks such as LTE [22] [23]) in which the HARQ process has to restart (triggered by a higher- layer simple ARQ re-transmission) if the number of HARQ rounds reaches a defined maximum. The precise model we study is described as follows. As before, each HARQ transmission (i.e., round) experiences a diversity order of $L$. However, a maximum of $M$ HARQ rounds are allowed per packet. If a packet cannot be decoded after $M$ HARQ rounds, a post-HARQ outage is declared. This triggers a higher-layer simple ARQ re-transmission, which restarts the HARQ process for that packet. This two-layered ARQ process continues (indefinitely) until the packet is successfully received at the receiver. For the sake of simplicity, we proceed under the ideal assumptions discussed in Section III. Note that the case $M=1$ reverts to the simple ARQ model discussed in the rest of the paper. Given this model, the first-HARQ-round outage probability, denoted $\varepsilon_{1}$, is exactly the same as the non-HARQ outage probability with the same SNR, diversity order $L$, and rate $R$ , i.e., $\displaystyle\varepsilon_{1}(\mbox{\scriptsize\sf SNR},L,R)=\mathbb{P}\left[\frac{1}{L}\sum_{i=1}^{L}\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h_{i}|^{2}\right)\leq R\right].$ (28) In this expression $R$ is the transmitted rate during the first HARQ round, which we refer to as the HARQ initial rate $R_{\textrm{init}}$ hereafter. Because IR leads to accumulation of mutual information, the number of HARQ rounds needed to decode a packet is the smallest integer $\mathcal{T}$ ($1\leq\mathcal{T}\leq M$) such that $\displaystyle\sum_{i=1}^{\mathcal{T}}\left(\frac{1}{L}\sum_{j=1}^{L}\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h_{i,j}|^{2}\right)\right)>R_{\textrm{init}}.$ (29) Therefore, the post-HARQ outage, denoted by $\varepsilon$, is: $\displaystyle\varepsilon(\mbox{\scriptsize\sf SNR},L,M,R_{\textrm{init}})$ $\displaystyle=$ $\displaystyle\mathbb{P}\left[\sum_{i=1}^{M}\left(\frac{1}{L}\sum_{j=1}^{L}\log_{2}\left(1+\mbox{\scriptsize\sf SNR}|h_{i,j}|^{2}\right)\right)\leq R_{\textrm{init}}\right].$ (30) This is the probability that a packet fails to be decoded after $M$ HARQ rounds, and thus is the probability that the HARQ process has to be restarted. Using the renewal-reward theorem as in [10] yields the following expression for the long-term average goodput with HARQ: $\displaystyle\eta=\frac{R_{\textrm{init}}(1-\varepsilon)}{\mathbb{E}[\mathcal{T}]},$ (31) where the distribution of $\mathcal{T}$ is determined by (29). Our interest is in finding the initial rate $R_{\textrm{init}}$ that maximizes $\eta$. This optimization is not analytically tractable, but we can nonetheless provide some insight. In Fig. 10, goodput is plotted versus vs. $R_{\textrm{init}}$ for $L=2$ and a maximum of $M=2$ HARQ rounds, as well as for a system using only simple ARQ (i.e., $M=1$) with the same $L=2$, at $\mbox{\scriptsize\sf SNR}=5$ and $10$ dB. We immediately observe that goodput with HARQ is maximized at a considerably higher rate than for the system without HARQ. Although we do not have analytical proof, we conjecture that the goodput-maximizing initial rate with HARQ is always larger than the maximizing rate without HARQ (for equal diversity order per round/transmission). In fact, with HARQ the initial rate should be chosen such that the first-round outage $\varepsilon_{1}$ is quite large, and for larger values of $M$ the optimizer actually trends towards one. If $\varepsilon_{1}$ is small, then HARQ is rarely used which means that the rate-matching capability provided by HARQ is not exploited. However, $R_{\textrm{init}}$ should not be chosen so large such that there is significant probability of post-HARQ outage, because this leads to a simple ARQ re-transmission and thus forces HARQ to re-start. The following theorem provides an upper bound on the optimal initial rate: ###### Theorem 1 For any $\mbox{\scriptsize\sf SNR},L$, and $M$, the optimal initial rate with HARQ is upper bounded by $1/M$ times the optimal transmitted rate for a non- HARQ system with diversity order $ML$. ###### Proof: The HARQ goodput can be rewritten as $\displaystyle\eta=\frac{R_{\textrm{init}}}{M}\cdot(1-\varepsilon)\cdot\frac{M}{\mathbb{E}[\mathcal{T}]}.$ (32) Based on (30) we see that the post-HARQ outage probability $\varepsilon$ is precisely the same as the outage probability for a non-HARQ system with diversity order $ML$ and transmitted rate $R_{\textrm{init}}/M$. Therefore, the term $(R_{\textrm{init}}/M)(1-\varepsilon)$ in (32) is precisely the goodput for a non-HARQ system with diversity order $ML$. Based on (29) we can see that the term $M/\mathbb{E}[\mathcal{T}]$ is decreasing in $R_{\textrm{init}}/M$, and thus the value of $R_{\textrm{init}}/M$ that maximizes (32) is smaller than the value that maximizes $(R_{\textrm{init}}/M)(1-\varepsilon)$. ∎ Notice that $ML$ is the maximum diversity experienced by a packet if HARQ is used, whereas $ML$ is the precise diversity order experienced by each packet in the reference system (in the theorem) without HARQ. Combined with our earlier observation, we see that the initial rate should be chosen large enough such that HARQ is sufficiently utilized, but not so large such that simple ARQ is overly used. ## VI Conclusion In this paper we have conducted a detailed study of the optimum physical layer reliability when simple ARQ is used to re-transmit incorrectly decoded packets. Our findings show that when a cross-layer perspective is taken, it is optimal to use a rather unreliable physical layer (e.g., a packet error probability of 10% for a wide range of channel parameters). The fundamental reason for this is that making the physical layer very reliable requires a very conservative transmitted rate in a fading channel (without instantaneous channel knowledge at the transmitter). Our findings are quite general, in the sense that the PHY should not be operated reliably even in scenarios in which intuition might suggest PHY-level reliability is necessary. For example, if a smaller packet error mis-detection probability is desired, it is much more efficient to utilize additional error detection bits (e.g., CRC) as compared to performing additional error correction (i.e., making the PHY more reliable). A delay constraint imposes an upper bound on the number of ARQ re-transmissions and an upper limit on the PHY error probability, but an optimized system should operate at exactly this level and no lower. Finally, when acknowledgement errors are taken into account and high end-to-end reliability is required, such reliability should be achieved by designing a reliable feedback channel instead of a reliable data (PHY) channel. In a broader context, one important message is that traditional diversity metrics, which characterize how quickly the probability of error can be made very small, may no longer be appropriate for wireless systems due to the presence of ARQ. As seen in [24] in the context of multi-antenna communication, this change can significantly reduce the attractiveness of transmit diversity techniques that reduce error at the expense of rate. ## Appendix A PROOF of Proposition 1 We first prove the strict concavity of $\eta_{g}$. For any invertible function $f(\cdot)$, the following holds [25]: $\displaystyle\left(f^{-1}(a)\right)^{\prime}=\frac{1}{f^{\prime}(f^{-1}(a))}.$ (33) By combining this with $Q(x)=\int_{x}^{\infty}\frac{1}{\sqrt{2\pi}}e^{-\frac{t^{2}}{2}}dt$, we get $\displaystyle\left(Q^{-1}(\varepsilon)\right)^{\prime}=-\sqrt{2\pi}e^{\frac{(Q^{-1}(\varepsilon))^{2}}{2}},$ (34) which is strictly negative. According to this, the second derivative of $\eta_{g}(\varepsilon)$ is: $\displaystyle\left(\eta_{g}(\varepsilon)\right)^{\prime\prime}$ $\displaystyle=$ $\displaystyle\kappa\mu\left(Q^{-1}(\varepsilon)\right)^{\prime}\left(2+(1-\varepsilon)\sqrt{2\pi}e^{\frac{(Q^{-1}(\varepsilon))^{2}}{2}}Q^{-1}(\varepsilon)\right).$ (35) Because $\kappa\left(Q^{-1}(\varepsilon)\right)^{\prime}<0$, in order to prove $\left(\eta_{g}(\varepsilon)\right)^{\prime\prime}<0$ we only need to show that the expression inside the parenthesis in (35) is strictly positive. If we substitute $\varepsilon=Q(x)$ (here we define $x=Q^{-1}(\varepsilon)$) , then we only need to prove $(Q(x)-1)e^{\frac{x^{2}}{2}}x<\sqrt{\frac{2}{\pi}}$. Notice when $x\geq 0$, the left hand side is negative (because $Q(x)\leq 1$) and the inequality holds. When $x<0$, the left hand side becomes $Q(-x)e^{\frac{x^{2}}{2}}(-x)$. From [26], $Q(-x)<\frac{1}{\sqrt{2\pi}(-x)}e^{-\frac{x^{2}}{2}}$, so if $x<0$, $\displaystyle(Q(x)-1)e^{\frac{x^{2}}{2}}x<\frac{1}{\sqrt{2\pi}(-x)}e^{-\frac{x^{2}}{2}}e^{\frac{x^{2}}{2}}(-x)=\frac{1}{\sqrt{2\pi}}<\sqrt{\frac{2}{\pi}}.$ (36) As a result, the second derivative of $\eta_{g}(\varepsilon)$ is strictly smaller than zero and thus $\eta_{g}$ is strictly concave in $\varepsilon$. Since $\eta_{g}$ is strictly concave in $\varepsilon$, we reach the fixed point equation in (15) by setting the first derivative to zero. The concavity of $\eta_{g}$ implies $\left(\eta_{g}(\varepsilon)\right)^{\prime}$ is decreasing in $\varepsilon$, and thus from (15) we see that $\varepsilon_{g}^{\star}$ is increasing in $\kappa$. ## Appendix B Expected ARQ Rounds with Acknowledgement Errors If the ARQ process terminates after $i$ rounds ($1\leq i\leq d-1$), the reasons for that can be: * • The first $i$ decoding attempts are unsuccessful, the first $i-1$ NACKs are received correctly, but a NACK$\rightarrow$ACK error happens in the $i$-th round, the probability of which is $\varepsilon^{i}\cdot(1-\varepsilon_{\textrm{fb}})^{i-1}\cdot\varepsilon_{\textrm{fb}}$. * • The packet is decoded correctly in the $j$-th round (for $1\leq j\leq i$), but the ACK is not correctly received until the $i$-th round. This corresponds to $j-1$ decoding failures with correct acknowledgements, followed by a decoding success and $i-j$ acknowledgement errors (ACK$\rightarrow$NACK), and then a correct acknowledgement: $\sum_{j=1}^{i}\varepsilon^{j-1}(1-\varepsilon_{\textrm{fb}})^{j}(1-\varepsilon)\varepsilon_{\textrm{fb}}^{i-j}$. These events are all exclusive, and thus we can sum the above probabilities. For $X=d$, we notice that the ARQ process takes the maximum of $d$ rounds if: * • There are $d$ decoding failures with $d-1$ correct NACKs, the probability of which is $\varepsilon^{d-1}\cdot(1-\varepsilon_{\textrm{fb}})^{d-1}$. * • The packet is decoded correctly in the $j$-th round (for $1\leq j\leq d-1$), but the ACK is never received correctly. This corresponds to $j-1$ decoding failures with correct NACKs, followed by a decoding success and $d-j$ acknowledgement errors (ACK$\rightarrow$NACK): $\sum_{j=1}^{d-1}\varepsilon^{j-1}(1-\varepsilon_{\textrm{fb}})^{j-1}(1-\varepsilon)\varepsilon_{\textrm{fb}}^{d-j}$. These events are again exclusive. Therefore, the expected number of rounds is: $\displaystyle\mathbb{E}[X]$ $\displaystyle=$ $\displaystyle\sum_{i=1}^{d-1}i\cdot\left(\varepsilon^{i}\cdot(1-\varepsilon_{\textrm{fb}})^{i-1}\cdot\varepsilon_{\textrm{fb}}+\sum_{j=1}^{i}\varepsilon^{j-1}(1-\varepsilon_{\textrm{fb}})^{j}(1-\varepsilon)\varepsilon_{\textrm{fb}}^{i-j}\right)$ (37) $\displaystyle+d\cdot\left(\varepsilon^{d-1}\cdot(1-\varepsilon_{\textrm{fb}})^{d-1}+\sum_{j=1}^{d-1}\varepsilon^{j-1}(1-\varepsilon_{\textrm{fb}})^{j-1}(1-\varepsilon)\varepsilon_{\textrm{fb}}^{d-j}\right).$ ## References * [1] M. Luby, T. Gasiba, T. Stockhammer, and M. Watson, “Reliable multimedia download delivery in cellular broadcast networks,” _IEEE Trans. Broadcasting_ , vol. 53, no. 1 Part 2, pp. 235–246, 2007. * [2] C. Berger, S. Zhou, Y. Wen, P. Willett, and K. Pattipati, “Optimizing joint erasure-and error-correction coding for wireless packet transmissions,” _IEEE Transactions on Wireless Communications_ , vol. 7, no. 11 Part 2, pp. 4586–4595, 2008. * [3] T. A. Courtade and R. D. Wesel, “A cross-layer perspective on rateless coding for wireless channels,” _Proc. of IEEE Int’l Conf. in Commun. (ICC’09)_ , pp. 1–6, Jun. 2009. * [4] X. Chen, V. Subramanian, and D. J. Leith., “PHY modulation/rate control for fountain codes in 802.11 WLANs,” _submitted to IEEE Trans. Wireless Comm., June 2009_. * [5] G. Carie, G. Taricco, and E. Biglieri, “Optimum power control over fading channels,” _IEEE Trans. Inform. Theory_ , vol. 45, no. 5, pp. 1468–1489, Jul. 1999. * [6] A. Guillén i Fàbregas and G. Caire, “Coded modulation in the block-fading channel: coding theorems and code construction,” _IEEE Trans. Inf. Theory_ , vol. 52, no. 1, pp. 91–114, Jan. 2006. * [7] N. Prasad and M. K. Varanasi, “Outage theorems for MIMO block-fading channels,” _IEEE Trans. Inform. Theory_ , vol. 52, no. 12, pp. 5284–5296, Dec. 2006. * [8] E. Malkamäki and H. Leib, “Coded diversity on block-fading channels,” _IEEE Trans. Inf. Theory_ , vol. 45, no. 2, pp. 771–781, Mar. 1999. * [9] D. Tse and P. Viswanath, _Fundamentals of Wireless Communications_. Cambridge University, 2005. * [10] G. Caire and D. Tuninetti, “The throughput of hybrid-ARQ protocols for the Gaussian collision channel,” _IEEE Trans. Inform. Theory_ , vol. 47, no. 4, pp. 1971–1988, Jul. 2001. * [11] R. Corless, G. Gonnet, D. Hare, D. Jeffrey, and D. Knuth, “On the LambertW function,” _Advances in Computational Mathematics_ , vol. 5, no. 1, pp. 329–359, 1996. * [12] P. J. Smith and M. Shafi, “On a Gaussian approximation to the capacity of wireless MIMO systems,” _Proc. of IEEE Int’l Conf. in Commun. (ICC’02)_ , pp. 406–410, Apr. 2002. * [13] G. Barriac and U. Madhow, “Characterizing outage rates for space-time communication over wideband channels,” _IEEE Trans. Commun._ , vol. 52, no. 4, pp. 2198–2207, Dec. 2004. * [14] P. Wu and N. Jindal, “Performance of hybrid-ARQ in block-fading channels: a fixed outage probability analysis,” _to appear at IEEE Trans. Commun._ , vol. 58, no. 4, Apr. 2010. * [15] M. S. Alouini and A. J. Goldsmith, “Capacity of Rayleigh fading channels under different adaptive transmission and diversity-combining techniques,” _IEEE Trans. Veh. Technol._ , vol. 48, no. 4, pp. 1165–1181, Jul. 1999. * [16] M. R. McKay, P. J. Smith, H. A. Suraweera, and I. B. Collings, “On the mutual information distribution of OFDM-based spatial multiplexing: exact variance and outage approximation,” _IEEE Trans. Inform. Theory_ , vol. 54, no. 7, pp. 3260–3278, Jul. 2008. * [17] D. Buckingham and M. Valenti, “The information-outage probability of finite-length codes over AWGN channels,” _42nd Annunal Conf. Inform. Sciences and Systems (CISS’08)_ , pp. 390–395, 2008. * [18] J. Laneman, “On the distribution of mutual information,” _Proc. Workshop on Information Theory and its Applications (ITA’06)_ , 2006. * [19] H. E. Gamal, G. Caire, and M. E. Damen, “The MIMO ARQ channel: diversity-multiplexing-delay tradeoff,” _IEEE Trans. Inform. Theory_ , vol. 52, no. 8, pp. 3601–3621, Aug. 2006. * [20] R. Wolff, _Stochastic Modeling and the Theory of Queues_. Prentice hall, 1989. * [21] A. Goldsmith, _Wireless Communications_. Cambridge University Press, 2005. * [22] M. Meyer, H. Wiemann, M. Renfors, J. Torsner, and J. Cheng, “ARQ concept for the UMTS Long-Term Evolution,” _IEEE 64th Vehicular Technology Conference (VTC’06)_ , pp. 1–5, Sep. 2006. * [23] H. Ekstrom, A. Furuskar, J. Karlsson, M. Meyer, S. Parkvall, J. Torsner, and M. Wahlqvist, “Technical solutions for the _3G_ long-term evolution,” _IEEE Communications Magazine_ , vol. 44, no. 3, pp. 38–45, 2006. * [24] A. Lozano and N. Jindal, “Transmit diversity v. spatial multiplexing in modern MIMO systems,” _IEEE Trans. Wireless Commun._ , vol. 9, no. 1, pp. 186–197, Jan. 2010. * [25] T. Apostol, _Mathematical Analysis_. Addison-Wesley Reading, MA, 1974. * [26] N. Kingsbury, “Approximation formula for the Gaussian error integral, Q(x),” http://cnx.org/content/m11067/latest/. Figure 1: Gooput $\eta$ (bits/symbol) vs. PHY outage probability $\varepsilon$ for $L=2,5$, $\mbox{\scriptsize\sf SNR}=10$ dB Figure 2: Optimal $\varepsilon$ vs. SNR (dB) for $L=2,5,10$ (a) $1-\varepsilon$ vs. $R_{\varepsilon}$ (bits/symbol) (b) $\eta$ (bits/symbol) vs. $R_{\varepsilon}$ (bits/symbol) Figure 3: Success probability $1-\varepsilon$ and $\eta$ (bits/symbol) vs. $R_{\varepsilon}$ (bits/symbol) for $\mbox{\scriptsize\sf SNR}=10$ dB (a) $L=2$ (b) $L=10$ Figure 4: $\eta$ (bits/symbol) vs. SNR (dB), for $\varepsilon=0.001,0.01,0.1$, and $\varepsilon^{\star}$ Figure 5: Success probability $1-\varepsilon$ vs. transmitted rate $R_{\varepsilon}$ (bits/symbol) for $n=50,200,\infty$, $L=10$ at $\mbox{\scriptsize\sf SNR}=0$ and $10$ dB Figure 6: Optimal $\varepsilon$ vs. SNR (dB) for $L=2,5,10$ and $n=200,500$ and $\infty$ Figure 7: The ARQ process with non-ideal feedback with an end-to-end delay constraint $d=3$. Figure 8: ($\varepsilon^{\star},\varepsilon_{\textrm{fb}}^{\star}$) with $L_{\textrm{fb}}=1,2$ and $5$ in Rayleigh fading feedback channel for $n=200$, $d=3$, $q=10^{-6}$, and $L=3$ at $\mbox{\scriptsize\sf SNR}=5$ and $10$ dB. The curve specifying the ($\varepsilon,\varepsilon_{\textrm{fb}}$) pairs that achieve the reliability constraint $\xi_{d}=q$ is also plotted. Figure 9: Goodput $\eta$ (bits/symbol) vs. PHY outage probability $\varepsilon$ with $L_{\textrm{fb}}=1$ and $2$ in Rayleigh fading feedback channel for $\mbox{\scriptsize\sf SNR}=5$ dB, $n=200$, $L=3$, $d=3$ and $q=10^{-6}$. Figure 10: Goodput (bits/symbol) vs. initial rate (bits/symbol) with HARQ for $M=2$ and $L=2$ and without HARQ for $M=1$ and $L=2$ at $\mbox{\scriptsize\sf SNR}=5,10$ dB.
arxiv-papers
2009-04-01T17:33:03
2024-09-04T02:49:01.604907
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Peng Wu and Nihar Jindal", "submitter": "Peng Wu", "url": "https://arxiv.org/abs/0904.0226" }
0904.0422
# Classical and quantum Cosmology of the Sáez-Ballester theory J. Socorro socorro@fisica.ugto.mx M. Sabido msabido@fisica.ugto.mx L. Arturo Ureña-López lurena@fisica.ugto.mx Departamento de Física, DCI, Campus León, Universidad de Guanajuato, C.P. 37150, Guanajuato, México ###### Abstract We study the generalization of the Sáez-Ballester theory applied to a flat FRW cosmological model. Classical exact solutions up to quadratures are easily obtained using the Hamilton-Jacobi approach. Contrary to claims in the specialized literature, it is shown that the Sáez-Ballester theory cannot provide a realistic solution to the dark matter problem of Cosmology. Furthermore the quantization procedure of the theory can be simplified by reinterpreting the theory in the Einstein frame, where the scalar field can be interpreted as part of the matter content of the theory, in this approach, exact solutions are also found for the Wheeler-DeWitt equation in the quantum regime. ###### pacs: 04.20.Fy; 04.20.Jb; 04.60.Kz; 98.80.Qc. ## I Introduction The inclusion of scalar fields into homogeneous cosmologies is a typical practice to study different scenarios, such as inflation, dark matter, and dark energyCopeland:2006wr . However, since the early seventies, the problem exists of finding the appropriate sources of matter and its corresponding Lagrangian to solve an specific scenarioryan1 ; ryan . In this respect, Saez and Ballester (SB)s-b formulated a scalar-tensor theory of gravitation in which the metric is coupled to a dimensionless scalar field in order to solve the so-called missing matter problem in Cosmology. Some works about the classical regime are already present in the literaturesingh ; shri ; mohanty ; singh-shri . In particular, in ref. singh-shri the authors consider the coupling parameter time-dependent and take a particular ansatz for mathematical convenience for solving the field equations. In spite of a the dimensionless character of the scalar field, an antigravity regime appears, and this fact has been used to suggest a new possible way to solve the missing matter problem in non-flat FRW cosmologies. On the other hand, the quantization program of the theory has yet to be made. In this paper, we shall study a generalization of the SB theory and transform it into a conventional tensor theory, where the dimensionless scalar field is interpreted as an exotic matter. We found the general behaviour for the kinetic scalar field dependent to the scale factor of the universe, but the behaviour corresponds to stiff matter and not for a dust universe, then the missing matter problem is not solved. With respect to the quantization program, in this approach we can construct the quantization program of the theory using the usual ADM formalismryan1 . Also, we can in principle quantize the theory following the Loop Quantum Cosmoloy program. In this work, we shall use this formulation to obtain classical and quantum solutions in quadratures, for the flat barotropic FRW cosmology, including a cosmological term $\lambda$. The paper is arranged as follows, In section II we write the generalization Sáez-Ballester formalism in the usual manner, that is, we calculate the corresponding energy-momentum tensor to the scalar field and give the equivalent lagrangian density. Next, we proceed to obtain the corresponding canonical lagrangian ${\cal L}_{can}$ to a flat FRW universe through the lagrange transformation, we calculate the classical hamiltonian, we also present solutions to some models. In section III, using the transformation and the Hamiltonian constraint ${\cal H}$, f we find the Wheeler-DeWitt (WDW) equation of the corresponding cosmological model under study. Section IV is devoted to conclusions and outlook. ## II Generalized Saez-Ballester theory The simplest generalization of the Sáez-Ballester theorys-b with a cosmological term is ${\cal L}_{geo}=\left(R-2\lambda-F(\phi)\phi_{,\gamma}\phi^{,\gamma}\right)\,,$ (1) where $R$ the scalar curvature, $\phi^{,\gamma}=g^{\gamma\alpha}\phi_{,\alpha}$, and $F(\phi)$ is a dimensionless and arbitrary functional of the scalar field. According to common wisdom, the Lagrangian (1) would correspond to a scalar field theory without scalar potential but with an exotic kinetic term. The complete action is then $I=\int_{\Sigma}\sqrt{-g}({\cal L}_{geo}+{\cal L}_{mat})\,d^{4}x\,,$ (2) where we have included a matter Lagrangian ${\cal L}_{mat}$, and $g$ is the determinant of metric tensor. The field equations derived from the above action are $\displaystyle G_{\alpha\beta}+g_{\alpha\beta}\lambda-F(\phi)\left(\phi_{,\alpha}\phi_{,\beta}-\frac{1}{2}g_{\alpha\beta}\phi_{,\gamma}\phi^{,\gamma}\right)$ $\displaystyle=$ $\displaystyle 8\pi GT_{\alpha\beta}\,,$ (3a) $\displaystyle 2F(\phi)\phi^{,\alpha}_{\,\,;\alpha}+\frac{dF}{d\phi}\phi_{,\gamma}\phi^{,\gamma}$ $\displaystyle=$ $\displaystyle 0\,,$ (3b) in which $G$ is the gravitational constant, and a semicolon means covariant derivative. The same set of equations(3a,3b) is obtained if we consider the scalar field $\phi$ as part of the matter budget, i.e. say $\rm{\cal L}_{\phi}=\rm F(\phi)g^{\alpha\beta}\phi_{,\alpha}\phi_{,\beta}$. In this new line of reasoning, action (2) can be rewritten as a geometrical part (Hilbert-Einstein with $\Lambda$) and matter content (usual matter plus a term that corresponds to the scalar field component of Sáez-Ballester theory), $I=\int_{\Sigma}\sqrt{-g}\left(R-2\lambda+{\cal L}_{mat}+{\cal L}_{\phi}\right)\,d^{4}x\,.$ (4) Even though the philosophy is different to that of the original SB theory, the similarity of the latter to a standard scalar field theory at the classical level will help us to infer the correspondence quantum formulation. We expect the quantum picture will also be the correct one for the SB theory, as all the formulation is based upon the same (classical) Hamiltonian constraint. Using this action we obtain the classical Hamiltonian of the generalized SB theory for a Friedmann-Robertson-Walker background. Let us start with the line element for a homogeneous and isotropic universe, $ds^{2}=-N^{2}(t)dt^{2}+a^{2}(t)\left[\frac{dr^{2}}{1-\kappa r^{2}}+r^{2}d\Omega^{2}\right]\,,$ (5) where $a(t)$ is the scale factor, $N(t)$ is the lapse function, and $\kappa$ is the curvature constant that can to take the values $0$, $1$ and $-1$, for flat, closed and open universe, respectively. The total Lagrangian density then reads ${\cal L}=\frac{6\dot{a}^{2}a}{N}-6\kappa Na+\frac{F(\phi)a^{3}}{N}\dot{\phi}^{2}+16\pi GNa^{3}\rho-2Na^{3}\lambda\,,$ (6) where $\rho$ is the matter energy density; we will assume that it complies with a barotropic equation of state of the form $p=\gamma\rho$, where $\gamma$ is a constant. The conjugate momenta are obtained from $\displaystyle\Pi_{a}$ $\displaystyle=$ $\displaystyle\frac{\partial{\cal L}}{\partial\dot{a}}=\frac{12a\dot{a}}{N},\qquad\rightarrow\qquad\dot{a}=\frac{N\Pi_{a}}{12a}\,,$ $\displaystyle\Pi_{\phi}$ $\displaystyle=$ $\displaystyle\frac{\partial{\cal L}}{\partial\dot{\phi}}=\frac{2Fa^{3}\dot{\phi}}{N}\,,\qquad\rightarrow\qquad\dot{\phi}=\frac{N\Pi_{\phi}}{2Fa^{3}}\,.$ (7) From the canonical form of the Lagrangian density (6) and the solution for the barotropic fluid equation of motion we find the Hamiltonian density for this theory ${\cal H}=\frac{a^{-3}}{24}\left[a^{2}\Pi_{a}^{2}+\frac{6}{F(\phi)}\Pi_{\phi}^{2}+144\kappa a^{4}+48a^{6}\lambda-384\pi G\rho_{\gamma}a^{3(1-\gamma)}\right],$ (8) where $\rho_{\gamma}$ is an integration constant. ### II.1 Classical solutions for flat FRW Using the transformation $\Pi_{q}=\frac{dS_{q}}{dq}$, the Einstein-Hamilton- Jacobi corresponding to Eq. (8) is $a^{2}\left(\frac{dS_{a}}{da}\right)^{2}+\frac{6}{F(\phi)}\left(\frac{dS_{\phi}}{d\phi}\right)^{2}+48a^{6}\lambda-384\pi G\rho_{\gamma}a^{3(1-\gamma)}=0\,,.$ (9) The EHJ equation can be further separated in the equations $\displaystyle\frac{6}{F(\phi)}\left(\frac{dS_{\phi}}{d\phi}\right)^{2}$ $\displaystyle=$ $\displaystyle\mu^{2}\,,$ (10) $\displaystyle a^{2}\left(\frac{dS_{a}}{da}\right)^{2}+48a^{6}\lambda-384\pi G\rho_{\gamma}a^{3(1-\gamma)}$ $\displaystyle=$ $\displaystyle-\mu^{2}\,,$ (11) where $\mu$ is a separation constant. With the help of Eqs. (7), we can obtain the solution up to quadratures of Eqs. (10) and (11), $\displaystyle\int\sqrt{F(\phi)}\,d\phi$ $\displaystyle=$ $\displaystyle\frac{\mu}{2\sqrt{6}}\int a^{-3}(\tau)\,d\tau\,,$ (12a) $\displaystyle\Delta\tau$ $\displaystyle=$ $\displaystyle\int\frac{a^{2}da}{\sqrt{\frac{8}{3}\pi G\rho_{\gamma}a^{3(1-\gamma)}-\frac{\lambda}{3}a^{6}-\nu^{2}}}\,,$ (12b) with $\nu=\frac{\mu}{12}$ Eq. (12a) readily indicates that $F(\phi)\dot{\phi}^{2}=6\nu^{2}a^{-6}(\tau)\,,$ (13) despite of the particular form of the functional $F(\phi)$. Also, this structure is directly obtained for this model solving the equation (3b). Moreover, the matter contribution of the SB scalar field to the rhs of the Einstein equations would be $\rho_{\phi}=\frac{1}{2}F(\phi)\dot{\phi}^{2}\propto a^{-6}\,.$ (14) That is, the contribution of the scalar field is the same as that of stiff matter with a barotropic equation of state $\gamma=1$. This is an interesting result, since the original SB theory was thought of as a form to solve the missing matter problem of Cosmology, now generically called the dark matter problem; to solve the latter, one needs a fluid behaving as dust with $\gamma=0$. It is surprising that such a general result remain unnoticed until now in the literature about SB. Also, that we have identified the general evolution of the scalar field with that of a stiff fluid means that the Eq. (12b) can be integrated separately without a complete solution for the scalar field. For completeness, we give below a compilation of exact solutions in the case of the original SB theory. If $F(\phi)=\omega\phi^{m}$, then we have two cases that correspond to $m=-2$ and $m\neq-2$; the general solution for the scalar field is $\phi=\left\\{\begin{tabular}[]{lr}$Exp\left[\frac{6\nu}{\sqrt{6\omega}}\int a^{-3}(\tau)d\tau\right]$&\qquad m = -2\\\ $\left[\frac{2\nu(m+2)}{\sqrt{6\omega}}\int a^{-3}(\tau)d\tau\right]^{\frac{2}{m+2}}$&\qquad$m\not=-2$\\\ \end{tabular}\right.$ (15) which can be completely integrated once the time dependence of the scale factor $a$ has been resolved. * • Stiff plus a cosmological constant, $\gamma=-1$. The master equation become $\Delta\tau=\int\frac{a^{2}da}{\sqrt{b_{-1}a^{6}-\nu^{2}}}\,,$ (16) where $b_{-1}=\frac{8}{3}\pi G\rho_{-1}-\frac{\lambda}{3}$, whose solution is $\Delta\tau=\frac{1}{3\sqrt{b_{-1}}}\,Ln\left[b_{-1}a^{3}+\sqrt{b_{-1}}\sqrt{b_{-1}a^{6}-\nu^{2}}\right]\,.$ (17) The volume function is then $a^{3}=\frac{1}{2b_{-1}}\left(e^{3\sqrt{b_{-1}}\,\Delta\tau}+b_{-1}\nu^{2}e^{-3\sqrt{b_{-1}}\,\Delta\tau}\right)\,,$ (18) whereas that of the scalar field is $\phi=\left\\{\begin{tabular}[]{lr}$Exp\left[\frac{4}{\sqrt{6\omega}}\arctan\left(\frac{Exp[3\sqrt{b_{-1}}\Delta\tau]}{\nu\sqrt{b_{-1}}}\right)\right]$&\qquad$m=-2$ \, ;\\\ $\left[\frac{2(m+2)}{\sqrt{6\omega}}\arctan\left(\frac{Exp[3\sqrt{b_{-1}}\Delta\tau]}{\nu\sqrt{b_{-1}}}\right)\right]^{\frac{2}{m+2}}$&\qquad$m\not=-2$ \, .\\\ \end{tabular}\right.$ (19) For the case $\gamma=1$ the same solutions are found and only a redefinition of the constants is needed. * • Stiff plus a cosmological constant plus dust, $\gamma=0$. In this case the master equation becomes $\Delta\tau=\int\frac{a^{2}da}{\sqrt{\frac{8}{3}\pi G\rho_{0}a^{3}-\frac{\lambda}{3}a^{6}-\nu^{2}}}$ (20) whose solution is $\Delta\tau=\frac{1}{\sqrt{3|\lambda|}}\,Ln\left[\frac{b_{0}+\frac{2|\lambda|}{3}a^{3}}{\sqrt{\frac{|\lambda|}{3}}}+2\sqrt{b_{0}a^{3}+\frac{|\lambda|}{3}a^{6}-\nu^{2}}\right]\,,$ (21) with $|\lambda|>0$ and $\rm b_{0}=\frac{8}{3}\pi G\rho_{0}$. The volume function is now $a^{3}=\frac{3}{4\sqrt{3|\lambda|}}e^{-\sqrt{3|\lambda|}\tau}\left[4\nu^{2}+\left(e^{\sqrt{3|\lambda|}\tau}-\frac{3b_{0}}{\sqrt{3|\lambda|}}\right)^{2}\right]\,.$ (22) In this way, the solution for the field $\phi$ is $\phi=\left\\{\begin{tabular}[]{lr}$Exp\left[\frac{4}{\sqrt{6\,\omega}}\arctan\left(\frac{\sqrt{3|\lambda|}Exp[\sqrt{3|\lambda|}\Delta\tau]-3b_{0}}{2\nu\sqrt{3|\lambda|}}\right)\right]$&\qquad$m=-2$ \, ;\\\ $\left[\frac{4(m+2)}{\sqrt{6\omega}}\arctan\left(\frac{\sqrt{3|\lambda|}Exp[\sqrt{3|\lambda|}\Delta\tau]-3b_{0}}{2\nu\sqrt{3|\lambda|}}\right)\right]^{\frac{2}{m+2}}$&\qquad$m\not=-2$ \, .\\\ \end{tabular}\right.$ (23) The classical solution when $\rm F(\phi)=we^{m\phi}$ have the following structure $\rm\phi(\tau)=\frac{2}{m}Ln\left[\frac{m}{2}\sqrt{\frac{6\nu^{2}}{w}}\int a^{-3}(\tau)d\tau+e^{\frac{m}{2}\phi_{0}}\right],$ (24) where the integration value must be consider the last calculations over the scale factor. The solutions above were checked to comply with the Einstein field equations encoded in equations (3b), using the REDUCE 3.8 package. ## III Quantum FRW cosmological model One of the open problem of SB is the lack of a quantum model, in this section using the generalization of the ideas presented in the previos sections we use canonical quantuization. By the usual representation for the momenta operators $\rm\Pi_{q}=-i\frac{\partial}{\partial q}$, $(\hbar=1),$ including the factor ordering problem in the $a$ and $\phi$ variables, we obtain the Wheeler-DeWitt equation $\rm\left[-a^{2}\frac{\partial^{2}}{\partial a^{2}}-qa\frac{\partial}{\partial a}-\frac{6}{F(\phi)}\frac{\partial^{2}}{\partial\phi^{2}}-\frac{6s}{F(\phi)}\phi^{-1}\frac{\partial}{\partial\phi}+144\kappa a^{4}+48a^{6}\lambda-384\pi G\rho_{\gamma}a^{3(1-\gamma)}\right]\Psi=0,$ (25) where q and s are real constants that measures the ambiguity in the factor ordering in the operators $\Pi_{a}$ and $\Pi_{\phi}$, $\Psi$ is the wave function for this cosmological model. Employing the variables separation method, $\Psi(a,\phi)={\cal A}(a){\cal B}(\phi)$, (25) gives the set of equations $\displaystyle\rm-a^{2}\frac{d^{2}{\cal A}}{da^{2}}-qa\frac{\partial{\cal A}}{\partial a}+\left(144\kappa a^{4}+48a^{6}\lambda-384\pi G\rho_{\gamma}a^{3(1-\gamma)}-\mu^{2}\right){\cal A}$ $\displaystyle=$ $\displaystyle 0,$ (26) $\displaystyle\rm\phi\frac{d^{2}{\cal B}}{d\phi^{2}}+s\frac{d{\cal B}}{d\phi}-\frac{\mu^{2}}{6}\phi F(\phi){\cal B}$ $\displaystyle=$ $\displaystyle 0.$ (27) The equation (26) does have not a general solution for any $\kappa$, then we solve for flat case and the particular values in the $\gamma$ parameter. When $\gamma=-1$, the exact solution is $\rm{\cal A}(a)=a^{\frac{1-q}{2}}\,Z_{\nu}\left(\frac{\sqrt{b}}{3}a^{3}\right),$ (28) where $\nu=\frac{1}{6}\sqrt{(1-q)^{2}-4\mu^{2}}$ and $b=384\pi G\rho_{-1}-48\lambda$. We can see that when $b>0$, the generic Bessel function $Z_{\nu}\to J_{\nu}$, and when $b<0$, $Z_{\nu}\to(K_{\nu},I_{\nu})$ Other soluble case is when $\gamma=1$, the solution is the same, and the changes appear in the constants $\mu^{2}\to 384\pi G\rho_{1}+\mu^{2}$ and $b=-48\lambda$. In this form, we obtain the exact solution to the wave function $\Psi(a,\phi)$ in this theory. For solve the equation (27), we apply this approach at Sáez-Ballester theory. The case when $m\not=-2$ polyanin is written in term of generic Bessel function $\rm Z_{\eta}$ as $\rm B(\phi)=c\phi^{\frac{1-s}{2}}Z_{\eta}\left(\frac{2\sqrt{-\xi}}{m+2}\phi^{\frac{m+2}{2}}\right),$ (29) where c is a integration constants, and $\eta=\frac{1-s}{m+2}$, $\xi=\frac{\mu^{2}\omega}{6}$. Also, we can see that the generic Bessel function $\rm Z_{\eta}\to J_{\eta}$ when $\omega<0$, or $\rm(K_{\eta},I_{\eta})$ when $\omega>0$. We can build the wave packet, introducing the continuum parameters $\eta$ and $\nu$ as $\rm\Psi_{\eta\nu}=\int_{\eta}\int_{\nu}{\cal F}(\eta){\cal G}(\nu)\phi^{\frac{1-s}{2}}Z_{\eta}\left(\frac{2\sqrt{-\xi}}{n+2}\phi^{\frac{n+2}{2}}\right)a^{\frac{1-q}{2}}\,Z_{\nu}\left(\frac{\sqrt{b}}{3}a^{3}\right)d\eta d\nu$ (30) For particular values in the constant $m$, the exact solutions are very simple. For instant when $m=-2$, we have the Euler equation who solution is $\rm B(\phi)=\phi^{\frac{1-s}{2}}\left\\{\begin{tabular}[]{lr}$\rm\left[c_{1}\phi^{\alpha}+c_{2}\phi^{-\alpha}\right]$&\qquad$(1-s)^{2}>4b$\\\ $\rm\left[c_{1}+c_{2}Ln\phi\right]$&\qquad$(1-s)^{2}=4b$\\\ $\rm\left[c_{1}sin(\alpha Ln\phi)+c_{2}cos(\alpha Ln(\phi))\right]$&\qquad$(1-s)^{2}<4b$\end{tabular}\right.$ (31) with $\alpha=\frac{1}{2}\sqrt{(1-s)^{2}-4b}$ and $b=-\frac{\omega\mu^{2}}{6}$. When $m=-6$ and $s=-1$, making the transformations $z=\phi^{-2}$ and $B=\frac{u}{z}$, leads to a constant coefficient linear equation, (27) is transformed to $4\frac{d^{2}u}{dz^{2}}-\frac{\mu^{2}\omega}{6}u=0$ who exact solutions becomes $u(z)=\left\\{\begin{tabular}[]{lr}$\rm c_{1}\,sinh\left(\sqrt{\frac{\mu^{2}\omega}{24}}z\right)+c_{2}\,cosh\left(\sqrt{\frac{\mu^{2}\omega}{24}}z\right)$&\qquad$\omega>0$\\\ $\rm c_{1}\,sin\left(\sqrt{\frac{\mu^{2}\omega}{24}}z\right)+c_{2}\,cos\left(\sqrt{\frac{\mu^{2}\omega}{24}}z\right)$&\qquad$\omega<0$\\\ \end{tabular}\right.$ (32) in the original variables ${\cal B}(\phi)=\phi^{2}\left\\{\begin{tabular}[]{lr}$\rm c_{1}\,sinh\left(\sqrt{\frac{\mu^{2}\omega}{24}}\frac{1}{\phi^{2}}\right)+c_{2}\,cosh\left(\sqrt{\frac{\mu^{2}\omega}{24}}\frac{1}{\phi^{2}}\right)$&\qquad$\omega>0$\\\ $\rm c_{1}\,sin\left(\sqrt{\frac{\mu^{2}\omega}{24}}\frac{1}{\phi^{2}}\right)+c_{2}\,cos\left(\sqrt{\frac{\mu^{2}\omega}{24}}\frac{1}{\phi^{2}}\right)$&\qquad$\omega<0$\\\ \end{tabular}\right.$ (33) ## IV conclusions We studied the generalization of the Sáez-Ballester theory by including a dimensionless functional of the scalar field $F(\phi)$. The classical dynamics of the theory were obtained from the corresponding classical Lagragian and Hamiltonian densities; the solutions were in turn given up to quadratures. One general result here is that the evolution of the scale factor of the Universe does not depend upon the particular form of the functional $F(\phi)$; actually, the contribution of the scalar field in the SB theory is that of perfect fluid with a stiff (barotropic) equation of state. If any, its contribution to the matter budget of the Universe is only relevant at early times. A separate conclusion is that the SB, whether in its original form as given in Ref.s-b or in the generalized case studied here, cannot be an answer to the dark matter riddle of Cosmology. In the quantum regime was necessary to build one equivalent density lagrangian in order to apply this, and does not possible to write this solution in closed form. In this sense, we check this approach using the original Sáez-Ballester formalism, obtaining the exact solutions in both regimes, classical and quantum for particular values in the $\gamma$ parameter. This formalism will be used with anisotropic cosmological models, which will be reported in other work. ###### Acknowledgements. This work was partially supported by CONACYT grants 47641, 56946 and 62253, DINPO 38.07 and PROMEP UGTO-CA-3. This work is part of the collaboration within the Instituto Avanzado de Cosmología. ## References * (1) E. J. Copeland, M. Sami and S. Tsujikawa, Int. J. Mod. Phys. D 15, 1753 (2006) [arXiv:hep-th/0603057]. * (2) M.P. Ryan, Hamiltonian cosmology, (Springer, Berlin, 1972). * (3) M.P. Ryan and L.C. Shepley, Homogeneous Relativistic Cosmologies, Princeton University Press, Princeton, New Jersey (1975). * (4) D. Saez and V.J. Ballester, Phys. Lett. A 113, 467 (1986). * (5) T. Singh and A.K. Agrawal, Astrophys. Space Sci. 182, 289 (1991). * (6) Shri Ram and J.K. Singh, Astrophys. Space Sci. 234, 325 (1995). * (7) G. Mohanty and S.K. Pattanaik, Theor. Appl. Mech. 26, 59 (2001). * (8) C.P. Singh and Shri Ram, Astrophys. Space Sci. 284, 1199 (2003). * (9) Andrei D. Polyanin and Valentin F. Zaitzev, in: Handbook of exact solutions for ordinary differential equations, second edition, Chapman & Hall/CRC (2003).
arxiv-papers
2009-04-02T16:27:29
2024-09-04T02:49:01.618399
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "J. Socorro, M. Sabido, and L. Arturo Ure\\~na-L\\'opez", "submitter": "Jose Socorro Garcia", "url": "https://arxiv.org/abs/0904.0422" }
0904.0430
# Sparse NonGaussian Component Analysis111Supported by DFG research center Matheon ”Mathematics for key technologies” (FZT 86) in Berlin. $\,\text{\sc Elmar Diederichs}^{1}\,$, $\,\text{\sc Anatoli Juditski}^{3}\,$, $\,\text{\sc Vladimir Spokoiny}^{2}\,$, $\,\text{\sc Christof Sch\"{u}tte}^{1}\,$ $\,{}^{1}\text{Institute for Mathematics and Informatics, Free University Berlin}\,$ Arnimallee 6, 14195 Berlin, Germany $\,{}^{2}\text{Weierstrass Institute and Humboldt University}\,$ Mohrenstr. 39, 10117 Berlin, Germany $\,{}^{3}\text{LJK, Universit\'{e} J. Fourier, }\,$ BP 53 38041 GRENOBLE cedex 9, France ###### Abstract Non-gaussian component analysis (NGCA) introduced in [24] offered a method for high dimensional data analysis allowing for identifying a low-dimensional non- Gaussian component of the whole distribution in an iterative and structure adaptive way. An important step of the NGCA procedure is identification of the non-Gaussian subspace using Principle Component Analysis (PCA) method. This article proposes a new approach to NGCA called _sparse NGCA_ which replaces the PCA-based procedure with a new the algorithm we refer to as _convex projection_. keywords: reduction of dimensionality, model reduction, sparsity, variable selection, principle component analysis, structural adaptation, convex projection Mathematical Subject Classification: 62G05, 60G10, 60G35, 62M10, 93E10 ## 1 Introduction Numerous mathematical applications in econometrics or biology are confronted with high dimensional data. Such data sets present new challenges in data analysis, since often the data have dimensionality ranging from hundreds to hundreds of thousands. This means an exponential increase of the computational burden for many methods. On the other hand the sparsity of the data in high dimensions entails that data thin out in the local neighborhood of a given point $\,x\,$. Hence statistical methods are not reliable in high dimensions if the sample size remains of the same order. This problem is usually referred to as ”curse of dimensionality” (cf. [8], [27]). The standard approach to deal with the high dimensional data is to introduce a _structural assumption_ which allows to reduce the complexity or intrinsic dimension of the data without significant loss of statistical information [19], [17]. Let a random phenomenon is observed in the high dimensional space $\,\mathbb{R}^{d}\,$ while the intrinsic dimension of this phenomenon is much smaller, say $\,m\,$. From a geometrical point of view $\,m\,$ is the dimension of a linear subspace that approximately contains the structure of the sample data. Alternatively we can consider this structure as a low dimensional signal embedded in high dimensional noise. Consequently a lower dimensional, compact representation that according to some criterion, captures the interesting information in the original data, is sought. In this paper we assume that we have a sample of data lying approximately in a $\,m\leq d\,$ dimensional linear (target) subspace $\,\mathcal{I}\subseteq\mathbb{R}^{d}\,$ of $\,\mathbb{R}^{d}\,$. In order to reduce the problem dimension one looks for a mapping from the original data space onto this subspace. In the statistical literature the Gaussian components of the data distribution are often considered as entropy maximizing and consequently as non-informative noise [5]. It is well known that for high-dimensional clouds of points most low-dimensional projections are approximately Gaussian [6]. The Non-Gaussian Component Analysis (NGCA), introduced in [24], is based on the assumption that the structure of the data is represented by a low dimensional non-Gaussian component of the observation distribution, as opposed to a full dimensional Gaussian component, considered as noise. Thus the objective of NGCA is to ”kill the noise” rather than to describe the whole multidimensional distribution. Note that the suggested way of treating the Gaussian distribution as a pure nuisance in general exclude the use of the classical _Principle Component Analysis_ (PCA) which simply searches for the directions with of largest variance. In the same way as a number of projection methods of feature extraction (e.g. Projection Pursuit [10], Partial Least Square Regression [28, 29], Conditional Minimum Average Variance Estimation [30] or Sliced Inverse Regression [15, 4, 2]), when implementing the NGCA we decompose the problem of dimension reduction into two tasks: the first one is to extract from data a set of vectors which are close to the target space $\,\mathcal{I}\,$; the second is to construct a basis of the target space from these vectors. These characteristics can also be found in the unsupervised, data driven approach of SNGCA, presented in this article. When compared to available dimension reduction methods (e.g. Principal Component Analysis [13], Independent Component Analysis [11] or Singular Spectrum Analysis [7]) SNGCA does not assume any a priori knowledge about the density of the original data. The proposed method, as well as NGCA, is an iterative algorithm which is structure adaptive in the sense that every new step essentially uses the result of previous iterations. The main difference between NGCA and SNGCA algorithms lies in the way the information is extracted from the data. The algorithm of NGCA heavily relies upon the Euclidean projection and the PCA of the set of the estimated vectors. In the case when data dimension is important and the sample size is moderate, computation of the $\,l_{2}\,$-projection can amplify the noise. Moreover, when most of the estimated vectors do not contain information about the space $\,\mathcal{I}\,$ but are mainly noise, the results of using the PCA algorithm to extract the basis of feature space can be very poor. The reason for that is that the PCA algorithm is known to accumulate the noise. To address this issue the SNGCA uses convex programming techniques to estimate elements of the target subspace by “convex projection”, what allows to bound uniformly the estimation error. Further, another technique of convex analysis, based on computation of rounding ellipsoids of the set of estimated vectors, is used to extract the subspace information. These changes allow the SNGCA algorithm to treat large families of candidate vectors without increasing significantly the variance of the estimation of the target subspace. The paper is organized as follows. First we describe the considered set-up in Section 2 and discuss the main ideas behind the proposed approach. The formal description of the algorithm is given in Section 3. A simulation study of the algorithms is presented in Section 4, where we compare the performance obtained by SNGCA algorithms and by several other methods of feature extraction. ## 2 Non-Gaussian Component Analysis ### 2.1 The setup The following setting is due to [24]. Let $\,X_{1},...,X_{N}\,$ be i.i.d. from a distribution $\,I\\!\\!P\,$ in $\,\mathbb{R}^{d}\,$. We suppose that $\,I\\!\\!P\,$ possesses a density $\,\rho\,$ with respect to the Lebesgue measure on $\,\mathbb{R}^{d}\,$, which can be decomposed as follows: $\displaystyle\rho(x)=\phi_{\mu=0,\Sigma}(x)q(Tx).$ (2.1) Here $\,\phi_{\mu,\Sigma}\,$ stands for the density of the multivariate normal distribution $\,\mathcal{N}(\mu,\Sigma)\,$ with parameters $\,\mu\in\mathbb{R}^{d}\,$ (expectation) and $\,\Sigma\in\mathbb{R}^{d\times d}\,$ positive definite (covariance matrix). The function $\,q:\mathbb{R}^{m}\to\mathbb{R}\,$ with $\,m\leq d\,$ has to be nonlinear and smooth. $\,T\in\mathbb{R}^{m\times d}\,$ is an unknown linear mapping. Naturally, we refer to $\,\mathcal{I}={\rm range}\;T\,$ as target or non- Gaussian subspace. For the sake of simplicity let us assume $\,I\\!\\!E[X]=0\,$ where $\,I\\!\\!E[X]\,$ stands for the expectation of $\,X\,$. Though the representation (2.1) is not uniquely defined, the subspace $\,\mathcal{I}\subset\mathbb{R}^{d}\,$ is well defined as well as the Euclidean projector $\,\Pi^{*}\,$ on $\,\mathcal{I}\,$. By analogy with the regression case [4, 16, 15], we could also call $\,\mathcal{I}\,$ the effective dimension reduction space (EDR-space). We call $\,m\,$ effective dimension of the data. In many applications $\,m\,$ is unknown and has to be recovered from the data. Our task is to recover $\,\Pi^{*}\,$. The model structure (2.1) allows the following interpretation (cf. [24]) : we can decompose the random vector $\,X\,$ into two independent components $\displaystyle X=\Pi^{*}X+(I-\Pi^{*})X=Z+u,$ where $\,Z\,$ is a non-Gaussian $\,m\,$-dimensional signal and $\,u\,$ is $\,(d-m)\,$-dimensional normal noise. As we have already noticed in the introduction, SNGCA algorithm relies upon two basic operations: the first is to construct a set of vectors, say $\,\beta_{1},...,\beta_{J}\,$, which are ”close” to the target subspace; the objective of the second is to compute an estimate $\,\widehat{\Pi}\,$ of the Euclidean projector $\,\Pi^{*}\,$ on $\,\mathcal{I}\,$ using the set $\,\\{\beta_{j}\\}_{j=1}^{J}\,$. ### 2.2 Estimation of elements of the target subspace Estimation of elements of $\,\mathcal{I}\,$. The implementation of the first step of SNGCA is based on the following result (cf. Theorem 1 of [24]): ###### Theorem 1. Let $\,X\,$ follow the distribution with the density $\,\rho\,$ which satisfies (2.1) and let $\,I\\!\\!E[X]=0\,$. Suppose that a function $\,\psi:\,\mathbb{R}^{d}\to\mathbb{R}\,$ is continuously differentiable. Define $\displaystyle\beta(\psi):=I\\!\\!E\bigl{[}\nabla\psi(X)\bigr{]}=\int\nabla\psi(x)\,\rho(x)\,dx,$ (2.2) where $\,\nabla\psi\,$ stands for the gradient of $\,\psi\,$. Then there exists a vector $\,\beta\in\mathcal{I}\,$ such that $\displaystyle\|\beta(\psi)-\beta\|_{2}$ $\displaystyle\leq$ $\displaystyle\big{\|}\Sigma^{-1}I\\!\\!E[X\psi(X)]\big{\|}_{2}$ $\displaystyle=$ $\displaystyle\Big{\|}\Sigma^{-1}\int x\psi(x)\rho(x)\;dx\Big{\|}_{2}.$ In particular, if $\,I\\!\\!E[X\psi(X)]=0\,$, then $\,\beta(\psi)\in\mathcal{I}\,$. The bound of Theorem 1 implies that $\displaystyle\|(I-\Pi^{*})\beta(\psi)\|_{2}\leq\Big{\|}\Sigma^{-1}\int x\psi(x)\rho(x)\;dx\Big{\|}_{2},$ (2.3) where $\,I\,$ is the $\,d\,$-dimensional identity matrix and $\,\Pi^{*}\,$ is the orthogonal projector on $\,\mathcal{I}\,$. Based on this result, [24] suggested the following way of constructing a set of vectors $\,\beta\,$ which approximate the target space $\,\mathcal{I}\,$. Let $\,h_{1},...,h_{L}\,$ be smooth bounded functions on $\,\mathbb{R}^{d}\,$. Define $\,\gamma_{l}=I\\!\\!E[Xh_{l}(X)]\,$ and $\,\eta_{l}=I\\!\\!E[\nabla h_{l}(X)]\,$. These vectors are not computable because they rely on the unknown data distribution, but they can be well estimated from the given data. Next, for any vector $\,c\in\mathbb{R}^{L}\,$, define the vectors $\,\beta(c),\gamma(c)\in\mathbb{R}^{d}\,$ with $\displaystyle\beta(c)=\sum_{l=1}^{L}c_{l}\eta_{l},\qquad\gamma(c)=\sum_{l=1}^{L}c_{l}\gamma_{l}$ Then by Theorem 1, $\,\beta(c)\in\mathcal{I}\,$ conditioned that $\,\gamma(c)=0\,$. Indeed, if we set $\,\psi(x)=\sum_{l}c_{l}h_{l}(x)\,$, then $\,I\\!\\!E[X\psi(X)]=0\,$, and by (2.3), $\gamma(c)=I\\!\\!E[\nabla\psi(X)]\in\mathcal{I}.$ The approach of [24] is to compute the vectors of coefficients $\,c\in\mathbb{R}^{L}\,$ which ensure $\,\gamma(c)\approx 0\,$ and then to use the corresponding empirical analogs of $\,\beta(c)\,$ to estimate the target space. More precisely, given the observations $\,X_{1},...,X_{N}\,$ compute the set of vectors (empirical counterparts of $\,\eta_{l}\,$ and $\,\gamma_{l}\,$) according to $\displaystyle\widehat{\gamma}_{l}=N^{-1}\sum_{i=1}^{N}X_{i}h_{l}(X_{i}),\quad\widehat{\eta}_{l}=N^{-1}\sum_{i=1}^{N}\nabla h_{l}(X_{i}).\qquad$ (2.4) Similarly define for $\,c\in\mathbb{R}^{L}\,$ $\displaystyle\widehat{\beta}(c)=\sum_{l=1}^{L}c_{l}\widehat{\eta}_{l},\qquad\widehat{\gamma}(c)=\sum_{l=1}^{L}c_{l}\widehat{\gamma}_{l}\,.$ One can expect that for vectors $\,c\,$ with $\,\widehat{\gamma}(c)=0\,$, the vectors $\,\widehat{\beta}(c)\,$ are ”close” to $\,\mathcal{I}\,$. Below we follow a similar way of constructing $\,\widehat{\beta}(c)\,$ with an additional constraint that the considered vectors of coefficients $\,c\,$ satisfy $\,\|c\|_{1}\leq 1\,$. This constraint allows for both efficient numerical algorithms and sharp error bounds. The test functions $\,h_{l}\,$ can be generated as follows: let $\,\mathcal{B}_{d}\,$ be a unit ball $\,\mathcal{B}_{d}=\\{x\in\mathbb{R}^{d}|:\,\|x\|_{2}\leq 1\\}\,$ and let $\,f(x,\omega)\,$, $\,f:\,\mathcal{B}\times\mathbb{R}^{d}\to\mathbb{R}\,$ be a continuously differentiable function. Consider the functions $\,h_{l}(x)=f(x,\omega_{l})\,$, for some $\,\omega_{l}\in\mathcal{B},\;l=1,...,L\,$. The choice of family $\,f(\cdot,\omega)\,$ is an important parameter of the algorithm design. For instance, in the simulation examples of Section 4 we consider the following families: $\displaystyle f(x,\omega)$ $\displaystyle=$ $\displaystyle\tanh(\omega^{\top}x)e^{-\alpha\|x\|^{2}_{2}/2},$ (2.5) $\displaystyle f(x,\omega)$ $\displaystyle=$ $\displaystyle[1+(\omega^{\top}x)^{2}]^{-1}\exp^{\omega^{\top}x-\alpha\|x\|^{2}_{2}/2},$ (2.6) and $\,\omega_{l},\;l=1,...,L\,$ are unit vectors in $\,\mathbb{R}^{d}\,$. The next result justifies the proposed construction. ###### Theorem 2. Suppose that $\,f\,$ is continuously differentiable in $\,w\,$ and for some fixed constant $\,f^{*}_{1}\,$ and any $\,\omega\in\mathcal{B}_{d},\,x\in\mathbb{R}^{d}\,$ $\displaystyle\operatorname{Var}\bigl{[}X_{j}\,f(X,\omega)\bigr{]}\leq f^{*}_{1},\quad\operatorname{Cov}\bigl{[}X_{j}\,\nabla_{\omega}f(X,\omega)\bigr{]}\leq f^{*}_{1}I,$ $\displaystyle\operatorname{Var}\biggl{[}\frac{\partial}{\partial x_{j}}f(X,\omega)\biggr{]}\leq f^{*}_{1},\quad\operatorname{Cov}\biggl{[}\nabla_{\omega}\frac{\partial}{\partial x_{j}}f(X,\omega)\biggr{]}\leq f^{*}_{1}I,$ Consider the (random) set $\displaystyle\mathscr{C}=\bigl{\\{}c\in\mathbb{R}^{L}:\|c\|_{1}\leq 1,\,\widehat{\gamma}(c)=0\bigr{\\}}.$ (2.7) Then for any $\,\varepsilon>0\,$ there is a set $\,A\subset\Omega\,$ of probability at least $\,1-\varepsilon\,$ such that on $\,A\,$ for all $\,c\in\mathscr{C}\,$, $\bigl{\|}(I-\Pi^{*})\widehat{\beta}(c)\bigr{\|}_{2}\leq\sqrt{d}\,\delta_{N}\bigl{(}1+\|\Sigma^{-1}\|_{2}\bigr{)},$ where $\displaystyle\delta_{N}=N^{-1/2}\inf_{\lambda\leq\lambda^{*}_{1}N^{1/2}}\bigl{\\{}5\mathfrak{n}_{0}f^{*}_{1}\lambda+2\lambda^{-1}\bigl{[}\mathfrak{e}_{d}+\log(2d/\varepsilon)\bigr{]}\bigr{\\}}$ and $\,\mathfrak{e}_{d}=4d\log 2\,$. The proof of the theorem is given in the appendix. Due to this result, any vector $\,c\in\mathscr{C}\,$ can be used to produce a vector $\,\widehat{\beta}(c)\,$ which is close to the target subspace $\,\mathcal{I}\,$. However, such constructed vectors are only informative if its length is significant relative to the estimation error. We therefore compute a family of such coefficient vectors $\,c\,$ by solving the following optimization problems: for a fixed unit vector $\,\xi\in\mathbb{R}^{d}\,$ called a _probe vector_ , find $\displaystyle\widehat{c}=\operatorname*{\mathrm{arg\,min}}_{c\in\mathbb{R}^{L}:\,\|c\|_{1}\leq 1}\|\xi-\widehat{\eta}(c)\|_{2},\mbox{ subject to }\widehat{\gamma}(c)=0.$ (2.8) where $\,\widehat{\eta}(c)=\sum_{l}c_{l}\widehat{\eta}_{l}\,$. This is a convex optimization problem which can be efficiently solved by some numerical procedures, e.g. by the interior point method. Then we set $\displaystyle\widehat{\beta}=\widehat{\beta}(\widehat{c})=\sum_{l}\widehat{c}_{l}\widehat{\eta}_{l}\,.$ (2.9) It can be easily seen that for $\,\xi\perp\mathcal{I}\,$, the solution $\,\widehat{\beta}\,$ fulfills $\,\widehat{\beta}\approx 0\,$. On the contrary, if $\,\xi\in\mathcal{I}\,$, then there is a solution with significantly positive $\,\|\widehat{c}\|_{1}\,$ and $\,\|\widehat{\beta}(\widehat{c})\|_{2}\,$. This leads to the following strategy: In the first step of the algorithm when there is no information about $\,\mathcal{I}\,$ available, the probe vectors $\,\xi_{1},...,\xi_{J}\,$ in $\,\mathbb{R}^{d}\,$ are generated randomly from $\,\mathcal{B}_{d}\,$. In the next steps we apply the idea of structural adaptation by generating the essential part of the vectors $\,\xi_{j}\,$ from the estimated subspace $\,\widetilde{\mathcal{I}}\,$. For details see Section 3. We address now the implementation of the second step of SNGCA – inferring the projector $\,\Pi^{*}\,$ on $\,\mathcal{I}\,$ from estimations $\,\\{\widehat{\beta}_{j}\\}_{j=1}^{J}\,$ of elements of $\,\mathcal{I}\,$. Recovering the target subspace. Suppose that we are given vectors $\,\widehat{\beta}_{1},...,\widehat{\beta}_{J}\,$ which satisfy $\|\widehat{\beta}_{j}-\beta_{j}\|_{2}\leq\varrho,$ for some $\,\beta_{j}\in\mathcal{I}\,$, $\,j=1,...,J\,$. The problem of estimating the subspace $\,\mathcal{I}\,$ from $\,\widehat{\beta}_{j}\,$ is a special case of the so called _Reduced Rank Regression_ (RRR) problem. A simple and popular PCA estimate of the projector $\,\Pi^{*}\,$ on $\,\mathcal{I}\,$ is given by solving the quadratic optimization problem $\displaystyle\widehat{\Pi}=\operatorname*{\mathrm{arg\,min}}_{\Pi_{m}}\,\sum_{j=1}^{J}\|(I-\Pi_{m})\widehat{\beta}_{j}\|_{2}^{2},$ where the minimum is taken over all projectors of rank $\,m\,$. One can easily verify that $\,\widehat{\Pi}\,$ projects on the subspace in $\,\mathbb{R}^{d}\,$ generated by the first $\,m\,$ principal eigenvectors of the matrix $\,\sum_{j}\widehat{\beta}_{j}\widehat{\beta}_{j}^{\top}\,$. However, if the number of informative vectors $\,\widehat{\beta}_{j}\,$ is small with respect to $\,J\,$, the quality of estimate $\,\widehat{\Pi}\,$ can be extremely poor. To address this drawback of the PCA solution we consider a sparse estimate of $\,\mathcal{I}\,$ which uses rounding ellipsoids for the set $\,\\{\widehat{\beta}_{j}\\}_{j=1}^{J}\,$. For a symmetric positive-definite matrix $\,B\,$ and $\,r>0\,$, the ellipsoid $\,\mathcal{E}_{r}(B)\,$ is defined as $\mathscr{E}_{r}(B)=\\{x\in\mathbb{R}^{d}\mid x^{\top}Bx\leq r^{2}\\},$ For $\,\alpha\leq 1\,$,$\,\mathcal{E}(B)\equiv\mathscr{E}_{1}(B)\,$ is $\,\alpha\,$-_rounding_ ellipsoid for a convex set $\,\mathscr{S}\,$ if $\mathcal{E}_{1/\alpha}(B)\subseteq\mathscr{S}\subseteq\mathcal{E}(B).$ Note that such ellipsoid exists with $\,\alpha=d^{-1/2}\,$ due to the Fritz John theorem [12]. Furthermore, numerically efficient algorithms for computing $\,\sqrt{d}\,$-rounding ellipsoids are available, see e.g. [18]. So, for recovering the spatial information from the vector system $\,\\{\pm\widehat{\beta}_{j}\\}_{j=1}^{J}\,$ one can look for the $\,d^{1/2}\,$ rounding ellipsoid for the convex hull $\,\mathscr{S}\,$ of points $\,\\{\pm\widehat{\beta}_{j}\\}_{j=1}^{J}\,$. We measure the quality of estimation of the subspace $\,\mathcal{I}\,$ by the closeness of the estimated projector $\,\widehat{\Pi}\,$ to $\,\Pi^{*}\,$: $\displaystyle\varepsilon(\mathcal{I},\widehat{\mathcal{I}})=\|\widehat{\Pi}-\Pi^{*}\|_{2}^{2}=\mathrm{Tr}\bigl{[}(\widehat{\Pi}-\Pi^{*})^{2}\bigr{]}.$ (2.10) The property of the spatial information recovery, based on the idea of rounding ellipsoids, is described in the following theorem. ###### Theorem 3. 1\. Let $\,\mathscr{S}\,$ be the convex envelope of the set $\,\\{\pm\widehat{\beta}_{j}\\},\;j=1,...,J\,$, and let $\,\mathscr{E}_{1}(B)\,$ be an ellipsoid inscribed into $\,\mathscr{S}\,$, such that $\,\mathscr{E}_{\sqrt{d}}(B)\,$ is $\,\sqrt{d}\,$-rounding ellipsoid for $\,\mathscr{S}\,$. Then for any unit vector $\,v\perp\mathcal{I}\,$, $v^{\top}B^{-1}v\leq\varrho^{2}.$ 2\. If there is $\,\mu\in\mathbb{R}^{J}\,$ with $\,\mu_{j}\geq 0\,$ and $\,\sum_{j}\mu_{j}=1\,$ such that $\lambda_{m}\biggl{(}\sum_{j}\mu_{j}\beta_{j}\beta_{j}^{\top}\biggr{)}\geq\lambda^{*}>2\varrho^{2},$ where $\,\lambda_{m}(A)\,$ stands for the $\,m\,$-th principal eigenvalue of $\,A\,$, then $\displaystyle\lambda_{m}(B^{-1})\geq\frac{\lambda^{*}-2\varrho^{2}}{2\sqrt{d}}\,.$ (2.11) 3\. Moreover, let $\,\widehat{\Pi}=\widehat{\Gamma}_{m}\widehat{\Gamma}_{m}^{\top}\,$ where $\,\Gamma_{m}\,$ is the matrix of $\,m\,$ principal eigenvectors of $\,B^{-1}\,$. Then $\|\widehat{\Pi}-\Pi^{*}\|_{2}^{2}\leq\frac{4\varrho^{2}d\sqrt{d}}{\lambda^{*}-2\varrho^{2}}.$ The proof of the theorem is presented in the appendix. The results of Theorems 2 and 3 provide a kind of theoretical justification for the algorithms, presented in the next section. Indeed, suppose that the test functions $\,h_{1},...,h_{L}\,$ and the vectors $\,\xi_{1},...,\xi_{J}\,$ are chosen in such a way that there are at least $\,m\,$ vectors with ”significant” projection on $\,\mathcal{I}\,$ among $\,\widehat{\beta}_{1},...,\widehat{\beta}_{J}\,$ as in (2.9). Then the projector estimate $\,\widehat{\Pi}\,$, computed using the ellipsoid $\,\mathcal{E}(B)\,$ which is rounding for the set $\,\\{\pm\widehat{\beta}_{j}\\}\,$, with high probability will be close to $\,\Pi^{*}\,$. However, the results about the estimation quality depend critically on the dimension $\,d\,$. Numerical results also indicate that with growing dimension, the fraction of non-informative vectors $\,\widehat{\beta}_{j}\,$ increases leading to the situation when some of the longest semi-major axis of $\,\mathcal{E}_{\sqrt{d}}\,$ are also non-informative and nearly orthogonal to $\,\mathcal{I}\,$. This enforces us to introduce an additional check of non- normality for the directions suggested by the estimated ellipsoid $\,\mathcal{E}\,$. Identifying the non-Gaussian subspace by statistical tests: Currently the estimation procedure of the vectors $\,\beta(\psi_{h,c})\,$ itself does not allow the identification of the semi-axis within the target space. Hence the basic idea is to apply statistical tests on normality w.r.t. the significance level $\,\alpha\,$ to the original data from $\,\mathbb{R}^{d}\,$ projected on every semi-axis of $\,\mathcal{E}_{\sqrt{d}}\,$. If the hypothesis of normality is rejected w.r.t. the projected data, the corresponding semi-axis is used as a basis vector for the reduced target space $\,\mathcal{I}\,$. Structural adaptation: At the beginning of the algorithm, we have no prior information about $\,\mathcal{I}\,$ and therefore sample the directions $\,\xi_{j}\,$ and $\,\omega_{l}\,$ randomly from the uniform law. However, the SNGCA procedure assumes that the obtained estimated structure $\,\widehat{\mathcal{I}}\,$ delivers some information about $\,\mathcal{I}\,$ which can be used for improving the sample mechanism and therefore, the final quality of estimation. This leads to the _structurally adaptation_ iterative procedure [9]: the step of estimating the vectors $\,\\{\widehat{\beta}_{j}\\}_{j=1}^{J}\,$ and the step of estimating subspace $\,\mathcal{I}\,$ are iterated, the estimated structural information given by $\,\widehat{\mathcal{I}}\,$ is used to improve the quality of estimating the vectors $\,\widehat{\beta}_{j}\,$ in the next iteration of SNGCA. In our implementation, we sample a fraction of directions $\,\xi_{j}\,$ and $\,\omega_{l}\,$ due to the previously estimated ellipsoid $\,\widehat{B}\,$ and the other part randomly. However the number of the randomly selected directions remains constant during iteration. In the next section we present the formal description of SNGCA. ## 3 Algorithms This section describes the principal steps of the procedure. The detailed description is given in the Appendix. ### 3.1 Normalization As a preprocessing step the SNGCA procedure uses a componentwise normalization of the data. Let $\,\sigma=(\sigma_{1},\ldots\sigma_{d})\,$ be the standard deviations of the data components of $\,x_{1},\ldots,x_{d}\,$. For $\,i=1,\ldots,N\,$ the componentwise normalization of the data is done by $\,Y_{i}=\mathrm{diag}(\sigma^{-1})X_{i}\,$. ### 3.2 Estimation of the vectors from non-Gaussian subspace: Let $\,\\{\omega_{jl}\\}\,$, $\,l=1,\ldots,L\,$, and $\,\\{\xi_{j}\\}\,$, $\,j=1,\ldots,J\,$ be two collections of unit vectors called the measurement directions. Define for all $\,j=1,\ldots,J\,$ and $\,l\leq L\,$, the functions $\,h_{jl}(x)=f(x,\omega_{jl})\,$, and compute the vectors $\,\widehat{\gamma}_{jl}\,$ and $\,\widehat{\eta}_{jl}\,$ due to (2.4). Next, for every $\,j\leq J\,$, compute the vector $\,\widehat{c}_{j}\,$ by solving the problem (2.8) with $\,\xi=\xi_{j}\,$ leading to the vector $\,\widehat{\beta}_{j}\,$ by (2.9). ### 3.3 Computing the estimator $\,\widehat{\Pi}\,$ of the projector $\,\Pi^{*}\,$ The projector $\,\widehat{\Pi}\,$ is constructed on the base of the first $\,m\,$ principal eigenvectors of the rounding ellipsoid $\,\mathcal{E}\,$ for the set $\,\mathscr{S}\,$ spanned by the vectors $\,\pm\widehat{\beta}_{j}\,$, $\,j=1,\ldots,J\,$. To build the ellipsoid $\,\mathcal{E}\,$ we use the algorithm in [18] which in fact computes the minimum volume ellipsoid (MVEE) which covers $\,\mathscr{S}\,$. For convenience we provide the algorithm in the appendix. ### 3.4 Building the subspace $\,\widehat{\mathcal{E}}\,$ using statistical tests In order to construct the projector $\,\widehat{\Pi}\,$ the identification of the $\,m\,$ principal eigenvectors of $\,\mathcal{E}\,$ that approximate $\,\mathcal{I}\,$ is required. In projecting the data onto the semi-axis of $\,\mathcal{E}\,$ and testing the projected data on normality the projective approach from the estimation step is repeated. Since statistical tests specialized for a certain deviation from the normal distribution, are more powerful, we use different tests inside of SNGCA in order to cope with different deviations from normality of the projected data. To be more precise we use the $\,K^{2}\,$-test according to D’Agostino-Pearson [31] to identify a significant asymmetry in the projected distribution and the EDF-test according to Anderson-Darling [1] with the modification of Stephens [25], which is sensitive to the tails of the projected distribution. In order to confirm these test results from above we use the Shapiro-Wilks test [22] based on a regression strategy in the version given by Royston [20, 21]. Once we have classified the semi-axis of $\,\mathcal{E}_{\sqrt{d}}\,$ as being close to the target space we can use the identified subset of axis in the structural adaptation step. ### 3.5 Structural Adaptation The first step of the algorithm assumes that the measurement directions $\,\omega_{jl}\,$ and $\,\xi_{j}\,$ are drawn randomly from the unit sphere in $\,\mathbb{R}^{d}\,$. At each further step of the algorithm we can use the result of the previous iterations of SNGCA in order to accumulate information about $\,\mathcal{I}\,$ in a sequence $\,\widehat{\mathcal{I}}_{1},\widehat{\mathcal{I}}_{2},\ldots\,$ of estimators of the target space. This information is used to draw a fraction of the measurement directions from the estimated subspaces and the other part of such direction is selected randomly. The procedure is described in detail in algorithm 7. ### 3.6 The stopping criterion Suppose that $\,\mathcal{I}\,$ is a priori given. Then the convergence of SNGCA can be measured according to the criterion (2.10). More precisely we assume convergence if the improvement of the error measured by (2.10) from one iteration to the next one is less than $\,\delta\,$ percent of the error in the former iteration. To this end the maximum angle $\,\theta\,$ between the subspaces specified by the matrix of eigenvectors $\,V^{(k)}=\big{[}\widehat{v}_{1}^{(k)},\widehat{v}_{2}^{(k)},\ldots\big{]}\,$ and $\,V^{(k+1)}=\big{[}\widehat{v}_{1}^{(k+1)},\widehat{v}_{2}^{(k+1)},\ldots\big{]}\,$ given by $\displaystyle\cos(\theta)=\max_{x,y}\frac{|x^{\top}V^{(k)^{\top}}V^{(k+1)}y|}{\|V^{(k)}x\|_{2}\;\|V^{(k+1)}y\|_{2}}$ is computed. In the next section we demonstrate the improvement of the estimation error between subsequent iterations of SNGCA. ## 4 Numerical results The aim of this section is to compare SNGCA with other statistical methods of dimension reduction. The reported results from Projection Pursuit (PP) and NGCA were already published in [24]. ### 4.1 Synthetic Data Each of the following test data sets includes $\,1000\,$ samples in $\,10\,$ dimension and each sample consists of $\,8\,$-dimensional independent, standard and homogeneous Gaussian distributions. The other $\,2\,$ components of each sample are non-Gaussian with variance unity. The densities of the non- Gaussian components are chosen as follows: * (A) Gaussian mixture: $\,2\,$-dimensional independent Gaussian mixtures with density of each component given by $\,0.5\;\phi_{-3,1}(x)+0.5\;\phi_{3,1}(x)\,$. * (B) Dependent super-Gaussian: $\,2\,$-dimensional isotropic distribution with density proportional to $\,\exp(-\|x\|)\,$. * (C) Dependent sub-Gaussian: $\,2\,$-dimensional isotropic uniform with constant positive density for $\,\|x\|_{2}\leq 1\,$ and $\,0\,$ otherwise. * (D) Dependent super- and sub-Gaussian: $\,1\,$-dimensional Laplacian with density proportional to $\,\exp(-|x_{Lap}|)\,$ and $\,1\,$-dimensional dependent uniform $\,\mathcal{U}(c,c+1)\,$, where $\,c=0\,$ for $\,|x_{Lap}|\leq\log(2)\,$ and $\,c=-1\,$ otherwise. * (E) Dependent sub-Gaussian:$\,2\,$-dimensional isotropic Cauchy distribution with density proportional to $\,\lambda(\lambda^{2}-x^{2})^{-1}\,$ where $\,\lambda=1\,$. That means, that the non-normal distributed data are located in a linear subspace. In the sequel we compare SNGCA with PP and NGCA using the test data sets from above and the estimation error defined in (2.10). Each simulation is repeated $\,100\,$ times. All simulations are done with the hyperbolic tangent index as in (2.5). Since the speed of convergence varies with the type of non-Gaussian components we use the maximum number $\,maxIter=3\log(d)\,$ of allowed iterations to stop SNGCA. In the experiments the error measure $\,\epsilon(\mathcal{I},\widehat{\mathcal{I}})\,$ is used only to determine the final estimation error. All simulations other than whose w.r.t. model (C) are computed with a componentwise pre-normalization. | ---|--- (A) | (B) | (C) | (D) | (E) | Figure 4.1: densities of the non-Gaussian components: (A) $\,2\,$d independent Gaussian mixtures, (B) $\,2\,$d isotropic super-Gaussian, (C) $\,2\,$d isotropic uniform and (D) dependent $\,1\,$d Laplacian with additive $\,1\,$d uniform, (E) $\,2\,$d isotropic sub-Gaussian Figure 4.1 illustrates the densities of the non-Gaussian components of the test data. For all numerical experiments reported in this article the dimension of the target space $\,\mathcal{I}\,$ is a priori given as a tuning parameter for the algorithm. Since the optimizer used in PP tends to trap in a local minima in each of the 100 simulations, PP is 10 times restarted with random starting points. The best result w.r.t. (2.10) is reported as the result of each PP-simulation. In all PP-simulations the number of non-Gaussian dimensions is a priori given. In the next figure 4.2 we present boxplots of the error (2.10) obtained from the methods PP, NGCA and SNGCA. | ---|--- (A) | (B) | (C) | (D) | (E) | Figure 4.2: performance comparison in $\,10\,$ dimensions of PP and NGCA versus SNGCA (wrt. the error criterion $\,\mathcal{E}(\widehat{\mathcal{I}},\mathcal{I})\,$ ) using the index $\,tanh(x)\,$. The doted line denotes the mean, the solid lines the variance of (2.10). Concerning the results of SNGCA on the data sets (A) and (D) we observe a slightly inferior performance compared to NGCA. In case of model (A) this is due to the fact that most of the data projections have almost a Gaussian density. Consequently the decrease of the estimation error is slow with increasing number of iterations. In case of the model (D) the higher variance of the results indicate that the initial sampling of the data sets gives a poor result. Consequently more iterations are needed to get an estimation error that is comparable to the result of NGCA. In order to illustrate this interpretation we report in table (4.1) the progress of SNGCA w.r.t. estimation error $\,\varepsilon(\mathcal{I},\widehat{\mathcal{I}})\,$ in each iteration for every test model. | $\,j\,$ | $\,\mu_{\epsilon}\,$ | $\,\sigma^{2}_{\epsilon}\,$ ---|---|--- 1 | 0.232504 | 0.045787 2 | 0.163022 | 0.072263 3 | 0.066537 | 0.032436 4 | 0.009380 | 0.021975 5 | 0.002359 | 0.000853 | $\,j\,$ | $\,\mu_{\epsilon}\,$ | $\,\sigma^{2}_{\epsilon}\,$ ---|---|--- 1 | 0.30350 | 0.175313 2 | 0.144430 | 0.057856 3 | 0.088142 | 0.015168 4 | 0.041420 | 0.008197 5 | 0.026436 | 0.000917 (A) | (B) | $\,j\,$ | $\,\mu_{\epsilon}\,$ | $\,\sigma^{2}_{\epsilon}\,$ ---|---|--- 1 | 0.040556 | 0.004215 2 | 0.016012 | 0.002441 3 | 0.012427 | 0.001105 4 | 0.008874 | 0.000169 5 | 0.003770 | 0.000125 | $\,j\,$ | $\,\mu_{\epsilon}\,$ | $\,\sigma^{2}_{\epsilon}\,$ ---|---|--- 1 | 0.203419 | 0.044672 2 | 0.023023 | 0.000314 3 | 0.019960 | 0.000211 4 | 0.012709 | 0.000197 5 | 0.009343 | 0.000127 (C) | (D) | $\,j\,$ | $\,\mu_{\epsilon}\,$ | $\,\sigma^{2}_{\epsilon}\,$ ---|---|--- 1 | 0.2762e-3 | 0.1371e-6 2 | 0.0450e-3 | 0.0031e-6 3 | 0.0416e-3 | 0.0033e-6 4 | 0.0360e-3 | 0.0014e-6 5 | 0.0287e-3 | 0.0024e-6 (E) | Table 4.1: Progress of SNGCA for test models in $\,10\,$ dimensions with increasing number $\,j\,$ of iterations. The empirical mean of the error $\,\mathcal{E}(\widehat{\mathcal{I}},\mathcal{I})\,$ defined in (2.10) is denoted by $\,\mu_{\epsilon}\,$ and $\,\sigma^{2}_{\epsilon}\,$ is its empirical variance. Illustration of one-step-improvement: We shall now illustrate the iterative gain of information about the EDR space. To this end we use the projection of $\,\widehat{\beta}_{j}\,$ to the EDR-space in order to demonstrate, how the algorithm works. Figure 4.3 shows that $\,dist(\widehat{\beta},\widehat{\mathcal{I}})\,$ decreases with increasing number of iterations. We observe, that estimators $\,\widehat{\beta}\,$ with higher norm tend to be close to $\,\mathcal{I}\,$. Nevertheless, this can not be assured for much higher dimensions. Moreover the improvement in each iteration depends on the size of the sampling of measurement directions. Figure 4.3: illustrative plots of SNGCA applied to toy 20 dimensional data of type (C) (see section 4): We show $\,\|\widehat{\beta}\|\,$ vs. $\,\cos(\theta(\widehat{\beta},\mathcal{I}))\,$ for different iterations of the algorithm where $\,\mathcal{I}\,$ is the a priori known EDR-space. | ---|--- (A) | (B) | (C) | (D) | (E) | Figure 4.4: results wrt. $\,\mathcal{E}(\widehat{\mathcal{I}},\mathcal{I})\,$ with deviations of Gaussian components following a geometrical progression on $\,[10^{-r},10^{r}]\,$ where $\,r\,$ is the parameter on the abscissa) . Now let us switch to the question of robustness of the estimation procedure with respect to a bad conditioning of the covariance matrix $\,\Sigma\,$ of the data. In figure 4.4 we consider the same test data sets as above. The non- Gaussian coordinates always have unity variance, but the standard deviation of the $\,8\,$ Gaussian dimensions now follows the geometrical progression $\,10^{-r},10^{-r+2r/7},\ldots,10^{r}\,$ where $\,r=1,\ldots,8\,$. Again we apply a componentwise normalization procedure to the data from the models (A), (B), (D), (E). We observe that the condition of the covariance matrix heavily influences the estimation error for the methods NGCA and PP(tanh). In comparison SNGCA is independent of differences in the noise variance along different directions in most cases. Only the detection of the uniform distribution by SNGCA is influenced by the condition of $\,\Sigma\,$. | ---|--- (A) | (B) | (C) | (D) | (E) | Figure 4.5: results wrt. $\,\mathcal{E}(\widehat{\mathcal{I}},\mathcal{I})\,$ with increasing number of gaussian components. Figure 4.5 compares the behavior of SNGCA with PP and NGCA as the number of standard and homogeneous Gaussian dimensions increases. As described above we use the test models with $\,2\,$-dimensional non-Gaussian components with unity variance. We plot the mean of errors $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ over $\,100\,$ simulations w.r.t. the test models (A) to (E). Again concerning the mean of errors $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ over $\,100\,$ simulations of PP and NGCA we find a transition in the error criterion to a failure mode for the test models (A), (C) between $\,d=30\,$ and $\,d=40\,$ and between $\,d=20\,$ and $\,d=30\,$ respectively. For the test models (B),(D) and (E) we found a relative continuous increase in $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ for the methods PP and NGCA. In comparison SNGCA fails to analyze test model (A) independently from the size of the sampling, if the dimension exceeds $\,d=12\,$. Concerning test model (B) there is a sharp transition in the simulation result between $\,d=35\,$ and $\,d=40\,$. Failure modes: In order to provide a better insight into the details of the failure modes we present box plots of $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ in the transition phases w.r.t. the models (A) and (B). Figure 4.6: failure modes of SNGCA - upper figure: model (A) - lower figure: model(B) Figure 4.6 demonstrates the differences in the transition phases of model (A) and (B) respectively. The transition phase is characterized by a high variance of the estimation error. For model (A) the increase of the variance $\,\sigma^{2}_{\varepsilon}\,$ of $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ beginning at dimensions $\,13\,$ and its decrease beginning at dimension $\,15\,$ indicates that a sharp transition phase happens in the interval $\,[13,15]\,$. For higher dimensions more iterations of SNGCA have a decreasing effect on the estimation result. This indicates that by the sampling of the measurement directions, we can not detect the non-Gaussian components of the data density. For model (B) the transition phase starts at dimension $\,35\,$ and ends at dimension $\,43\,$. Moreover the decrease of $\,\sigma^{2}_{\varepsilon}\,$ towards higher dimensions and the increase of the mean of $\,\varepsilon(\widehat{\mathcal{I}},\mathcal{I})\,$ is much slower. This indicates that the non-Gaussian density components might be detectable if we would allow much more iterations of SNGCA and an enlarged size of the set of measurement directions. This observation motivates the interpretation that the Monte-Carlo sampling of the measurement directions is a very poor strategy that fails to provide sufficient information about the Laplace distribution in high dimensions. Currently the SNGCA performance is limited by the sampling strategy. ### 4.2 Application to real life examples We consider a simulating of a mixture of oil and gas flowing under high pressure through a pipeline. Under these physical conditions different phases of the oil-gas-mixture may exist at the same time in the phase space $\,\Gamma\,$. Only some of these phase configurations in $\,\Gamma\,$ are stable over long periods of time. Consequently one expects some clusters of points in $\,\Gamma\,$ indicating the physical state of the mixture. The $\,12\,$-dimensional data set, obtained by numerical simulations of a stationary physical model, was already used before for testing techniques of dimension reduction [3]. The data set comes with a subset of training data and a subset of test data. The length of the time series is $\,1000\,$ in each dimension. The task with this data is to find the clusters representing the stable configurations in the training data set. It is not known a priori if some dimensions are more relevant than others. However it is known a priori that the data is divided into $\,3\,$ classes, indicated by different shapes of the data points. The cluster information is not used in finding the EDR-space. Again we compare SNGCA with NGCA and PP using the hyperbolic tangent index (2.5). For PP and NGCA the results are shown in figure 4.7. They were already published in [24]. | ---|--- Figure 4.7: left: 2D projection of the ”oil flow” data manually chosen from 3D projection obtained from by vanilla FastICA methods using the tanh index - right: projection obtained by NGCA using a combination of Fourier, tanh, Gauss-pow3 indices Figure 4.7 shows a slice through $\,\Gamma\,$ such that the structure in the data set becomes visible: Using NGCA we can distinguish $\,10-11\,$ clusters versus at most $\,5\,$ for PP with index (2.5). For the SNGCA method the results are shown in the figure 4.8. SNGCA identifies 3 non-Gaussian dimensions. All figures are rotated by hand such that the separation of the cluster is illustrated at best. The next figure 4.8 shows the result of the oil-flow data obtained from SNGCA using a combination of the indices (2.5) and (2.6). Figure 4.8: phase configurations of the ”oil flow” data with apriori cluster mapping induced by crosses, circles and triangles obtained by SNGCA using a combination of asymmetric-Gauss and the tanh index In this case we can distinguish $\,10-11\,$ clusters versus at most $\,5\,$ for PP. Moreover we confirm the result of NGCA on the data set. The clusters are clearly separated from each other on the SNGCA projection. Only on the PP projection they are partially confounded in one single cluster. By applying the projection obtained from SNGCA to the test data, we found the cluster structure to be relevant. We conclude that SNGCA gives a more relevant estimation of $\,\mathcal{I}\,$ than PP. However it is found that the family of functions $\,h_{\omega}(x)\,$ is an important tuning parameter in SNGCA: If we use only the tanh-index, we found only 6-7 cluster are identified and they are partially confounded. Hence a combination should be used in order to cope with symmetric data distributions. ## 5 Conclusion We propose a new improved methodology for the non-Gaussian component analysis, as proposed in [24]. As well as NGCA the suggested method is based on a semi- parametric framework for separation an uninteresting multivariate Gaussian noise subspace from a linear subspace, where the data are non-Gaussian distributed. Both methods assume that the non-Gaussian contribution to the data density contains the structure in a given data set. The combined strategy of convex projection and structural adaptation provides promising results of SNGCA. Moreover SNGCA provides an estimate for the dimension of the non- Gaussian subspace. On the other hand, the quality and the numerical complexity of Monte-Carlo sampling of the measurement directions is the main limitation of the proposed technique. ## Appendix A Statistical tests In this section we shortly report the statistical tests on normality used the dimension reduction step of SNGCA. In order to detect a significant asymmetry in the distribution of the original data projected on the semi-axis of the numerical approximation of the rounding ellipsoid $\,\mathcal{E}_{\sqrt{d}}\,$ we use the $\,K^{2}\,$-test according to D’Agostino-Pearson [31]. The D’Agostino-Pearson test computes how far the empirical skewness and kurtosis of the given data distribution differs from the value expected with a Gaussian distribution. The test statistic is approximately distributed according to the $\,\chi^{2}_{2}\,$-distribution and its empirical data counterpart is given by $\displaystyle\widehat{K}^{2}$ $\displaystyle=$ $\displaystyle\mathcal{Z}^{2}(\sqrt{b_{1}})+\mathcal{Z}^{2}(b_{2})$ $\displaystyle\sqrt{b_{1}}$ $\displaystyle=$ $\displaystyle\frac{1}{N}\sum_{i=1}^{N}[\sigma^{-1}(X_{i}-\mu)]^{3}$ $\displaystyle b_{2}$ $\displaystyle=$ $\displaystyle\frac{1}{N}\sum_{i=1}^{N}[\sigma^{-1}(X_{i}-\mu)]^{4}$ Here $\,\mu\,$ denotes the empirical mean, $\,\sigma\,$ the empirical standard deviation of the data and $\,\mathcal{Z}(\cdot)\,$ denotes a normalizing transformations of skewness and kurtosis. The test is more powerful w.r.t. an asymmetry of a distribution. Furthermore we use the EDF-test according to Anderson-Darling [1] with the modification of Stephens [25]: Let $\,F_{N}\,$ be the empirical cumulative distribution function and $\,F\,$ the assumed theoretical cumulative distribution function. The test statistics $\,\mathcal{T}\,$ measures the quadratic deviations between $\,F_{N}\,$ and $\,F\,$: $\displaystyle\mathcal{T}=\int_{\mathbb{R}}[F_{N}(x)-F(x)]^{2}\nu(x)\;dF$ where $\,\nu(x)\,$ is the weighting function $\,\nu(x)=[F_{N}(x)(1-F_{N}(x))]^{-1}\,$. In sum the data counterpart of $\,\mathcal{T}\,$ is given by $\displaystyle\widehat{\mathcal{T}}=$ $\displaystyle- cN-c\sum_{i=1}^{N}N^{-1}(2i-1)[\log(F(\sigma^{-1}(X_{i}-\mu))$ $\displaystyle+\log(1-F(\sigma^{-1}(X_{N-i+1}-\mu))]$ where $\,c=1+0.75N^{-1}+2.25N^{-2}\,$. Again $\,\mu\,$ is the empirical mean and $\,s\,$ the empirical standard deviation of the data. We compute $\,\widehat{\mathcal{T}}\,$ to detect deviations from normality in the tails of the projected distributions. The test is rejected if $\,\widehat{\mathcal{T}}\,$ exceeds a critical value $\,cv\,$ specific for a given level of significance: $\,\alpha\,$ : | $\,0.10\,$ | $\,0.05\,$ | $\,0.025\,$ | $\,0.01\,$ | $\,0.005\,$ ---|---|---|---|---|--- $\,cv\,$ : | $\,0.631\,$ | $\,0.752\,$ | $\,0.873\,$ | $\,1.035\,$ | $\,1.159\,$ The last test, applied to the projected data is the Shapiro-Wilks test [22] based on a regression strategy in the version given by Royston [20, 21]: $\displaystyle W$ $\displaystyle=$ $\displaystyle\sigma^{-1}[1-b^{2}(\sigma^{2}(N-1))^{-1}]^{\lambda}\sim\mathcal{N}(\mu,1)$ $\displaystyle b$ $\displaystyle=$ $\displaystyle\sum_{i=1}^{N/2}a_{N-i+1}(X_{N-i+1}-x_{i})$ $\displaystyle(a_{1},\dots,a_{N})$ $\displaystyle=$ $\displaystyle{m^{\top}\Sigma^{-1}\over(m^{\top}\Sigma^{-1^{\top}}\Sigma^{-1}m)^{1/2}}$ In this test $\,m=(m_{1},\ldots,m_{n})\,$ denotes the expected values of standard normal order statistics for a sample of size $\,N\,$ and $\,\Sigma\,$ is the corresponding covariance matrix. ## Appendix B Proofs ### B.1 Proof of Theorem 2 We use the following result from the empirical process theory (similar statements under slightly different assumptions can be found e.g. in [26]). Let $\,\mathcal{B}\,$ stand for the unit Euclidean ball, centered at the origin. Similarly, $\,B(\mu,\omega^{\circ})=\\{\omega:\|\omega-\omega^{\circ}\|_{2}\leq\mu\\}\,$ is a ball of radius $\,\mu\,$ centered at $\,\omega^{\circ}\,$. For a function $\,q(\omega,x)\,$, denote $\,I\\!\\!E_{N}[q(\omega,X)]=N^{-1}\sum_{i=1}^{N}q(\omega,X_{i})\,$. ###### Lemma 1. Let $\,q(\omega,x)\,$ be a continuously differentiable function of $\,\omega\in\mathcal{B}_{d}\,$ and $\,x\in\mathbb{R}^{d}\,$ such that for every $\,\omega\in\mathcal{B}_{d}\,$ $\displaystyle\operatorname{Var}\bigl{[}q(\omega,X)\bigr{]}\leq q^{*},\quad\operatorname{Cov}\bigl{[}\nabla_{\omega}q(\omega,X)\bigr{]}\leq q^{*}I,$ (B.12) with some $\,q^{*},q^{*}>0\,$. Define $\displaystyle\zeta(\omega)=N^{1/2}\bigl{\\{}I\\!\\!E_{N}[q(\omega,X)]-I\\!\\!E[q(\omega,X)]\bigr{\\}}$ and $\,\zeta(\omega,\omega^{\prime})=\zeta(\omega)-\zeta(\omega^{\prime})\,$. Then for any $\,\mathfrak{n}_{0}>1\,$, there is $\,\lambda^{*}_{1}=\lambda^{*}_{1}(\mathfrak{n}_{0})>0\,$ such that for any $\,\omega^{\circ}\in\mathcal{B}_{d}\,$, $\,\mu\leq 1\,$, and $\,\lambda\leq\lambda^{*}_{1}N^{1/2}\,$ $\displaystyle\log I\\!\\!E\exp\bigl{[}\lambda\zeta(\omega^{\circ})\bigr{]}\\!\\!\\!$ $\displaystyle\leq$ $\displaystyle\\!\\!\\!\mathfrak{n}_{0}q^{*}\lambda^{2}/2,$ (B.13) $\displaystyle\log I\\!\\!E\exp\Bigl{[}\frac{\lambda}{\mu}\sup_{\omega\in B(\mu,\omega^{\circ})}\zeta(\omega,\omega^{\circ})\Bigr{]}\\!\\!\\!$ $\displaystyle\leq$ $\displaystyle\\!\\!\\!2\mathfrak{n}_{0}q^{*}\lambda^{2}+\mathfrak{e}_{d}\,,\qquad$ (B.14) where $\,\mathfrak{e}_{d}=\sum_{k=1}^{\infty}2^{-k}\log(2^{kd})=4d\log 2\,$. Moreover, define $\displaystyle\mathfrak{z}(\lambda)=\mathfrak{n}_{0}\bigl{(}q^{*}/2+2q^{*}\bigr{)}\lambda^{2}+\mathfrak{e}_{d}.$ Then for any $\,\varepsilon>0\,$ $\displaystyle I\\!\\!P\biggl{(}\sup_{\omega\in\mathcal{B}_{d}}\zeta(\omega)\geq 2\lambda^{-1}\bigl{[}\mathfrak{z}(\lambda)+\log\varepsilon^{-1}\bigr{]}\biggr{)}\leq\varepsilon.$ ###### Proof. Define for $\,\omega\in\mathcal{B}_{d}\,$ $\displaystyle g_{0}(\lambda;\omega)=\log I\\!\\!E\exp\Big{[}\frac{\lambda}{\sqrt{\mathfrak{n}_{0}q^{*}}}\bigl{\\{}q(\omega,X_{1})-I\\!\\!E[q(\omega,X_{1})]\bigr{\\}}\Big{]}.$ Then $\,g_{0}(\lambda;\omega)\,$ is analytic in $\,\lambda\,$ and satisfies $\,g_{0}(0;\omega)=g^{\prime}_{0}(0;\omega)=0\,$. Moreover, the condition (B.12) implies $\,g^{\prime\prime}_{0}(0;\omega)<1\,$. Therefore, there is some $\,\lambda^{*}_{1}>0\,$ such that for any $\,\lambda_{1}\leq\lambda^{*}_{1}\,$ and any unit vector $\,\omega\,$, it holds $\,g_{0}(\lambda_{1};\omega)\leq\lambda_{1}^{2}/2\,$. Independence of the $\,X_{i}\,$’s implies (B.13) for $\,\lambda\leq\lambda^{*}_{1}N^{1/2}(\mathfrak{n}_{0}q^{*})^{-1/2}\,$. In the same way, for $\,\omega,u\in\mathcal{B}_{d}\,$ define $\,\zeta(\omega,X)=\nabla_{\omega}q(\omega,X_{1})-I\\!\\!E[\nabla_{\omega}q(\omega,X_{1})]\,$ and $\displaystyle g(\lambda;\omega,u)=\log I\\!\\!E\exp\big{[}\frac{2\lambda u^{\top}}{\sqrt{\mathfrak{n}_{0}q^{*}}}\zeta(\omega,X_{1})\big{]}.$ Then similarly to the above, the function $\,g(\lambda;\omega,u)\,$ is analytic in $\,\lambda\,$ and satisfies with some $\,\lambda^{*}_{1}>0\,$, any $\,\lambda_{1}\leq\lambda^{*}_{1}\,$ and any unit vectors $\,u\,$ and $\,\omega\,$ $\displaystyle g(\lambda_{1};\omega,u)\leq 2\lambda_{1}^{2}.$ The bound (B.14) is derived from [23], Lemma 5.1. Independence of the $\,X_{i}\,$’s yields for $\,\lambda\leq\lambda^{*}_{1}N^{1/2}(\mathfrak{n}_{0}q^{*})^{-1/2}\,$ $\displaystyle\log I\\!\\!E\exp\biggl{\\{}\frac{2\lambda}{\sqrt{\mathfrak{n}_{0}q^{*}}}u^{\top}\nabla\zeta(\omega)\biggr{\\}}\leq 2\lambda^{2}.$ This means that the condition $\,(\mathscr{E}D)\,$ of [23] is verified and the result (B.14) follows from [23], Lemma 5.1. Introduce a random set $\,A=\\{(\lambda/2)\sup_{\omega}\zeta(\omega)>\mathfrak{z}(\lambda)+\log\varepsilon^{-1}\\}\,$. and $\,A^{c}\,$ is its complement. By the Cauchy-Schwartz inequality $\displaystyle I\\!\\!P(A^{c})\\!\\!\\!$ $\displaystyle\leq$ $\displaystyle\\!\\!\\!I\\!\\!E\exp\biggl{\\{}\frac{\lambda}{2}\sup_{\omega}\zeta(\omega)-\mathfrak{z}(\lambda)-\log\varepsilon^{-1}\biggr{\\}}$ $\displaystyle\leq$ $\displaystyle\\!\\!\\!\varepsilon I\\!\\!E^{1/2}\exp\bigl{\\{}\lambda\zeta(\omega^{\circ})-\mathfrak{n}_{0}q^{*}\lambda^{2}/2\bigr{\\}}$ $\displaystyle\\!\\!\\!\times\,I\\!\\!E^{1/2}\exp\bigl{\\{}\lambda\sup_{\omega}\zeta(\omega,\omega^{\circ})-2\mathfrak{n}_{0}q^{*}\lambda^{2}-\mathfrak{e}_{d}\bigr{\\}}\leq\varepsilon$ and the last result follows. ∎ The result of Lemma 1 can be easily extended to the case of a vector function $\,q(\omega,x)\in\mathbb{R}^{d}\,$: $\displaystyle I\\!\\!P\biggl{(}\sup_{\omega\in\mathcal{B}_{d}}\|\zeta(\omega)\|_{\infty}\geq 2\lambda^{-1}\bigl{[}\mathfrak{z}(\lambda)+\log(d/\varepsilon)\bigr{]}\biggr{)}\leq\varepsilon.$ This fact can be obtained by applying Lemma 1 to each component of the vector $\,\zeta(\omega)\,$. The term $\,\log(d/\varepsilon)\,$ is responsible for the overall deviation probability. Let now $\,f(x,\omega)\,$ be a twice continuously differentiable function of $\,\omega\in\mathcal{B}_{d}\,$ and $\,x\in\mathbb{R}^{d}\,$ such that for every $\,j\leq d\,$, $\,\omega\in\mathcal{B}_{d}\,$, and $\,x\in\mathbb{R}^{d}\,$, it holds $\displaystyle\operatorname{Var}\bigl{[}X_{j}\,f(X,\omega)\bigr{]}\leq f^{*}_{1},\quad\operatorname{Cov}\bigl{[}X_{j}\,\nabla_{\omega}f(X,\omega)\bigr{]}\leq f^{*}_{1}I,$ $\displaystyle\operatorname{Var}\biggl{[}\frac{\partial}{\partial x_{j}}f(X,\omega)\biggr{]}\leq f^{*}_{1},\quad\operatorname{Cov}\biggl{[}\nabla_{\omega}\frac{\partial}{\partial x_{j}}f(X,\omega)\biggr{]}\leq f^{*}_{1}I,$ Then for any $\,\mathfrak{n}_{0}>1\,$, there is $\,\lambda^{*}_{1}=\lambda^{*}_{1}(\mathfrak{n}_{0})>0\,$ and for any $\,\varepsilon>0\,$, a random set $\,A\,$ with $\,I\\!\\!P(A)\geq 1-\varepsilon\,$ such that on $\,A\,$ it holds by Lemma 1 $\displaystyle\sup_{\omega\in\mathcal{B}_{d}}\big{\|}I\\!\\!E_{N}[Xf(X,\omega)]-I\\!\\!E[Xf(X,\omega)]\big{\|}_{\infty}\leq\delta_{N},$ $\displaystyle\sup_{\omega\in\mathcal{B}_{d}}\big{\|}I\\!\\!E_{N}[\nabla_{x}f(X,\omega)]-I\\!\\!E[\nabla_{x}f(X,\omega)]\big{\|}_{\infty}\leq\delta_{N},$ where $\displaystyle\delta_{N}=N^{-1/2}\inf_{\lambda\leq\lambda^{*}_{1}N^{1/2}}\bigl{\\{}5\mathfrak{n}_{0}f^{*}_{1}\lambda+2\lambda^{-1}\bigl{[}\mathfrak{e}_{d}+\log(2d/\varepsilon)\bigr{]}\bigr{\\}}.$ By construction of vectors $\,\widehat{\gamma}_{l}\,$ and $\,\widehat{\eta}_{l}\,$, it holds on $\,A\,$ $\displaystyle\max_{1\leq l\leq L}\|\widehat{\gamma}_{l}-\gamma_{l}\|_{\infty}\leq\delta_{N},\quad\max_{1\leq l\leq L}\|\widehat{\eta}_{l}-\eta_{l}\|_{\infty}\leq\delta_{N}\,.$ This implies for any $\,\|c\|_{1}\leq 1\,$ $\displaystyle\|\widehat{\gamma}(c)-\gamma(c)\|_{\infty}\leq\delta_{N},\;\;\;\|\widehat{\eta}(c)-\eta(c)\|_{\infty}\leq\delta_{N}.$ The constraint $\,\widehat{\gamma}(\widehat{c})=0\,$ implies $\,\|\gamma(\widehat{c})\|_{\infty}\leq\delta_{N}\,$, thus $\|\gamma(\widehat{c})\|_{2}\leq\sqrt{d}\,\delta_{N},$ and by (2.3) $\displaystyle\bigl{\|}(I-\Pi^{*})\widehat{\eta}(\widehat{c})\bigr{\|}_{2}$ $\displaystyle\leq$ $\displaystyle\bigl{\|}(I-\Pi^{*})\\{\widehat{\eta}(\widehat{c})-{\eta}(\widehat{c})\\}\bigr{\|}_{2}+\bigl{\|}(I-\Pi^{*})\eta(\widehat{c})\bigr{\|}_{2}$ $\displaystyle\leq$ $\displaystyle\bigl{\|}\widehat{\eta}(\widehat{c})-\eta(\widehat{c})\bigr{\|}_{2}+\bigl{\|}\Sigma^{-1}\gamma(\widehat{c})\bigr{\|}_{2}$ $\displaystyle\leq$ $\displaystyle\sqrt{d}\bigl{(}\delta_{N}+\bigl{\|}\Sigma^{-1}\bigr{\|}_{2}\delta_{N}\bigr{)}.$ ### B.2 Proof of Theorem 3 Let $\,\mathscr{S}\,$ stand for the convex envelope of $\,\\{\pm\widehat{\beta}_{j}\\}_{j=1}^{J}\,$. As $\,\mathscr{E}_{1}(B)\,$ is inscribed in $\,\mathscr{S}\,$, its support function $\,\xi_{\mathscr{E}_{1}(B)}(x)=\max_{s\in\mathscr{E}_{1}(B)}s^{\top}x\,$ is majorated by that of $\,\mathscr{S}\,$: $\xi_{\mathscr{E}_{1}(B)}(v)\leq\xi_{\mathscr{S}}(v)=\max_{j=1,...,J}|v^{\top}\widehat{\beta}_{j}|,\;\;\mbox{for any}\;\;v\in\mathbb{R}^{d}.$ Next, the support function of the ellipsoid $\,\mathscr{E}_{1}(B)\,$ is $\xi_{\mathscr{E}_{1}(B)}(v)=(v^{\top}B^{-1}v)^{1/2},$ so that the condition $\,\|\widehat{\beta}_{j}-\beta_{j}\|_{2}\leq\varrho\,$ implies $v^{\top}B^{-1}v\leq\max_{j=1,...,J}|v^{\top}\widehat{\beta}_{j}|^{2}\leq\varrho^{2},$ for any $\,v\perp\mathcal{I}\,$. Let us prove the second claim of the proposition. Let $\,\Pi^{*}\,$ be a projector onto $\,\mathcal{I}\,$. By the assumption of the proposition there exist coefficients $\,\mu_{j}\,$ with $\,\sum_{j}\mu_{j}\leq 1\,$ such that $\displaystyle S\stackrel{{\scriptstyle\operatorname{def}}}{{=}}\frac{1}{2}\biggl{[}\sum_{j}\mu_{j}\beta_{j}\beta_{j}^{\top}-2\varrho^{2}\Pi^{*}\biggr{]}\succeq 0.$ This implies (2.11). Now, for any such $\,S\,$ and its pseudo-inverse $\,S^{+}\,$, the ellipsoid, $\,\mathscr{E}^{f}_{1}(S^{+})\,$ with $\mathscr{E}^{f}_{1}(S^{+})=\\{x\in\mathcal{I}\mid x^{\top}S^{+}x\leq 1\\}$ is inscribed into $\,\mathscr{S}\,$. Indeed, the support function $\,\xi_{\mathscr{E}^{f}_{1}(S^{+})}(x)=(x^{\top}Sx)^{1/2}\,$ of this ellipsoid fulfills for $\,x\in\mathcal{B}_{d}\,$ $\displaystyle\xi_{\mathscr{E}^{f}_{1}(S^{+})}(x)$ $\displaystyle\leq$ $\displaystyle\biggl{(}\sum_{j}\mu_{j}\Bigl{[}\frac{1}{2}(x^{\top}\beta_{j})^{2}-\varrho^{2}\Bigr{]}\biggr{)}^{1/2}$ $\displaystyle\leq$ $\displaystyle\biggl{(}\sum_{j}\mu_{j}\bigl{|}x^{\top}\widehat{\beta}_{j}\bigr{|}^{2}\biggr{)}^{1/2}$ $\displaystyle\leq$ $\displaystyle\max_{1\leq j\leq J}|x^{\top}\widehat{\beta}_{j}|=\xi_{\mathscr{S}}(x),$ Now we are done: as the ellipsoid $\,\mathscr{E}^{f}_{1}(S^{+})\,$ is inscribed into $\,\mathscr{S}\,$, it is contained in the concentric to $\,\mathscr{E}_{1}(B)\,$ ellipsoid $\,\mathscr{E}_{\sqrt{d}}(B)\,$ which covers $\,\mathscr{S}\,$. To show the last statement of the theorem, observe that $\displaystyle\mathrm{Tr}\bigl{[}(\widehat{\Pi}-\Pi^{*})^{2}\bigr{]}=2(m-\mathrm{Tr}[\Pi^{*}\widehat{\Pi}])=2\mathrm{Tr}\bigl{[}(I-\Pi^{*})\widehat{\Pi}\bigr{]}.$ On the other hand, using the second claim one gets $\displaystyle\mathrm{Tr}\bigl{[}(I-\Pi^{*})\widehat{\Pi}\bigr{]}$ $\displaystyle\leq$ $\displaystyle(d-m)\sup_{v\perp\mathcal{I}}v^{\top}\widehat{\Pi}v$ $\displaystyle\leq$ $\displaystyle(d-m)\sup_{v\perp\mathcal{I}}\frac{v^{\top}B^{-1}v}{\lambda_{m}(B^{-1})}$ $\displaystyle\leq$ $\displaystyle\frac{2d^{3/2}\varrho^{2}}{\lambda^{*}-2\varrho^{2}}.$ ## Appendix C The algorithm Here we present the full algorithmic description of the SNGCA procedure. We start with the linear estimation subprocedure: Data: $\,Y\,$,$\,L\,$,$\,J\,$ Result: $\,\\{\widehat{\beta}_{j}\\}_{j=1}^{J}\,$ Sampling: choice of measurement directions for _j=1 to J_ do for _l=1 to L_ do Compute: $\,\widehat{\eta}_{jl}=N^{-1}\sum_{i=1}^{N}\nabla h_{\omega_{jl}}(Y_{i})\,$ $\,\widehat{\gamma}_{jl}=N^{-1}\sum_{i=1}^{N}Y_{i}h_{\omega_{jl}}(Y_{i})\,$ end Compute $\,\widehat{c}_{j}\,$ as in (2.8) and $\,\widehat{\beta}_{j}=\sum_{l=1}^{L}\widehat{c}_{j}\widehat{\eta}_{jl}\,$. end Algorithm 4 (linear estimation of $\,\beta(\psi_{h,c})\,$). The following subprocedure reports the computation of the $\sqrt{d}$-rounding ellipsoid based on a proposal in [18]: Data: $\,\\{\widehat{\beta}_{j}\\}_{j=1}^{J}\,$ Result: $\,\widehat{B}\,$, Let $\,\delta_{i}^{k^{\ast}}=\max_{1\leq j\leq J}\;\langle\widehat{\beta}_{j},\widehat{B}_{i}\widehat{\beta}_{j}\rangle\,$ and set $\,\nu_{i}=\delta_{i}^{k^{\ast}}d^{-1}\,$. Let $\,\widehat{B}_{0}\,$ be the inverse empirical covariance matrix of the $\,\widehat{\beta}_{j}\,$ and set $\,t_{i}=\nu_{i}(\delta_{i}^{k^{\ast}}d^{-1}-1)^{-1}\,$. Moreover let $\,i\,$ be the loop index. repeat $\,x_{i}=\widehat{B}_{i}\widehat{\beta}_{k^{\ast}}\,$ $\,\widehat{B}_{i+1}=(1-t_{i})^{-1}\Big{(}\widehat{B}_{i}-t_{i}(1+\nu_{i})^{-1}x_{i}x_{i}^{\top}\Big{)}\,$ $\,\delta_{i+1}^{k^{\ast}}=(1-t_{i})^{-1}\Big{(}\delta_{i}^{k^{\ast}}-t_{i}(1+\nu_{i})^{-1}\langle\widehat{\beta}_{k^{\ast}},x_{i}\rangle^{2}\Big{)}\,$ until _$\,\delta_{i}^{k^{\ast}}\leq C\cdot d\,$ where $\,C\,$ is a tuning parameter._ Algorithm 5 (Compute of the $\,\sqrt{d}\,$-rounding of the MVEE). The next algorithm 6 reports the pseudocode for constructing a reduced basis of the target space from the estimated elements by means of algorithm 5: Data: $\,\widehat{B}\,$ Result: $\,\big{\langle}\text{first }m\text{ eigenvectors of }\widehat{B}\big{\rangle}\,$ Let $\,\widehat{V}\,$ be the matrix of eigenvectors $\,\widehat{v}_{i}\,$ from $\,\widehat{B}\,$ computed according to algorithm 5. for _i=1 to d_ do Project the data orthogonal on $\,\widehat{v}_{i}\,$. Compute tests on normality of the projected data. end Discard every eigenvector with associated normal distributed projected data. Algorithm 6 (Dimension Reduction). In algorithm 4 we start with a random initialization of the non-parametric estimator $\,\widehat{\beta}_{j}\,$ by means of a Monte-Carlo sampling of the directions $\,\omega_{jl}\,$ and $\,\xi_{j}\,$. However we can use the result of the first iteration $\,k=1\,$ of SNGCA in order to accumulate information about $\,\mathcal{I}\,$ in a sequence $\,\widehat{\mathcal{I}}_{1},\widehat{\mathcal{I}}_{2},\ldots\,$ of estimators of the target space. The procedure is described in detail in algorithm 7. Data: $\,\big{\langle}\text{first }m\text{ eigenvectors of }\widehat{B}\big{\rangle}\,$ Let $\,\\{\widehat{v_{i}}\\}_{i=1}^{m}\,$ denote the reduced set of eigenvectors from $\,\widehat{B}\,$ and let $\,k\,$ iterations be completed. To initialize iteration $\,k+1\,$ choose random numbers $\,z_{j1},\ldots,z_{jm}\,$ and $\,u_{l1},\ldots,u_{lm}\,$ from $\,\mathcal{U}_{[-1,1]}\,$ and set $\,\quad\quad\quad\xi_{j}:=\sum_{s=1}^{m}z_{js}\widehat{v}_{i_{s}}\mbox{ for }1\leq j\leq n_{1}<J\,$ $\,\quad\quad\quad\omega_{l}:=\sum_{s=1}^{m}u_{ls}\widehat{v}_{i_{s}}\mbox{ for }1\leq l\leq n_{2}<L\,$ Then define $\,\omega_{L-n_{2}},\ldots,\omega_{L}\,$ and $\,\xi_{J-n_{1}},\ldots,\xi_{J}\,$ analogous to the case $\,k=1\,$. Now compose the sets $\,\quad\quad\quad\\{\xi_{1}^{(k)},\ldots,\xi_{n_{1}}^{(k)},\xi_{n_{1}+1}^{(k)},\ldots,\xi_{J}^{(k)}\\}\,$ $\,\quad\quad\quad\\{\omega_{1}^{(k)},\ldots,\omega_{n_{2}}^{(k)},\omega_{n_{2}+1}^{(k)},\ldots,\omega_{L}^{(k)}\\}\,$ For the initialization in the case $\,k=k+1\,$. Moreover we choose $\,n_{1}=kd\,$ and $\,n_{2}=kd\,$ until $\,n_{1}>J-d\,$ or $\,n_{2}>L-d\,$. Otherwise set $\,n_{1}=J-d\,$ or $\,n_{2}=L-d\,$. Algorithm 7 (structural adaptation of the linear estimation ). Choice of parameters: One of the advantages of the algorithm proposed above is the fact that there are only a few tuning parameters. * i) Suppose now that $\,\omega_{i}\,$ is an absolute continuous random variable with $\,\omega_{i}\sim\mathcal{U}_{[-1,1]}\,$. Without loss of generality we set $\,e=(1,0,\ldots,0)\,$. Due to the normalization of $\,(\omega_{1},\ldots,\omega_{d})\,$, it holds: $\displaystyle I\\!\\!P\big{(}|(\omega_{1},\ldots,\omega_{d})^{\top}e|\geq 0.5\big{)}=\big{(}\sqrt{d}\big{)}^{-1}$ However the choice of $\,J\,$ and $\,L\,$ heavily depends on the non-gaussian components. In the experiments we use $\,7d\leq J\leq 18d\,$ and $\,6d\leq L\leq 16d\,$. * ii) Set the parameter of the stopping rule to $\,\delta=0.05\,$. * iii) Set the constant in the stopping rule for the computation of the MVEE to $\,C=2\,$. * iv) Set the significance level of the statistical tests to $\,\alpha=0.05\,$. Finally we give a description of the complete algorithm. Data: $\,\\{X_{i}\\}_{i=1}^{N}\,$,$\,L\,$,$\,J\,$,$\,\alpha\,$ Result: $\,\widehat{\mathcal{I}}\,$ Normalization: The data $\,(X_{i})_{i=1}^{N}\,$ are recentered. Let $\,\sigma=(\sigma_{1},\ldots\sigma_{d})\,$ be the standard deviations of the components of $\,X_{i}\,$. Then $\,Y_{i}=\mathrm{diag}(\sigma^{-1})X_{i}\,$ denotes the componentwise empirically normalized data. Main Procedure:; // loop on $\,k\,$ while _$\,\sim StoppingCriterion(\mathcal{I},\widehat{\mathcal{I}})\,$_ do Sampling: The components of the Monte-Carlo-parts of $\,\xi_{j}^{(k)}\,$ and $\,\omega_{jl}^{(k)}\,$ are randomly chosen from $\,\mathcal{U}_{[-1,1]}\,$. The other part of the measurement directions are initialized according to the structural adaptation approach described in algorithm 7. Then $\,\xi_{j}^{(k)}\,$ and $\,\omega_{jl}^{(k)}\,$ are normalized to unit length. Linear Estimation Procedure: for _j=1 to J_ do for _l=1 to L_ do $\,\widehat{\eta}_{jl}^{(k)}=N^{-1}\sum_{i=1}^{N}\nabla h_{\omega_{jl}^{(k)}}(Y_{i})\,$ $\,\widehat{\gamma}_{jl}^{(k)}=N^{-1}\sum_{i=1}^{N}Y_{i}h_{\omega_{jl}^{(k)}}(Y_{i})\,$ endCompute the coefficients $\,\\{c_{l}\\}_{l=1}^{L}\,$ by solving the second-order conic optimization problem (2.8): $\,\quad\quad\quad\quad\quad\min\;q\qquad\mbox{s.t.}\,$ $\,\quad\quad\quad\quad\quad\quad\frac{1}{2}\|z\|_{2}\leq q\,$ $\,\quad\quad\sum_{l=1}^{L}(c_{l}^{+}-c_{l}^{-})\widehat{\eta}_{jl}^{(k)}-z=\xi_{j}^{(k)}\,$ $\,\quad\quad\quad\sum_{l=1}^{L}(c_{l}^{+}-c_{l}^{-})\widehat{\gamma}_{jl}^{(k)}=0\,$ $\,\sum_{l=1}^{L}(c_{l}^{+}-c_{l}^{-})\leq 1,\quad 0\leq c_{l}^{+},c_{l}^{-}\quad\forall l\,$ Compute $\,\widehat{\beta}_{j}^{(k)}=\sum_{l=1}^{L}(\widehat{c}_{l}^{+}-\widehat{c}_{l}^{-})\widehat{\eta}_{jl}^{(k)}\,$ end Dimension Reduction: Compute the symmetric matrix $\,\widehat{B}^{(k)}\,$ defining the approximation of $\,\mathcal{E}\,$ according to algorithm 5. Reduce the basis of $\,\mathcal{X}\,$ according to algorithm 6. end Algorithm 8 (full procedure of SNGCA). Complexity: We restrict ourselves to the leading polynomial terms of the arithmetical complexity of corresponding computations counting only the multiplications. * 1. The numerical effort to compute $\,\eta_{jl}\,$ and $\,\gamma_{jl}\,$ in algorithm 4 heavily depends on the choice of $\,h(\omega^{\top}x)\,$. Let $\,h(\omega^{\top}x)=\tanh(\omega^{\top}x)\,$. Then this step takes $\,\mathcal{O}(J(\log N)^{2}N^{2})\,$ operations. * 2. Algorithm 5 takes $\,\mathcal{O}(d^{2}J\log(J))\,$ operations [18]. * 3. For the optimization step in 4 we use a commercial solver222http://www.mosek.com based on an interior point method. The constrained convex projection solved as an SOCP takes $\,\mathcal{O}(d^{2}n^{3})\,$ operations there $\,n\,$ is the number of constraints. * 4. Computation of the statistical tests in one dimension: Let $\,N\,$ denote the number of samples. D’Agostino-Pearson-test needs $\,\mathcal{O}(N^{3}\log N)\,$ and the Anderson-Darling-test $\,\mathcal{O}((\log N)^{2}N^{2})\,$ operations. The test of Shapiro-Wilks takes $\,\mathcal{O}(N^{2})\,$. In order to avoid robustness problems [14] the number of samples is limited to $\,N\leq 1000\,$. For larger data sets, $\,N=1000\,$ points are randomly chosen. Hence without tests $\,\widehat{\mathcal{I}}\,$ is computed in $\,\mathcal{O}(J(\log N)^{2}N^{2}+d^{2}J\log(J)+d^{2}n^{3})\,$ arithmetical operations per iteration. ## Acknowledgment We are grateful to Yuri Nesterov from the CORE, Louvain-la-Neuve for helpful discussions and Gilles Blanchard from the FIRST.IDA Fraunhofer Institute Berlin for the permission to republish the results of NGCA. ## References * [1] F.J. Anscombe and W.J. Glynn. Distribution of kurtosis statistic for normal statistics. Biometrika, 70(1):227–234, 1983. * [2] E. Bura and R. D. Cook. Estimating the structural dimension of regressions via parametric inverse regression. J. Roy. Statist. Soc. Ser. B, 63(393-410), 2001. * [3] M. Svensen C.M. Bishop and C.K.I. Wiliams. Gtm: The generative topographic mapping. Neural Computation, 10(1):215–234, 1998. * [4] R.D. Cook. Principal hessian directions revisited. J. Am. Statist. Ass., 93:85–100, 1998. * [5] T.M. Cover and J.A. Thomas. Elements of Information Theory. Wiley Series in Telecommunications. Wiley and Sons, New York, 1991. * [6] P. Diaconis and D. Friedman. Asymptotics of graphical projection pursuit. Annals of Statistics, 12(3):793–815, 1984. * [7] N.E. Goljandina, V.V. Nekrutkin, and A.A. Zhigljavsky. Analysis of Time Series Structure: SSA and related technique. Chapman and Hall (CRS), Boca Raton, 2001. * [8] T. Hastie, R. Tibshirani, and J. Friedman. The elements of statistical learning. Springer Series in Statistcs. Springer, 2001. * [9] M. Hristache, A. Juditsky, J. Polzehl, and V. Spokoiny. Structure adaptive approach for dimension reduction. Ann. Statist., 29(6):1537–1566, 2001. * [10] P. J. Huber. Projection pursuit. The Annals of Statistics, 13(2):435–475, 1985. * [11] A. Hyvärinen. Survey on independent component analysis. Neural Computing Surveys, 2:94–128, 1999. * [12] F. John. Extremum problems with inequalities as subsidiary conditions, volume Reprinted in: Fritz John, Collected Papers Volume 2 of Birkhäuser, Boston, pages 543–560. J. Moser, 1985. * [13] I.T. Jolliffe. Principal Component Analysis. Springer Series in Statistics. Springer, Berlin and New York, 2nd edition, 2002. * [14] H.C. Thode Jr. Testing for Normality. Marcel Dekker, New York., 2002. * [15] K.C. Li. Sliced inverse regression for dimension reduction. J. Am. Statist. Ass., 86:316–342, 1991. * [16] K.C. Li. On principal hessian directions for data visualisation and dimension reduction: another application of stein’s lemma. Ann. Statist., 87:1025–1039, 1992. * [17] M. Mizuta. Dimension Reduction Methods, chapter 6, pages 566–89. J.E. Gentle and W. Härdle, and Y. Mori (eds.): Handbook of Computational Statistics, 2004. * [18] Yu. E. Nesterov. Rounding of convex sets and efficient gradient methods for linear programming problems. Discussion Paper 2004-4, CORE, Catholic University of Louvain, Louvain-la-Neuve, Belgium, 2004. * [19] S. Roweis and L. Saul. Nonlinear dimensionality reduction by locally linear embedding. Science, 290:2323–2326, 2000. * [20] J.P. Royston. An extension of shapiro and wilks’ w test for normality to large samples. Applied Statistics, 31:115–124, 1982. * [21] J.P. Royston. The w test for normality. Applied Statistics, 21:176–180, 1982. * [22] S.S. Shapiro and M.B. Wilk. An analysis of variance test for normality. Biometrika, 52:591–611, 1965. * [23] V. Spokoiny. A penalized exponential risk bound in parametric estimation. http://arxiv.org/abs/0903.1721, 2009. * [24] V. Spokoiny, G. Blanchard, M. Sugiyama, M.Kawanabe, and Klaus-Robert Müller. In search of non-Gaussian components of a high-dimensional distribution. Journal of Machine Learning Research, preprint TR05-003, 2005. * [25] M. A. Stephens. Goodness of Fit Techniques, chapter Tests based on Goodness of Fit. D’Agostino, R. B. and Stephens, M. A., 1986. * [26] A. van der Vaart and J.A. Wellner. Weak Convergence and Empirical Proccesses. Springer Series in Statistics. Springer – New York, 1996. * [27] L. Wasserman. All of Nonparametric Statistics. Springer Texts in Statistcs. Springer, 2006. * [28] H. Wold. Soft Modeling. The Basic Design and Some Extensions., volume 2 of Systems Under Indirect Observation, pages 1–53. K.-G. Jöreskog and H. Wold, North-Holland, Amsterdam, 1982. * [29] S. Wold, S. Hellberg, M. Sjostrom, and H. Wold. PLS Model Building: Theory and applications. PLS modeling with latent variables in two or more dimensions. 1987\. * [30] Y. Xia, H. Tong, W.K. Li, and Li-Xing Zhu. An adaptive estimation of dimension reduction space. Journal of the Royal Statistical Society, Series B, 64(3):363–388, 2001. * [31] J.H. Zar. Biostatistical Analysis, (2nd ed.). NJ: Prentice-Hall, Englewood Cliffs., 1999.
arxiv-papers
2009-04-02T17:05:23
2024-09-04T02:49:01.625287
{ "license": "Public Domain", "authors": "Elmar Diederichs, Anatoli Juditsky, Vladimir Spokoiny, Christof\n Schuette", "submitter": "Elmar Diederichs", "url": "https://arxiv.org/abs/0904.0430" }
0904.0439
STAR Collaboration # $J/\psi$ production at high transverse momenta in $p$+$p$ and Cu+Cu collisions at $\sqrt{s_{{}_{\mathrm{NN}}}}$ = 200 GeV B. I. Abelev University of Illinois at Chicago, Chicago, Illinois 60607, USA M. M. Aggarwal Panjab University, Chandigarh 160014, India Z. Ahammed Variable Energy Cyclotron Centre, Kolkata 700064, India B. D. Anderson Kent State University, Kent, Ohio 44242, USA D. Arkhipkin Particle Physics Laboratory (JINR), Dubna, Russia G. S. Averichev Laboratory for High Energy (JINR), Dubna, Russia J. Balewski Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA O. Barannikova University of Illinois at Chicago, Chicago, Illinois 60607, USA L. S. Barnby University of Birmingham, Birmingham, United Kingdom J. Baudot Institut de Recherches Subatomiques, Strasbourg, France S. Baumgart Yale University, New Haven, Connecticut 06520, USA D. R. Beavis Brookhaven National Laboratory, Upton, New York 11973, USA R. Bellwied Wayne State University, Detroit, Michigan 48201, USA F. Benedosso NIKHEF and Utrecht University, Amsterdam, The Netherlands M. J. Betancourt Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA R. R. Betts University of Illinois at Chicago, Chicago, Illinois 60607, USA A. Bhasin University of Jammu, Jammu 180001, India A. K. Bhati Panjab University, Chandigarh 160014, India H. Bichsel University of Washington, Seattle, Washington 98195, USA J. Bielcik Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic J. Bielcikova Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic B. Biritz University of California, Los Angeles, California 90095, USA L. C. Bland Brookhaven National Laboratory, Upton, New York 11973, USA M. Bombara University of Birmingham, Birmingham, United Kingdom B. E. Bonner Rice University, Houston, Texas 77251, USA M. Botje NIKHEF and Utrecht University, Amsterdam, The Netherlands J. Bouchet Kent State University, Kent, Ohio 44242, USA E. Braidot NIKHEF and Utrecht University, Amsterdam, The Netherlands A. V. Brandin Moscow Engineering Physics Institute, Moscow Russia E. Bruna Yale University, New Haven, Connecticut 06520, USA S. Bueltmann Old Dominion University, Norfolk, VA, 23529, USA T. P. Burton University of Birmingham, Birmingham, United Kingdom M. Bystersky Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic X. Z. Cai Shanghai Institute of Applied Physics, Shanghai 201800, China H. Caines Yale University, New Haven, Connecticut 06520, USA M. Calderón de la Barca Sánchez University of California, Davis, California 95616, USA O. Catu Yale University, New Haven, Connecticut 06520, USA D. Cebra University of California, Davis, California 95616, USA R. Cendejas University of California, Los Angeles, California 90095, USA M. C. Cervantes Texas A&M University, College Station, Texas 77843, USA Z. Chajecki Ohio State University, Columbus, Ohio 43210, USA P. Chaloupka Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic S. Chattopadhyay Variable Energy Cyclotron Centre, Kolkata 700064, India H. F. Chen University of Science & Technology of China, Hefei 230026, China J. H. Chen Kent State University, Kent, Ohio 44242, USA J. Y. Chen Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China J. Cheng Tsinghua University, Beijing 100084, China M. Cherney Creighton University, Omaha, Nebraska 68178, USA A. Chikanian Yale University, New Haven, Connecticut 06520, USA K. E. Choi Pusan National University, Pusan, Republic of Korea W. Christie Brookhaven National Laboratory, Upton, New York 11973, USA R. F. Clarke Texas A&M University, College Station, Texas 77843, USA M. J. M. Codrington Texas A&M University, College Station, Texas 77843, USA R. Corliss Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA T. M. Cormier Wayne State University, Detroit, Michigan 48201, USA M. R. Cosentino Universidade de Sao Paulo, Sao Paulo, Brazil J. G. Cramer University of Washington, Seattle, Washington 98195, USA H. J. Crawford University of California, Berkeley, California 94720, USA D. Das University of California, Davis, California 95616, USA S. Dash Institute of Physics, Bhubaneswar 751005, India M. Daugherity University of Texas, Austin, Texas 78712, USA L. C. De Silva Wayne State University, Detroit, Michigan 48201, USA T. G. Dedovich Laboratory for High Energy (JINR), Dubna, Russia M. DePhillips Brookhaven National Laboratory, Upton, New York 11973, USA A. A. Derevschikov Institute of High Energy Physics, Protvino, Russia R. Derradi de Souza Universidade Estadual de Campinas, Sao Paulo, Brazil L. Didenko Brookhaven National Laboratory, Upton, New York 11973, USA P. Djawotho Texas A&M University, College Station, Texas 77843, USA S. M. Dogra University of Jammu, Jammu 180001, India X. Dong Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA J. L. Drachenberg Texas A&M University, College Station, Texas 77843, USA J. E. Draper University of California, Davis, California 95616, USA J. C. Dunlop Brookhaven National Laboratory, Upton, New York 11973, USA M. R. Dutta Mazumdar Variable Energy Cyclotron Centre, Kolkata 700064, India W. R. Edwards Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA L. G. Efimov Laboratory for High Energy (JINR), Dubna, Russia E. Elhalhuli University of Birmingham, Birmingham, United Kingdom M. Elnimr Wayne State University, Detroit, Michigan 48201, USA V. Emelianov Moscow Engineering Physics Institute, Moscow Russia J. Engelage University of California, Berkeley, California 94720, USA G. Eppley Rice University, Houston, Texas 77251, USA B. Erazmus SUBATECH, Nantes, France M. Estienne SUBATECH, Nantes, France L. Eun Pennsylvania State University, University Park, Pennsylvania 16802, USA P. Fachini Brookhaven National Laboratory, Upton, New York 11973, USA R. Fatemi University of Kentucky, Lexington, Kentucky, 40506-0055, USA J. Fedorisin Laboratory for High Energy (JINR), Dubna, Russia A. Feng Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China P. Filip Particle Physics Laboratory (JINR), Dubna, Russia E. Finch Yale University, New Haven, Connecticut 06520, USA V. Fine Brookhaven National Laboratory, Upton, New York 11973, USA Y. Fisyak Brookhaven National Laboratory, Upton, New York 11973, USA C. A. Gagliardi Texas A&M University, College Station, Texas 77843, USA L. Gaillard University of Birmingham, Birmingham, United Kingdom D. R. Gangadharan University of California, Los Angeles, California 90095, USA M. S. Ganti Variable Energy Cyclotron Centre, Kolkata 700064, India E. J. Garcia-Solis University of Illinois at Chicago, Chicago, Illinois 60607, USA A. Geromitsos SUBATECH, Nantes, France F. Geurts Rice University, Houston, Texas 77251, USA V. Ghazikhanian University of California, Los Angeles, California 90095, USA P. Ghosh Variable Energy Cyclotron Centre, Kolkata 700064, India Y. N. Gorbunov Creighton University, Omaha, Nebraska 68178, USA A. Gordon Brookhaven National Laboratory, Upton, New York 11973, USA O. Grebenyuk Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA D. Grosnick Valparaiso University, Valparaiso, Indiana 46383, USA B. Grube Pusan National University, Pusan, Republic of Korea S. M. Guertin University of California, Los Angeles, California 90095, USA K. S. F. F. Guimaraes Universidade de Sao Paulo, Sao Paulo, Brazil A. Gupta University of Jammu, Jammu 180001, India N. Gupta University of Jammu, Jammu 180001, India W. Guryn Brookhaven National Laboratory, Upton, New York 11973, USA B. Haag University of California, Davis, California 95616, USA T. J. Hallman Brookhaven National Laboratory, Upton, New York 11973, USA A. Hamed Texas A&M University, College Station, Texas 77843, USA J. W. Harris Yale University, New Haven, Connecticut 06520, USA W. He Indiana University, Bloomington, Indiana 47408, USA M. Heinz Yale University, New Haven, Connecticut 06520, USA S. Heppelmann Pennsylvania State University, University Park, Pennsylvania 16802, USA B. Hippolyte Institut de Recherches Subatomiques, Strasbourg, France A. Hirsch Purdue University, West Lafayette, Indiana 47907, USA E. Hjort Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. M. Hoffman Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA G. W. Hoffmann University of Texas, Austin, Texas 78712, USA D. J. Hofman University of Illinois at Chicago, Chicago, Illinois 60607, USA R. S. Hollis University of Illinois at Chicago, Chicago, Illinois 60607, USA H. Z. Huang University of California, Los Angeles, California 90095, USA T. J. Humanic Ohio State University, Columbus, Ohio 43210, USA L. Huo Texas A&M University, College Station, Texas 77843, USA G. Igo University of California, Los Angeles, California 90095, USA A. Iordanova University of Illinois at Chicago, Chicago, Illinois 60607, USA P. Jacobs Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA W. W. Jacobs Indiana University, Bloomington, Indiana 47408, USA P. Jakl Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic C. Jena Institute of Physics, Bhubaneswar 751005, India F. Jin Shanghai Institute of Applied Physics, Shanghai 201800, China C. L. Jones Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA P. G. Jones University of Birmingham, Birmingham, United Kingdom J. Joseph Kent State University, Kent, Ohio 44242, USA E. G. Judd University of California, Berkeley, California 94720, USA S. Kabana SUBATECH, Nantes, France K. Kajimoto University of Texas, Austin, Texas 78712, USA K. Kang Tsinghua University, Beijing 100084, China J. Kapitan Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic D. Keane Kent State University, Kent, Ohio 44242, USA A. Kechechyan Laboratory for High Energy (JINR), Dubna, Russia D. Kettler University of Washington, Seattle, Washington 98195, USA V. Yu. Khodyrev Institute of High Energy Physics, Protvino, Russia D. P. Kikola Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA J. Kiryluk Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. Kisiel Ohio State University, Columbus, Ohio 43210, USA S. R. Klein Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. G. Knospe Yale University, New Haven, Connecticut 06520, USA A. Kocoloski Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA D. D. Koetke Valparaiso University, Valparaiso, Indiana 46383, USA M. Kopytine Kent State University, Kent, Ohio 44242, USA W. Korsch University of Kentucky, Lexington, Kentucky, 40506-0055, USA L. Kotchenda Moscow Engineering Physics Institute, Moscow Russia V. Kouchpil Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic P. Kravtsov Moscow Engineering Physics Institute, Moscow Russia V. I. Kravtsov Institute of High Energy Physics, Protvino, Russia K. Krueger Argonne National Laboratory, Argonne, Illinois 60439, USA M. Krus Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic C. Kuhn Institut de Recherches Subatomiques, Strasbourg, France L. Kumar Panjab University, Chandigarh 160014, India P. Kurnadi University of California, Los Angeles, California 90095, USA M. A. C. Lamont Brookhaven National Laboratory, Upton, New York 11973, USA J. M. Landgraf Brookhaven National Laboratory, Upton, New York 11973, USA S. LaPointe Wayne State University, Detroit, Michigan 48201, USA J. Lauret Brookhaven National Laboratory, Upton, New York 11973, USA A. Lebedev Brookhaven National Laboratory, Upton, New York 11973, USA R. Lednicky Particle Physics Laboratory (JINR), Dubna, Russia C-H. Lee Pusan National University, Pusan, Republic of Korea J. H. Lee Brookhaven National Laboratory, Upton, New York 11973, USA W. Leight Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA M. J. LeVine Brookhaven National Laboratory, Upton, New York 11973, USA C. Li University of Science & Technology of China, Hefei 230026, China N. Li Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China Y. Li Tsinghua University, Beijing 100084, China G. Lin Yale University, New Haven, Connecticut 06520, USA S. J. Lindenbaum City College of New York, New York City, New York 10031, USA M. A. Lisa Ohio State University, Columbus, Ohio 43210, USA F. Liu Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China J. Liu Rice University, Houston, Texas 77251, USA L. Liu Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China T. Ljubicic Brookhaven National Laboratory, Upton, New York 11973, USA W. J. Llope Rice University, Houston, Texas 77251, USA R. S. Longacre Brookhaven National Laboratory, Upton, New York 11973, USA W. A. Love Brookhaven National Laboratory, Upton, New York 11973, USA Y. Lu University of Science & Technology of China, Hefei 230026, China T. Ludlam Brookhaven National Laboratory, Upton, New York 11973, USA G. L. Ma Shanghai Institute of Applied Physics, Shanghai 201800, China Y. G. Ma Shanghai Institute of Applied Physics, Shanghai 201800, China D. P. Mahapatra Institute of Physics, Bhubaneswar 751005, India R. Majka Yale University, New Haven, Connecticut 06520, USA O. I. Mall University of California, Davis, California 95616, USA L. K. Mangotra University of Jammu, Jammu 180001, India R. Manweiler Valparaiso University, Valparaiso, Indiana 46383, USA S. Margetis Kent State University, Kent, Ohio 44242, USA C. Markert University of Texas, Austin, Texas 78712, USA H. S. Matis Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA Yu. A. Matulenko Institute of High Energy Physics, Protvino, Russia D. McDonald Rice University, Houston, Texas 77251, USA T. S. McShane Creighton University, Omaha, Nebraska 68178, USA A. Meschanin Institute of High Energy Physics, Protvino, Russia R. Milner Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA N. G. Minaev Institute of High Energy Physics, Protvino, Russia S. Mioduszewski Texas A&M University, College Station, Texas 77843, USA A. Mischke NIKHEF and Utrecht University, Amsterdam, The Netherlands B. Mohanty Variable Energy Cyclotron Centre, Kolkata 700064, India D. A. Morozov Institute of High Energy Physics, Protvino, Russia M. G. Munhoz Universidade de Sao Paulo, Sao Paulo, Brazil B. K. Nandi Indian Institute of Technology, Mumbai, India C. Nattrass Yale University, New Haven, Connecticut 06520, USA T. K. Nayak Variable Energy Cyclotron Centre, Kolkata 700064, India J. M. Nelson University of Birmingham, Birmingham, United Kingdom P. K. Netrakanti Purdue University, West Lafayette, Indiana 47907, USA M. J. Ng University of California, Berkeley, California 94720, USA L. V. Nogach Institute of High Energy Physics, Protvino, Russia S. B. Nurushev Institute of High Energy Physics, Protvino, Russia G. Odyniec Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. Ogawa Brookhaven National Laboratory, Upton, New York 11973, USA H. Okada Brookhaven National Laboratory, Upton, New York 11973, USA V. Okorokov Moscow Engineering Physics Institute, Moscow Russia D. Olson Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA M. Pachr Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic B. S. Page Indiana University, Bloomington, Indiana 47408, USA S. K. Pal Variable Energy Cyclotron Centre, Kolkata 700064, India Y. Pandit Kent State University, Kent, Ohio 44242, USA Y. Panebratsev Laboratory for High Energy (JINR), Dubna, Russia T. Pawlak Warsaw University of Technology, Warsaw, Poland T. Peitzmann NIKHEF and Utrecht University, Amsterdam, The Netherlands V. Perevoztchikov Brookhaven National Laboratory, Upton, New York 11973, USA C. Perkins University of California, Berkeley, California 94720, USA W. Peryt Warsaw University of Technology, Warsaw, Poland S. C. Phatak Institute of Physics, Bhubaneswar 751005, India P. Pile Brookhaven National Laboratory, Upton, New York 11973, USA M. Planinic University of Zagreb, Zagreb, HR-10002, Croatia J. Pluta Warsaw University of Technology, Warsaw, Poland D. Plyku Old Dominion University, Norfolk, VA, 23529, USA N. Poljak University of Zagreb, Zagreb, HR-10002, Croatia A. M. Poskanzer Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA B. V. K. S. Potukuchi University of Jammu, Jammu 180001, India D. Prindle University of Washington, Seattle, Washington 98195, USA C. Pruneau Wayne State University, Detroit, Michigan 48201, USA N. K. Pruthi Panjab University, Chandigarh 160014, India P. R. Pujahari Indian Institute of Technology, Mumbai, India J. Putschke Yale University, New Haven, Connecticut 06520, USA R. Raniwala University of Rajasthan, Jaipur 302004, India S. Raniwala University of Rajasthan, Jaipur 302004, India R. L. Ray University of Texas, Austin, Texas 78712, USA R. Redwine Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA R. Reed University of California, Davis, California 95616, USA A. Ridiger Moscow Engineering Physics Institute, Moscow Russia H. G. Ritter Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA J. B. Roberts Rice University, Houston, Texas 77251, USA O. V. Rogachevskiy Laboratory for High Energy (JINR), Dubna, Russia J. L. Romero University of California, Davis, California 95616, USA A. Rose Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA C. Roy SUBATECH, Nantes, France L. Ruan Brookhaven National Laboratory, Upton, New York 11973, USA M. J. Russcher NIKHEF and Utrecht University, Amsterdam, The Netherlands R. Sahoo SUBATECH, Nantes, France I. Sakrejda Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA T. Sakuma Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA S. Salur Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA J. Sandweiss Yale University, New Haven, Connecticut 06520, USA M. Sarsour Texas A&M University, College Station, Texas 77843, USA J. Schambach University of Texas, Austin, Texas 78712, USA R. P. Scharenberg Purdue University, West Lafayette, Indiana 47907, USA N. Schmitz Max-Planck-Institut für Physik, Munich, Germany J. Seger Creighton University, Omaha, Nebraska 68178, USA I. Selyuzhenkov Indiana University, Bloomington, Indiana 47408, USA P. Seyboth Max-Planck- Institut für Physik, Munich, Germany A. Shabetai Institut de Recherches Subatomiques, Strasbourg, France E. Shahaliev Laboratory for High Energy (JINR), Dubna, Russia M. Shao University of Science & Technology of China, Hefei 230026, China M. Sharma Wayne State University, Detroit, Michigan 48201, USA S. S. Shi Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China X-H. Shi Shanghai Institute of Applied Physics, Shanghai 201800, China E. P. Sichtermann Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA F. Simon Max-Planck-Institut für Physik, Munich, Germany R. N. Singaraju Variable Energy Cyclotron Centre, Kolkata 700064, India M. J. Skoby Purdue University, West Lafayette, Indiana 47907, USA N. Smirnov Yale University, New Haven, Connecticut 06520, USA R. Snellings NIKHEF and Utrecht University, Amsterdam, The Netherlands P. Sorensen Brookhaven National Laboratory, Upton, New York 11973, USA J. Sowinski Indiana University, Bloomington, Indiana 47408, USA H. M. Spinka Argonne National Laboratory, Argonne, Illinois 60439, USA B. Srivastava Purdue University, West Lafayette, Indiana 47907, USA A. Stadnik Laboratory for High Energy (JINR), Dubna, Russia T. D. S. Stanislaus Valparaiso University, Valparaiso, Indiana 46383, USA D. Staszak University of California, Los Angeles, California 90095, USA M. Strikhanov Moscow Engineering Physics Institute, Moscow Russia B. Stringfellow Purdue University, West Lafayette, Indiana 47907, USA A. A. P. Suaide Universidade de Sao Paulo, Sao Paulo, Brazil M. C. Suarez University of Illinois at Chicago, Chicago, Illinois 60607, USA N. L. Subba Kent State University, Kent, Ohio 44242, USA M. Sumbera Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic X. M. Sun Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA Y. Sun University of Science & Technology of China, Hefei 230026, China Z. Sun Institute of Modern Physics, Lanzhou, China B. Surrow Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA T. J. M. Symons Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. Szanto de Toledo Universidade de Sao Paulo, Sao Paulo, Brazil J. Takahashi Universidade Estadual de Campinas, Sao Paulo, Brazil A. H. Tang Brookhaven National Laboratory, Upton, New York 11973, USA Z. Tang University of Science & Technology of China, Hefei 230026, China L. H. Tarini Wayne State University, Detroit, Michigan 48201, USA T. Tarnowsky Michigan State University, East Lansing, Michigan 48824, USA D. Thein University of Texas, Austin, Texas 78712, USA J. H. Thomas Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA J. Tian Shanghai Institute of Applied Physics, Shanghai 201800, China A. R. Timmins Wayne State University, Detroit, Michigan 48201, USA S. Timoshenko Moscow Engineering Physics Institute, Moscow Russia D. Tlusty Nuclear Physics Institute AS CR, 250 68 Řež/Prague, Czech Republic M. Tokarev Laboratory for High Energy (JINR), Dubna, Russia T. A. Trainor University of Washington, Seattle, Washington 98195, USA V. N. Tram Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA A. L. Trattner University of California, Berkeley, California 94720, USA S. Trentalange University of California, Los Angeles, California 90095, USA R. E. Tribble Texas A&M University, College Station, Texas 77843, USA O. D. Tsai University of California, Los Angeles, California 90095, USA J. Ulery Purdue University, West Lafayette, Indiana 47907, USA T. Ullrich Brookhaven National Laboratory, Upton, New York 11973, USA D. G. Underwood Argonne National Laboratory, Argonne, Illinois 60439, USA G. Van Buren Brookhaven National Laboratory, Upton, New York 11973, USA M. van Leeuwen NIKHEF and Utrecht University, Amsterdam, The Netherlands A. M. Vander Molen Michigan State University, East Lansing, Michigan 48824, USA J. A. Vanfossen, Jr Kent State University, Kent, Ohio 44242, USA R. Varma Indian Institute of Technology, Mumbai, India G. M. S. Vasconcelos Universidade Estadual de Campinas, Sao Paulo, Brazil I. M. Vasilevski Particle Physics Laboratory (JINR), Dubna, Russia A. N. Vasiliev Institute of High Energy Physics, Protvino, Russia F. Videbaek Brookhaven National Laboratory, Upton, New York 11973, USA S. E. Vigdor Indiana University, Bloomington, Indiana 47408, USA Y. P. Viyogi Institute of Physics, Bhubaneswar 751005, India S. Vokal Laboratory for High Energy (JINR), Dubna, Russia S. A. Voloshin Wayne State University, Detroit, Michigan 48201, USA M. Wada University of Texas, Austin, Texas 78712, USA M. Walker Massachusetts Institute of Technology, Cambridge, MA 02139-4307, USA F. Wang Purdue University, West Lafayette, Indiana 47907, USA G. Wang University of California, Los Angeles, California 90095, USA J. S. Wang Institute of Modern Physics, Lanzhou, China Q. Wang Purdue University, West Lafayette, Indiana 47907, USA X. Wang Tsinghua University, Beijing 100084, China X. L. Wang University of Science & Technology of China, Hefei 230026, China Y. Wang Tsinghua University, Beijing 100084, China G. Webb University of Kentucky, Lexington, Kentucky, 40506-0055, USA J. C. Webb Valparaiso University, Valparaiso, Indiana 46383, USA G. D. Westfall Michigan State University, East Lansing, Michigan 48824, USA C. Whitten Jr University of California, Los Angeles, California 90095, USA H. Wieman Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA S. W. Wissink Indiana University, Bloomington, Indiana 47408, USA R. Witt United States Naval Academy, Annapolis, MD 21402, USA Y. Wu Institute of Particle Physics, CCNU (HZNU), Wuhan 430079, China W. Xie Purdue University, West Lafayette, Indiana 47907, USA N. Xu Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA Q. H. Xu Shandong University, Jinan, Shandong 250100, China Y. Xu University of Science & Technology of China, Hefei 230026, China Z. Xu Brookhaven National Laboratory, Upton, New York 11973, USA Y. Yang Institute of Modern Physics, Lanzhou, China P. Yepes Rice University, Houston, Texas 77251, USA K. Yip Brookhaven National Laboratory, Upton, New York 11973, USA I-K. Yoo Pusan National University, Pusan, Republic of Korea Q. Yue Tsinghua University, Beijing 100084, China M. Zawisza Warsaw University of Technology, Warsaw, Poland H. Zbroszczyk Warsaw University of Technology, Warsaw, Poland W. Zhan Institute of Modern Physics, Lanzhou, China S. Zhang Shanghai Institute of Applied Physics, Shanghai 201800, China W. M. Zhang Kent State University, Kent, Ohio 44242, USA X. P. Zhang Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA Y. Zhang Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA Z. P. Zhang University of Science & Technology of China, Hefei 230026, China Y. Zhao University of Science & Technology of China, Hefei 230026, China C. Zhong Shanghai Institute of Applied Physics, Shanghai 201800, China J. Zhou Rice University, Houston, Texas 77251, USA R. Zoulkarneev Particle Physics Laboratory (JINR), Dubna, Russia Y. Zoulkarneeva Particle Physics Laboratory (JINR), Dubna, Russia J. X. Zuo Shanghai Institute of Applied Physics, Shanghai 201800, China ###### Abstract The STAR collaboration at RHIC presents measurements of $J/\psi$ $\rightarrow{e^{+}e^{-}}$ at mid-rapidity and high transverse momentum ($p_{T}>5$ GeV/$c$) in $p$+$p$ and central Cu+Cu collisions at $\sqrt{s_{{}_{\mathrm{NN}}}}$ = 200 GeV. The inclusive $J/\psi$ production cross section for Cu+Cu collisions is found to be consistent at high $p_{T}$ with the binary collision-scaled cross section for $p$+$p$ collisions, in contrast to previous measurements at lower $p_{T}$, where a suppression of $J/\psi$ production is observed relative to the expectation from binary scaling. Azimuthal correlations of $J/\psi$ with charged hadrons in $p$+$p$ collisions provide an estimate of the contribution of $B$-meson decays to $J/\psi$ production of $13\%\pm 5\%$. ###### pacs: 12.38.Mh, 14.40.Gx, 25.75.Dw, 25.75.Nq Suppression of the $c\bar{c}$ bound state $J/\psi$ meson production in relativistic heavy-ion collisions arising from $J/\psi$ dissociation due to screening of the $c\bar{c}$ binding potential in the deconfined medium has been proposed as a signature of Quark-Gluon Plasma (QGP) formation Matsui and Satz (1986). Measurements at $\sqrt{s_{{}_{\mathrm{NN}}}}$ $=17.3$ GeV at the CERN-SPS observed a strong suppression of $J/\psi$ production in heavy-ion collisions Abreu et al. (2001), although the magnitude of the suppression decreases with increasing $J/\psi$ $p_{T}$. This systematic dependence may be explained by initial state scattering (Cronin effect Zhao and Rapp (2007)), as well as the combined effects of finite $J/\psi$ formation time and the finite space-time extent of the hot, dense volume where the dissociation can occur Karsch and Petronzio (1988). At higher beam energy ($\sqrt{s_{{}_{\mathrm{NN}}}}$ $=200$ GeV), the PHENIX collaboration at RHIC has measured $J/\psi$ suppression for $p_{T}<5$ GeV/$c$ in central (small impact parameter) Au+Au and Cu+Cu collisions Adare et al. (2007a) that is similar in magnitude to that observed at the CERN-SPS. This similarity is surprising in light of the expectation that the energy density is significantly higher at larger collision energy. It may be due to the counterbalancing of larger dissociation with recombination of unassociated $c$ and $\bar{c}$ in the medium, which are more abundant at higher energy Braun- Munzinger and Stachel (2000); Grandchamp and Rapp (2001); Gorenstein et al. (2002); Thews et al. (2001); Frawley et al. (2008). Measurements of open heavy-flavor production may also shed light on $J/\psi$ suppression mechanisms. Non-photonic electrons from the semi-leptonic decay of heavy flavor mesons are found to be strongly suppressed in heavy-ion relative to p+p collisions at RHIC Abelev et al. (2007); Adare et al. (2007b), an effect that has been attributed to partonic energy loss in dense matter Dokshitzer and Kharzeev (2001). This process may also contribute to high-$p_{T}$ $J/\psi$ suppression, if $J/\psi$ formation proceeds through a channel carrying color. The medium generated in RHIC heavy-ion collisions is thought to be strongly coupled Adams et al. (2005a), making accurate QCD calculations of quarkonium propagation difficult. The AdS/CFT duality for QCD-like theories may provide insight into heavy fermion pair propagation in a strongly coupled liquid. One such calculation predicts that the dissociation temperature decreases with increasing $J/\psi$ $p_{T}$ (or velocity) Liu et al. (2007). The temperature achieved at RHIC ($\sim 1.5$ Tc) Adams et al. (2005a) is below this dissociation temperature at low $J/\psi$ $p_{T}$, and above it at $p_{T}\gtrsim 5$ GeV/$c$. Consequently, $J/\psi$ production is predicted to be more suppressed at high $p_{T}$, in contrast to the standard suppression mechanism. This prediction can be tested with measurements of $J/\psi$ over a broad kinematic range, in both $p$+$p$ and nuclear collisions. The interpretation of $J/\psi$ suppression observed at the SPS and by the PHENIX collaboration requires understanding of the quarkonium production mechanism in hadronic collisions, which include direct production via gluon fusion and color-octet (CO) and color-singlet (CS) transitions, as described by Non-Relativistic Quantum ChromoDynamics (NRQCD) Bodwin et al. (1995); parton fragmentation; and feeddown from higher charmonium states ($\chi_{c}$, $\psi(2S)$) and $B$ meson decays. No model at present fully explains the $J/\psi$ systematics observed in elementary collisions Brambilla et al. (2004). $J/\psi$ measurements at high-$p_{T}$ both in $p$+$p$ and nuclear collisions may provide additional insights into the basic processes underlying quarkonium production. This letter reports new measurements by the STAR collaboration at RHIC of $J/\psi$ production at high transverse momentum in $p$+$p$ and Cu+Cu collisions at $\sqrt{s_{{}_{\mathrm{NN}}}}$ = 200 GeV Ackermann et al. (2003). The inclusive cross section and semi-inclusive $J/\psi$-hadron correlations are presented. The Cu+Cu data are from the RHIC 2005 run, while the $p$+$p$ data are from 2005 and 2006. The online trigger, utilizing the STAR Barrel Electromagnetic Calorimeter (BEMC) Beddo et al. (2003) as well as other trigger detectors, required one BEMC tower with an energy deposition above a given threshold in coincidence with a minimum bias (MB) collision trigger Abelev et al. (2008a). The online trigger threshold, MB trigger condition, and sampled integrated luminosity for each dataset are listed in Tab. 1. In Cu+Cu data, the most central 0-20% and 0-60% of the total hadronic cross section were selected as in Abelev et al. (2008a, b). In this analysis, $J/\psi$ $\rightarrow{e^{+}e^{-}}$ (Branching Ratio (B)=5.9%) was reconstructed using the STAR Time Projection Chamber (TPC) Anderson et al. (2003) and BEMC, with acceptance $|\eta|<1$ and full azimuthal coverage. Hadron rejection was achieved through the combination of BEMC shower energy, shower shape measured in the embedded Shower-Maximum Detector (SMD), and ionization loss ($dE/dx$) in the TPC Abelev et al. (2007); Xu et al. (2008). Electron purity is $>70\%$ with high efficiency. At moderate $p_{T}$, the TPC alone can measure electrons with efficiency $>90\%$ and sufficient hadron rejection ($\sim 10^{3}$) Abelev et al. (2007); Adams et al. (2005b). Table 1: Trigger conditions, off-line cuts and $J/\psi$ signal statistics. $E_{T}$ is the BEMC trigger threshold. $p_{T1}$ and $p_{T2}$ are the lower bounds for the two electron candidates. BBC (ZDC) means the coincidence of Beam Beam Counters (Zero Degree Calorimeters). S/B is the ratio of signal to background. | $p$+$p$ (2005) | $p$+$p$ (2006) | Cu+Cu ---|---|---|--- MB trigger | BBC | BBC | ZDC $E_{T}$ (GeV) | $>$ 3.5 | $>$ 5.4 | $>$ 3.75 Sampled int. lumi | 2.8 $pb^{-1}$ | 11.3 $pb^{-1}$ | 860 $\mu b^{-1}$ $p_{T1}$ (GeV/$c$) | $>$ 2.5 | $>$ 4.0 | $>$ 3.5 $p_{T2}$ (GeV/$c$) | $>$ 1.2 | $>$ 1.2 | $>$ 1.5 $J/\psi$ $p_{T}$ (GeV/c) | 5-8 | 5-14 | 5-8 $J/\psi$ counts | 32 $\pm$ 6 | 51 $\pm$ 10 | 23 $\pm$ 8 S/B | 9:1 | 2:1 | 1:4 Figure 1: (Color online.) Left: invariant dielectron mass distribution in (a) $p$+$p$ and (b) Cu+Cu collisions, for opposite sign (solid red) and same sign pairs (grey band) from data, and simulated $J/\psi$ peak for $p$+$p$ (dashed). Right: $J/\psi$ $p_{T}$ distributions in $p$+$p$ and Cu+Cu collisions at $\sqrt{s_{{}_{\mathrm{NN}}}}$ = 200 GeV. Horizontal brackets show bin limits. Also shown are perturbative calculations for LO CS+CO (solid line) and NNLO* CS (band) direct yields, without feeddown contributions. Figure 1 shows di-electron invariant mass distributions for (a) $p$+$p$ and (b) Cu+Cu collisions at $\sqrt{s_{{}_{\mathrm{NN}}}}$ = 200 GeV. The like-sign distribution measures random pair background from Dalitz decays and photon conversions. The $J/\psi$ mass window is $2.7<M_{inv}^{ee}<3.2$ GeV/$c^{2}$. Other correlated $e^{+}e^{-}$ background is estimated to be $<10\%$ Adare et al. (2007c); Abe et al. (1997); Acosta et al. (2005). Table 1 lists the offline cuts and $J/\psi$ signal statistics. Different thresholds were used for the two electron candidates, corresponding to different online trigger thresholds. The $J/\psi$ detection efficiency was calculated by two complementary methods. The first method was to determine the electron trigger efficiency by comparing triggered electron yield to the measured inclusive electron spectrum Abelev et al. (2007). The non-triggered electron efficiency depends only on the TPC tracking efficiency, which was determined by embedding simulated electron tracks into real events Abelev et al. (2008a), and $dE/dx$ efficiencies, determined from the distributions in real data Xu et al. (2008). The second method was to simulate $J/\psi$ events in PYTHIA Sjostrand et al. (2006), embed them into real events, and reconstruct the hybrid event to determine the $J/\psi$ trigger and detection efficiencies. The difference in estimated efficiency between the two methods is $<10\%$ for all datasets and is included into the systematic uncertainties of the inclusive spectra. This systematic uncertainty is correlated in $p$+$p$ and Cu+Cu. A log-likelihood method is used to correct the $J/\psi$ efficiency and calculate the yields Tang (2009). Figure 1 (c) shows the measured $J/\psi\rightarrow{e^{+}e^{-}}$ $p_{T}$ spectra. The systematic uncertainties are dominated by kinematic cuts, trigger efficiency (9%) and reconstruction efficiency (8%), and are similar and correlated in $p$+$p$ and Cu+Cu. The normalization uncertainty for the inclusive non-singly diffractive $p$+$p$ cross section is 14% Adams et al. (2003). Theoretical calculations shown in the figure are NRQCD from CO and CS transitions for direct $J/\psi$’s in $p+p$ collisions Nayak et al. (2003) (solid line) and NNLO⋆ CS result Artoisenet et al. (2008) (gray band). Neither calculation includes feeddown contributions. The band for NNLO⋆ gives the uncertainty due to scale parameters and the charm quark mass. The CS+CO calculation describes the data well and leaves little room for feeddown from $\psi^{\prime}$, $\chi_{c}$ and $B$, estimated to be a factor of $\sim 1.5$. NNLO⋆ CS predicts a steeper $p_{T}$ dependence. Figure 2: $x_{T}$ distributions of pions and protons Banner et al. (1982); Adams et al. (2006, 2005c); Alper et al. (1975); Antreasyan et al. (1979) and $J/\psi$ (CDF Acosta et al. (2005); Abe et al. (1997), UA1 Albajar et al. (1991), PHENIX Adare et al. (2007c), and ISR Kourkoumelis et al. (1980)). Proton and pion inclusive production cross sections in high energy $p$+$p$ collisions have been found to follow $x_{T}$ scaling Clark et al. (1978); Angelis et al. (1978); Adler et al. (2004): $E\frac{d^{3}\sigma}{dp^{3}}=g(x_{T})/s^{n/2}$, where $x_{T}=2p_{T}/\sqrt{s}$. In the parton model, $n$ reflects the number of constituents taking an active role in hadron production. Figure 2 shows the $x_{T}$ distributions of this data and previous $J/\psi$, pion and proton data, from $p$+$p$ collisions. The $J/\psi$ data Acosta et al. (2005); Abe et al. (1997); Albajar et al. (1991); Adare et al. (2007c); Kourkoumelis et al. (1980) cover the range $\sqrt{s}$ =30 GeV to $\sqrt{s}$ =1.96 TeV. The $J/\psi$ exhibits $x_{T}$ scaling ($n=5.6\pm 0.2$) at high $p_{T}$, similar to the trend for pions and protons ($n=6.6\pm 0.1$) Adams et al. (2006, 2005c). While low $p_{T}$ $J/\psi$ production originates in a hard process due to the mass scale, subsequent soft processes could cause violation of $x_{T}$ scaling. At high $p_{T}$, the power parameter $n=5.6\pm 0.2$ is closer to the predictions from CO and Color- Evaporation production ($n\simeq 6$) Nayak et al. (2003); Bedjidian et al. (2004) and much smaller than that from next-to-next-to leading order (NNLO*) CS production ($n\simeq 8$) Artoisenet et al. (2008). This is also evident from Fig. 1 (c). Figure 3: (Color online). $J/\psi$ $R_{AA}$ vs. $p_{T}$. STAR data points have statistical (bars) and systematic (caps) uncertainties. The box about unity on the left shows $R_{AA}$ normalization uncertainty, which is the quadrature sum of p+p normalization and binary collision scaling uncertainties. The solid line and band show the average and uncertainty of the two 0-20% data points. The curves are model calculations described in the text. The uncertainty band of 10% for the dotted curve is not shown. The nuclear modification factor $R_{AA}(p_{T}$) Adler et al. (2002), defined as the ratio of the inclusive hadron yield in nuclear collisions to that in $p$+$p$ collisions scaled by the underlying number of binary nucleon-nucleon collisions, measures medium-induced effects on inclusive particle production. In the absence of such effects, $R_{AA}$ is unity for hard processes. Figure 3 shows $R_{AA}$ for $J/\psi$ vs $p_{T}$, in 0-20% Cu+Cu collisions from PHENIX Adare et al. (2008) and STAR, and 0-60% Cu+Cu from STAR. Cu+Cu and $p$+$p$ data with $p_{T}>5$ GeV/$c$ are from STAR. The $R_{AA}$ systematic uncertainty takes into account the correlated efficiencies of the Cu+Cu and $p$+$p$ datasets. $R_{AA}$ for $J/\psi$ is seen to increase with increasing $p_{T}$. The average of the two STAR 0-20% data points at high-$p_{T}$ is $R_{AA}=1.4\pm 0.4~{}(stat.)\pm 0.2~{}(syst.)$. Utilizing the STAR Cu+Cu and $p$+$p$ data reported here and PHENIX Cu+Cu data at high-$p_{T}$ Adare et al. (2008) gives $R_{AA}=1.1\pm 0.3~{}(stat.)\pm 0.2~{}(syst.)$ for $p_{T}>5$ GeV/$c$. Both results are consistent with unity and differ by two standard deviations from a PHENIX measurement at lower $p_{T}$ ($R_{AA}=0.52\pm 0.05$ Adare et al. (2008)). A notable conclusion from these data is that $J/\psi$ is the only hadron measured in RHIC heavy-ion collisions that does not exhibit significant high $p_{T}$ suppression. However, for the $J/\psi$ population reported here, the initial scattered partons have average momentum fraction $\sim 0.1$ (see also Fig. 2), where initial state effects such as anti- shadowing may lead to increasing $R_{AA}$ with increasing $p_{T}$. The dashed curve in Fig. 3 shows the prediction of an AdS/CFT-based calculation, in which the $J/\psi$ is embedded in a hydrodynamic model Gunji (2008) and the $J/\psi$ dissociation temperature decreases with increasing velocity according to Liu et al. (2007). Its $p_{T}$ dependence is at variance with that of the data. The dotted line shows the prediction of a two-component model including color screening, hadronic phase dissociation, statistical $c\bar{c}$ coalescence at the hadronization transition, $J/\psi$ formation time effects, and $B$-meson feeddown Zhao and Rapp (2007). This calculation describes the overall trend of the data. The other calculations in Fig. 3 provide a comparison to open charm $R_{AA}$. The solid line is based on the WHDG model for charm quark energy loss, with assumed medium gluon density $dN_{g}/dy=254$ for 0-20% Cu+Cu Wicks et al. (2007). The dash-dotted line shows a GLV model calculation for D-meson energy loss, with $dN_{g}/dy=275$ Adil and Vitev (2007). Both models, which correctly describe heavy-flavor suppression in Au+Au collisions, predict charm meson suppression of a factor $\sim 2$ at $p_{T}>5$ GeV/$c$. This is in contrast to the $J/\psi$ $R_{AA}$. This comparison suggests that high-$p_{T}$ $J/\psi$ production does not proceed dominantly via a channel carrying color. However, other effects Zhao and Rapp (2007); Xu (2002) may compensate for the predicted loss in this $p_{T}$ range. Figure 4: (Color online). $J/\psi$-hadron azimuthal correlations. Lines show PYTHIA calculation of prompt (dashed) and $B$-meson (dot-dashed) feeddown contributions, and their sum (solid). Figure 4 shows the azimuthal correlation between high-$p_{T}$ $J/\psi$ ($p_{T}>5$ GeV/$c$) and charged hadrons with $p_{T}>0.5$ GeV/$c$ in 200 GeV p+p collisions. The $J/\psi$ mass window is narrowed to 2.9-3.2 GeV/$c^{2}$ to increase the S/B ratio. There is no significant correlated yield in the near- side ($\Delta\phi\sim 0$), in contrast to dihadron correlation measurements Adams et al. (2005d). The lines show the result of a PYTHIA calculation Sjostrand et al. (2006), which exhibits a near-side correlation due dominantly to $B\rightarrow J/\psi+X$. A $\chi^{2}$ fit to the data of the summed distribution (directly produced $J/\psi$ , feeddown from $\chi_{c}$, $\psi(2S)$ and $B$-meson) gives a contribution from $B$-meson feeddown to inclusive $J/\psi$ production of $13\%\pm 5\%$ at $p_{T}>5$ GeV/$c$. In summary, we report new measurements of $J/\psi$ production in $\sqrt{s}$ =200 GeV $p$+$p$ and Cu+Cu collisions at high $p_{T}$ ($p_{T}>5$ GeV/$c$) at RHIC. The $J/\psi$ inclusive cross section was found to obey $x_{T}$ scaling for $p_{T}$ $\gtrsim 5$ GeV/c, in contrast to lower $p_{T}$ $J/\psi$ production. The $J/\psi$ nuclear modification factor $R_{AA}$ in Cu+Cu increases from low to high $p_{T}$ and is consistent with no $J/\psi$ suppression for $p_{T}$ $>$5 GeV/c, in contrast to the prediction from a theoretical model of quarkonium dissociation in a strongly coupled liquid using an AdS/CFT approach. The two-component model with finite $J/\psi$ formation time describes the increasing trend of the $J/\psi$ $R_{AA}$. Based on the measurement of azimuthal correlations and the comparison to model calculations, we estimate the fraction of $J/\psi$ from $B$-meson decay to be $13\pm 5\%$ at $p_{T}>5$ GeV/$c$. The authors thank G.C. Nayak, J.P. Lansberg, W.A. Horowitz and I. Vitev for providing calculations and discussion. We thank the RHIC Operations Group and RCF at BNL, and the NERSC Center at LBNL and the resources provided by the Open Science Grid consortium for their support. This work was supported in part by the Offices of NP and HEP within the U.S. DOE Office of Science, the U.S. NSF, the Sloan Foundation, the DFG Excellence Cluster EXC153 of Germany, CNRS/IN2P3, RA, RPL, and EMN of France, STFC and EPSRC of the United Kingdom, FAPESP of Brazil, the Russian Ministry of Sci. and Tech., the NNSFC, CAS, MoST, and MoE of China, IRP and GA of the Czech Republic, FOM of the Netherlands, DAE, DST, and CSIR of the Government of India, the Polish State Committee for Scientific Research, and the Korea Sci. & Eng. Foundation. ## References * Matsui and Satz (1986) T. Matsui and H. Satz, Phys. Lett. B178, 416 (1986). * Abreu et al. (2001) M. C. Abreu et al., Phys. Lett. B499, 85 (2001). * Zhao and Rapp (2007) X. Zhao and R. Rapp (2007), eprint arXiv:0712.2407. * Karsch and Petronzio (1988) F. Karsch and R. Petronzio, Phys. Lett. B212, 255 (1988). * Adare et al. (2007a) A. Adare et al., Phys. Rev. Lett. 98, 232301 (2007a). * Braun-Munzinger and Stachel (2000) P. Braun-Munzinger and J. Stachel, Phys. Lett. B490, 196 (2000). * Grandchamp and Rapp (2001) L. Grandchamp and R. Rapp, Phys. Lett. B523, 60 (2001). * Gorenstein et al. (2002) M. I. Gorenstein et al., Phys. Lett. B524, 265 (2002). * Thews et al. (2001) R. L. Thews, M. Schroedter, and J. Rafelski, Phys. Rev. C63, 054905 (2001). * Frawley et al. (2008) A. D. Frawley, T. Ullrich, and R. Vogt, Phys. Rept. 462, 125 (2008). * Abelev et al. (2007) B. I. Abelev et al., Phys. Rev. Lett. 98, 192301 (2007). * Adare et al. (2007b) A. Adare et al., Phys. Rev. Lett. 98, 172301 (2007b). * Dokshitzer and Kharzeev (2001) Y. L. Dokshitzer and D. E. Kharzeev, Phys. Lett. B519, 199 (2001). * Adams et al. (2005a) J. Adams et al., Nucl. Phys. A757, 102 (2005a). * Liu et al. (2007) H. Liu, K. Rajagopal, and U.A.Wiedemann, Phys. Rev. Lett. 98, 182301 (2007). * Bodwin et al. (1995) G. T. Bodwin, E. Braaten, and G. P. Lepage, Phys. Rev. D51, 1125 (1995), eprint hep-ph/9407339. * Brambilla et al. (2004) N. Brambilla et al. (2004), eprint hep-ph/0412158. * Ackermann et al. (2003) K. H. Ackermann et al., Nucl. Instrum Meth. A499, 624 (2003). * Beddo et al. (2003) M. Beddo et al., Nucl. Instrum. Meth. A499, 725 (2003). * Abelev et al. (2008a) B. I. Abelev et al. (2008a), eprint arXiv:0808.2041. * Abelev et al. (2008b) B. I. Abelev et al. (2008b), eprint arXiv:0810.4979. * Anderson et al. (2003) M. Anderson et al., Nucl. Instrum. Meth. A499, 659 (2003). * Xu et al. (2008) Y.-C. Xu et al. (2008), eprint arXiv:0807.4303. * Adams et al. (2005b) J. Adams et al., Phys. Rev. Lett. 94, 062301 (2005b). * Adare et al. (2007c) A. Adare et al., Phys. Rev. Lett. 98, 232002 (2007c). * Abe et al. (1997) F. Abe et al., Phys. Rev. Lett. 79, 572 (1997). * Acosta et al. (2005) D. E. Acosta et al., Phys. Rev. D71, 032001 (2005). * Sjostrand et al. (2006) T. Sjostrand, S. Mrenna, and P. Skands, JHEP 05, 026 (2006). * Tang (2009) Z. Tang, Ph.D. thesis, University of Science and Technology and China (2009). * Adams et al. (2003) J. Adams et al., Phys. Rev. Lett. 91, 172302 (2003). * Nayak et al. (2003) G. C. Nayak, M. X. Liu, and F. Cooper, Phys. Rev. D68, 034003 (2003), and private communication. * Artoisenet et al. (2008) P. Artoisenet et al., Phys. Rev. Lett. 101, 152001 (2008), and J.P. Lansberg private communication. * Banner et al. (1982) M. Banner et al., Phys. Lett. B115, 59 (1982). * Adams et al. (2006) J. Adams et al., Phys. Lett. B637, 161 (2006). * Adams et al. (2005c) J. Adams et al., Phys. Lett. B616, 8 (2005c). * Alper et al. (1975) B. Alper et al., Nucl. Phys. B100, 237 (1975). * Antreasyan et al. (1979) D. Antreasyan et al., Phys. Rev. D19, 764 (1979). * Albajar et al. (1991) C. Albajar et al., Phys. Lett. B256, 112 (1991). * Kourkoumelis et al. (1980) C. Kourkoumelis et al., Phys. Lett. B91, 481 (1980). * Clark et al. (1978) A. G. Clark et al., Phys. Lett. B74, 267 (1978). * Angelis et al. (1978) A. L. S. Angelis et al., Phys. Lett. B79, 505 (1978). * Adler et al. (2004) S. S. Adler et al., Phys. Rev. C69, 034910 (2004). * Bedjidian et al. (2004) M. Bedjidian et al. (2004), and R. Vogt private communication. * Adler et al. (2002) C. Adler et al., Phys. Rev. Lett. 89, 202301 (2002). * Adare et al. (2008) A. Adare et al., Phys. Rev. Lett. 101, 122301 (2008). * Gunji (2008) T. Gunji, J. Phys.G: Nucl. Part. Phys. 35, 104137 (2008). * Wicks et al. (2007) S. Wicks et al., Nucl. Phys. A784, 426 (2007), and W. A. Horowitz private communication. * Adil and Vitev (2007) A. Adil and I. Vitev, Phys. Lett. B649, 139 (2007), and I. Vitev private communication. * Xu (2002) X.-M. Xu, Nucl. Phys. A697, 825 (2002). * Adams et al. (2005d) J. Adams et al., Phys. Rev. Lett. 95, 152301 (2005d).
arxiv-papers
2009-04-02T19:26:22
2024-09-04T02:49:01.637604
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "STAR Collaboration: B. I. Abelev, et al", "submitter": "Zebo Tang", "url": "https://arxiv.org/abs/0904.0439" }
0904.0538
# Cesàro summation for random fields Allan Gut Uppsala University Ulrich Stadtmüller University of Ulm ###### Abstract Various methods of summation for divergent series of real numbers have been generalized to analogous results for sums of i.i.d. random variables. The natural extension of results corresponding to Cesàro summation amounts to proving almost sure convergence of the Cesàro means. In the present paper we extend such results as well as weak laws and results on complete convergence to random fields, more specifically to random variables indexed by $\mathbb{Z}_{+}^{2}$, the positive two-dimensional integer lattice points. ††footnotetext: AMS 2000 subject classifications. Primary 60F15, 60G50, 60G60, 40G05; Secondary 60F05. Keywords and phrases. Cesàro summation, sums of i.i.d. random variables, complete convergence, convergence in probability, almost sure convergence, strong law of large numbers. Abbreviated title. Cesàro summation for random fields. Date. ## 1 Introduction Various methods of summation for divergent series have been studied in the literature; see e.g. [10, 21]. Several analogous results have been proved for sums of independent, identically distributed (i.i.d.) random variables. The most commonly studied method is _Cesàro_ summation, which is defined as follows: Let $\\{x_{n},\,n\geq 0\\}$ be a sequence of real numbers and set, for $\alpha>-1$, $\displaystyle A_{n}^{\alpha}=\frac{(\alpha+1)(\alpha+2)\cdots(\alpha+n)}{n!},\quad n=1,2,\dots,\quad\mbox{ and}\quad A^{\alpha}_{0}=1.$ (1.1) The sequence $\\{x_{n},\,n\geq 0\\}$ is said to be $(C,\alpha)$-_summable_ iff $\displaystyle\frac{1}{A_{n}^{\alpha}}\sum_{k=0}^{n}A_{n-k}^{\alpha-1}x_{k}\quad\mbox{ converges as}\quad n\to\infty.$ (1.2) It is easily checked (with $A_{n}^{-1}=0$ for $n\geq 1$ and $A_{0}^{-1}=1$) that $(C,0)$-convergence is the same as ordinary convergence, and that $(C,1)$-convergence is the same as convergence of the arithmetic means. Now, let $\\{X_{k},\,k\geq 1\\}$ be i.i.d. random variables with partial sums $\\{S_{n},\,n\geq 1\\}$, and let $X$ be a generic random variable. The following result is a natural probabilistic analog of (1.2). ###### Theorem 1.1 Let $0<\alpha\leq 1$. The sequence $\\{X_{k},\,k\geq 1\\}$ is _almost surely (a.s.)_ $(C,\alpha)$-summable iff $E|X|^{1/\alpha}<\infty$. More precisely, $\frac{1}{A_{n}^{\alpha}}\sum_{k=0}^{n}A_{n-k}^{\alpha-1}X_{k}\stackrel{{\scriptstyle a.s.}}{{\to}}\mu\quad\mbox{ as}\quad n\to\infty\quad\mbox{ $\Longleftrightarrow$}\quad E|X|^{1/\alpha}<\infty\mbox{ and }E\,X=\mu.$ For $\alpha=1$ this is, of course, the classical Kolmogorov strong law. For proofs we refer to [14] ($\frac{1}{2}<\alpha<1$), [1] ($0<\alpha<\frac{1}{2}$) and [2] ($\alpha=\frac{1}{2}$). Convergence in probability for strongly integrable random variables taking their values in real separable Banach spaces was establised in [11] under the assumption of strong integrability. In the real valued case finite mean is not necessary; for $\alpha=1$ we obtain Feller’s weak law of large numbers for which a tail condition is both necessary and sufficient; cf. e.g. [8], Section 6.4.1. Next we present Theorem 2.1 of [7] where complete convergence was obtained. ###### Theorem 1.2 Let $0<\alpha\leq 1$. The sequence $\\{X_{k},\,k\geq 1\\}$ _converges completely to $\mu$_, i.e., $\sum_{n=1}^{\infty}P\big{(}\Big{|}\sum_{k=0}^{n}A_{n-k}^{\alpha-1}X_{k}-\mu\Big{|}>A_{n}^{\alpha}\varepsilon\big{)}<\infty\quad\mbox{ for every}\quad\varepsilon>0\,,$ if and only if $\begin{cases}E|X|^{1/\alpha}<\infty,&\quad\mbox{ for}\quad 0<\alpha<\frac{1}{2},\\\ E|X|^{2}\log^{+}|X|<\infty,&\quad\mbox{ for}\quad\alpha=\frac{1}{2},\\\ E|X|^{2}<\infty,&\quad\mbox{ for}\quad\frac{1}{2}<\alpha\leq 1,\end{cases}$ and $E\,X=\mu$. Here and in the following $\log^{+}x=\max\\{\log x,1\\}$. The aim of the present paper is to generalize these results to random fields. For simplicity we shall focus on random variables indexed by $\mathbb{Z}_{+}^{2}$, leaving the corresponding results for the index set $\mathbb{Z}_{+}^{d}$, $d>2$, to the readers. The definition of Cesàro summability for arrays extends as follows: ###### Definition 1.1 Let $\alpha,\,\beta>0$. The array $\\{x_{m,n},\,m,n\geq 0\\}$ is said to be $(C,\alpha,\beta)$-_summable_ iff $\displaystyle\frac{1}{A_{m}^{\alpha}A_{n}^{\beta}}\sum_{m,n}\,\sum_{k,l=0}^{m,n}A_{n-k}^{\alpha-1}A_{n-l}^{\beta-1}\,x_{k,l}\quad\mbox{ converges as}\quad m,n\to\infty\,.$ (1.3) Our setup thus is the set $\\{X_{k,l},\,(k,l)\in\mathbb{Z}_{+}^{2}\\}$ with partial sums $S_{m,n}$, $(m,n)\in\mathbb{Z}_{+}^{2}$. The Kolmogorov and Marcinkiewicz-Zygmund strong law runs as follows. ###### Theorem 1.3 Let $0<r<2$, and suppose that $X,\\{X_{\mathbf{k}},\,\mathbf{k}\in\mathbb{Z}^{d}\\}$ are i.i.d. random variables with partial sums $S_{\mathbf{n}}=\sum_{\mathbf{k}\leq\mathbf{n}}X_{\mathbf{k}}$, $\mathbf{n}\in\mathbb{Z}^{d}$. If $E|X|^{r}(\log^{+}|X|^{d-1})<\infty$, and $E\,X=0$ when $1\leq r<2$, then $\frac{S_{\mathbf{n}}}{|\mathbf{n}|^{1/r}}\stackrel{{\scriptstyle a.s.}}{{\to}}0\quad\mbox{ as}\quad\mathbf{n}\to\infty.$ Conversely, if almost sure convergence holds as stated, then $E|X|^{r}(\log^{+}|X|^{d-1})<\infty$, and $E\,X=0$ when $1\leq r<2$. Here $|\mathbf{n}|=\prod_{k=1}^{d}n_{i}$ and $\mathbf{n}\to\infty$ means $\inf_{1\leq k\leq d}n_{i}\to\infty$, that is, all coordinates tend to infinity. The theorem was proved in [18] for the case $r=1$ and, generally, in [5]. For the analogous weak laws a finite moment of order $r$ suffices (in fact, even a little less), since convergence in probability is independent of the order of the index set. The central object of investigation in the present paper is $\displaystyle\frac{1}{A_{m}^{\alpha}A_{n}^{\beta}}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}\,,$ (1.4) for which we shall establish conditions for convergence in probability, almost sure convergence and complete convergence Let us already at this point observe that for $\alpha=\beta=1$ the quantity in (1.4) reduces to that of Theorem 1.3 with $r=1$, that is, to the multiindex Kolmogorov strong law obtained in [18]. A second thought leads us to extensions of Theorem 1.3 to the case when we do not normalize the partial sums with the product of the coordinates raised to some power, but the product of the coordinates raised to _different_ powers, viz., to, for example ($d=2$), $\frac{S_{m,n}}{m^{\alpha}n^{\beta}}\,\quad\mbox{ for}\quad 0<\alpha<\beta\leq 1,$ (where thus the case $\alpha=\beta=1/r$ relates to Theorem 1.3). Here we only mention that some surprises occur depending on the domain of the parameters $\alpha$ and $\beta$. For details concerning this “asymmetric” Kolmogorov- Marcinkiewicz-Zygmund extension we refer to [9]. After some preliminaries we present our results for the different modes of convergence mentioned above. A final appendix contains a collection of so- called elementary but tedious calculations. ## 2 Preliminaries Here we collect some facts that will be used on and off, in general without specific reference. $\bullet$ The first fact we shall use is that whenever weak forms of convergence or sums of probabilites are inyvolved we may equivalently compute sums “backwards”, which, in view of the i.i.d. assumption shows that, for example $\displaystyle\sum_{m,n}\,\sum_{k,l=0}^{m,n}P(A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X_{k}|>A_{m}^{\alpha}A_{n}^{\beta})<\infty\iff\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(A_{k}^{\alpha-1}A_{l}^{\beta-1}|X|>A_{m}^{\alpha}A_{n}^{\beta})<\infty.$ (2.1) In the same vein the order of the index set is irrelevant, that is, one- dimensional results and methods remain valid. $\bullet$ Secondly we recall from (1.1) that $A^{\alpha}_{0}=1$ and that. $A_{n}^{\alpha}=\frac{(\alpha+1)(\alpha+2)\cdots(\alpha+n)}{n!},\quad n=1,2,\dots,$ which behaves asymptotically as $\displaystyle A_{n}^{\alpha}\sim\frac{n^{\alpha}}{\Gamma(\alpha+1)}\quad\mbox{ as}\quad n\to\infty,$ (2.2) where $\sim$ denotes that the limit as $n\to\infty$ of the ratio between the members on either side equals 1. Combining the two relations above tells us that $\displaystyle\sum_{m,n}\,\sum_{k,l=0}^{m,n}P(A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X|>A_{m}^{\alpha}A_{n}^{\beta})<\infty\quad\mbox{ $\Longleftrightarrow$}\quad\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(k^{\alpha-1}l^{\beta-1}|X|>m^{\alpha}n^{\beta})<\infty\,.$ (2.3) $\bullet$ We shall also make abundant use of the fact that if $\\{a_{k}\in\mathbb{R}$, $k\geq 1\\}$, then $\displaystyle a_{n}\to 0\quad\mbox{ as}\quad n\to\infty\quad\Longrightarrow\quad\frac{1}{n}\sum^{n}_{k=1}a_{k}\to 0\quad\mbox{ as}\quad n\to\infty,$ (2.4) that if, in addition, $w_{k}\in\mathbb{R}^{+}$, $k\geq 1$, with $B_{n}=\sum^{n}_{k=1}w_{k}$, $n\geq 1$, where $B_{n}\nearrow\infty$ as $n\to\infty$, then $\displaystyle\frac{1}{B_{n}}\sum^{n}_{k=1}w_{k}a_{k}\to 0\quad\mbox{ as}\quad n\to\infty,$ (2.5) as well as integral versions of the same. ## 3 Convergence in probability We thus begin by investigating convergence in probability. We do not aim at optimal conditions, except that, as will be seen, the weak law does not require finiteness of the mean (whereas the strong law does so). ###### Theorem 3.1 Let $0<\alpha\leq\beta\leq 1$ and suppose that $\\{X_{k,l},\,k,l\geq 0\\}$ are i.i.d. random variables. Further, set, for $0\leq k\leq m,\,0\leq l\leq n,$ $Y_{k,l}^{m,n}=A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}I\\{|X_{k,l}|\leq A_{m}^{\alpha}A_{n}^{\beta}\\},\quad S_{m,n}^{\prime}=\sum_{k,l=0}^{m,n}Y_{k,l}^{m,n}\quad\mbox{ and}\quad\mu_{m,n}=E\,S_{m,n}^{\prime}.$ Then $\displaystyle\frac{1}{A_{m}^{\alpha}A_{n}^{\beta}}\Big{(}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}-\mu_{m,n}\Big{)}\stackrel{{\scriptstyle p}}{{\to}}0\quad\mbox{ as}\quad m,n\to\infty$ (3.1) if $\displaystyle nP(|X|>n)\to 0\quad\mbox{ as}\quad n\to\infty\,.$ (3.2) If, in addition, $\displaystyle\frac{\mu_{m,n}}{A_{m}^{\alpha}A_{n}^{\beta}}\to 0\quad\mbox{ as}\quad m,n\to\infty,$ (3.3) then $\displaystyle\frac{1}{A_{m}^{\alpha}A_{n}^{\beta}}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}\stackrel{{\scriptstyle p}}{{\to}}0\quad\mbox{ as}\quad m,n\to\infty\,.$ (3.4) ###### Remark 3.1 _Condition ( 3.2) is short of $E|X|<\infty$, i.e., the theorem extends the Kolmogorov-Feller weak law [12], [13], and [3], Section VII.7, to a weak law for weigthed random fields for a class of weights decaying as powers of order less than 1 in each direction._ ###### Corollary 3.1 If, in addition, $E\,X=0$, then (3.4) holds (and if the mean $\mu$ is not equal to zero the limit in (3.4) equals $\mu$). ###### Corollary 3.2 If, in addition, the distribution of the summands is symmetric, then (3.2) alone suffices for (3.4) to hold. Proof of Theorem 3.1. The proof of the theorem amounts to an application of the so-called degenerate convergence criterion, see e.g. [8], Theorem 6.3.3. Recalling (2.1) and (2.3) we may, equivalently, prove the theorem for the respective powers of $k$ and $l$, viz., we redefine the truncated means as $\displaystyle Y_{k,l}^{m,n}=k^{\alpha-1}l^{\beta-1}X_{k,l}I\\{k^{\alpha-1}l^{\beta-1}\,|X_{k,l}|\leq m^{\alpha}n^{\beta}\\},$ (3.5) with partial sums and means as $\displaystyle S_{m,n}^{\prime}=\sum_{k,l=1}^{m,n}Y_{k,l}^{m,n}\quad\mbox{ and}\quad\mu_{m,n}=E\,S_{m,n}^{\prime}\,,$ (3.6) respectively. In order to check the conditions of the degenerate convergence criterion we thus wish to show that, if (3.2) is satisfied, then $\displaystyle\sum_{k,l=1}^{m,n}P(k^{\alpha-1}l^{\beta-1}|X|>m^{\alpha}n^{\beta})\to 0\quad\mbox{ as}\quad m,n\to\infty\,,$ (3.7) and that $\displaystyle\frac{1}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}\mathrm{Var\,}\big{(}Y_{k,l}^{m,n}\big{)}\to 0\quad\mbox{ as}\quad m,n\to\infty.$ (3.8) As for (3.7), $\sum_{k,l=1}^{m,n}P(k^{\alpha-1}l^{\beta-1}|X|>m^{\alpha}n^{\beta})=\frac{1}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}k^{\alpha-1}l^{\beta-1}\cdot m^{\alpha}n^{\beta}k^{1-\alpha}l^{1-\beta}P(k^{\alpha-1}l^{\beta-1}|X|>m^{\alpha}n^{\beta}),$ which converges to 0 as $m,n\to\infty$ via (2.5). In order to verify (3.8) we apply the usual “slicing device” to obtain $\displaystyle\hskip-24.0pt\frac{1}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}\mathrm{Var\,}\big{(}Y_{k,l}^{m,n}\big{)}\leq\frac{1}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}E\big{(}Y_{k,l}^{m,n}\big{)}^{2}$ $\displaystyle\hskip 24.0pt\leq\frac{1}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}E\big{(}k^{2(\alpha-1)}l^{2(\beta-1)}X^{2}I\\{k^{\alpha-1}l^{\beta-1}|X|\leq m^{\alpha}n^{\beta}\\}\big{)}$ $\displaystyle\hskip 24.0pt=\frac{1}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}k^{2(\alpha-1)}l^{2(\beta-1)}\sum_{j=1}^{mn^{\beta/\alpha}}E\big{(}X^{2}I\\{(j-1)^{\alpha}<k^{\alpha-1}l^{\beta-1}|X|\leq j^{\alpha}\\}\big{)}$ $\displaystyle\hskip 24.0pt\leq\frac{1}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}\sum_{j=1}^{mn^{\beta/\alpha}}j^{2\alpha}\,P\big{(}(j-1)^{\alpha}<k^{\alpha-1}l^{\beta-1}|X|\leq j^{\alpha}\big{)}$ $\displaystyle\hskip 24.0pt\leq\frac{C}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}\sum_{j=1}^{mn^{\beta/\alpha}}\Big{(}\sum_{i=1}^{j}i^{2\alpha-1}\Big{)}P\big{(}(j-1)^{\alpha}<k^{\alpha-1}l^{\beta-1}|X|\leq j^{\alpha}\big{)}$ $\displaystyle\hskip 24.0pt\leq\frac{C}{m^{2\alpha}n^{2\beta}}\sum_{k,l=1}^{m,n}\sum_{i=1}^{mn^{\beta/\alpha}}i^{2\alpha-1}\,P(|X|\geq i^{\alpha}k^{1-\alpha}l^{1-\beta})$ $\displaystyle\hskip 24.0pt=\frac{C}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}k^{\alpha-1}l^{\beta-1}\Big{(}\frac{1}{m^{\alpha}n^{\beta}}\sum_{i=1}^{mn^{\beta/\alpha}}i^{\alpha-1}\big{(}i^{\alpha}k^{1-\alpha}l^{1-\beta}\,P(|X|\geq i^{\alpha}k^{1-\alpha}l^{1-\beta})\big{)}\Big{)},$ $\displaystyle\hskip 24.0pt\to 0\quad\mbox{ as}\quad m,n\to\infty\,,$ by applying (2.5) twice to (3.2). This completes the proof of (3.1), from which (3.4) is immediate. $\Box$ Proof of Corollary 3.1. In order to conclude that also (3.4) holds we use the usual method to show that the normalized trruncated means tend to zero, where w.l.o.g. we assume that $E\,X=0$. Then $\displaystyle\hskip-48.0pt\Big{|}\frac{1}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}E\big{(}k^{(\alpha-1)}l^{(\beta-1)}XI\\{k^{(\alpha-1)}l^{(\beta-1)}|X|\leq m^{\alpha}n^{\beta}\\}\big{)}\Big{|}$ $\displaystyle=$ $\displaystyle\Big{|}-\frac{1}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}E\big{(}k^{(\alpha-1)}l^{(\beta-1)}XI\\{k^{(\alpha-1)}l^{(\beta-1)}|X|>m^{\alpha}n^{\beta}\\}\big{)}\Big{|}$ $\displaystyle\leq$ $\displaystyle\frac{1}{m^{\alpha}n^{\beta}}\sum_{k,l=1}^{m,n}E\big{(}k^{(\alpha-1)}l^{(\beta-1)}|X|I\\{k^{(\alpha-1)}l^{(\beta-1)}|X|>m^{\alpha}n^{\beta}\\}\big{)}\to 0\quad\mbox{ as}\quad n,m\to\infty.$ Proof of Corollary 3.2. Immediate, since the truncated means are (also) equal to zero. $\Box$ ## 4 Complete convergence ###### Theorem 4.1 Let $0<\alpha\leq\beta\leq 1$. The field $\\{X_{k,l},\,k,l\geq 0\\}$ _converges completely to $\mu$_, i.e., $\sum_{m\,n}P\big{(}\Big{|}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}-\mu\Big{|}>A_{m}^{\alpha}A_{n}^{\beta}\varepsilon\big{)}<\infty\quad\mbox{ for every}\quad\varepsilon>0\,,$ if and only if $\begin{cases}E|X|^{\frac{1}{\alpha}},&\quad\mbox{ for}\quad 0<\alpha<1/2\,,\;\alpha<\beta\leq 1,\\\\[6.0pt] E|X|^{\frac{1}{\alpha}}\log^{+}|X|,&\quad\mbox{ for}\quad 0<\alpha=\beta<\frac{1}{2},\\\\[6.0pt] E|X|^{2}(\log^{+}|X|)^{3},&\quad\mbox{ for}\quad\alpha=\beta=\frac{1}{2},\\\\[6.0pt] E|X|^{2}(\log^{+}|X|)^{2},&\quad\mbox{ for}\quad\alpha=\frac{1}{2}<\beta\leq 1,\\\\[6.0pt] E|X|^{2}\log^{+}|X|,&\quad\mbox{ for}\quad\frac{1}{2}<\alpha\leq\beta\leq 1.\end{cases}$ and $E\,X=\mu$. Proof. For the proof of the sufficiency we refer to the Appendix. As for the necessity, we argue as in [6], p. 59. We first suppose that the distribution is symmetric. Now, if complete convergence holds, then, using the fact that $\max_{0\leq k,l\leq m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X_{k,l}|\leq 2\max_{0\leq\mu,\nu\leq m,n}\Big{|}\sum_{k,l=0}^{\mu,\nu}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}\Big{|},$ together with the Lévy inequalities we must have, say, $\sum_{m,n}P\big{(}\max_{0\leq k,l\leq m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X_{k,l}|>A_{m}^{\alpha}A_{n}^{\beta}\big{)}<\infty\,,$ so that, by the first Borel-Cantelli lemma $P(A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X_{k,l}|>A_{m}^{\alpha}A_{n}^{\beta}\quad\mbox{i.o. for }1\leq k,l\leq m,n\,\,;m,n\geq 1)=0.$ At this point we use a device from [17], p. 379. Namely, if the sums $\sum_{k,l=1}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}$ were independent, we would conclude that $\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}|X|>A_{m}^{\alpha}A_{n}^{\beta})$ were finite. Since, however, finiteness of the sum is only a matter of the tail probabilities, the sum is also finite in the general case. An application of (A.6) now tells us that the finiteness of the sum is equivalent to the moment conditions as given in the statement of the theorem. This proves the necessity in the symmetric case. The general case follows the standard desymmetrization procedure, for which we use Theorem 3.1 in order to take care of the asymptotics for the normalized medians (cf. [5], p. 472 for analogous details in the multiindex setting of the Marcinkiewicz-Zygmund strong laws). $\Box$ ## 5 Almost sure convergence ###### Theorem 5.1 Let $0<\alpha\leq\beta\leq 1$. The field $\\{X_{k,l},\,k,l\geq 0\\}$ is _almost surely (a.s.)_ $(C,\alpha,\beta)$-summable, that is, $\frac{1}{A_{m}^{\alpha}A_{n}^{\beta}}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}\stackrel{{\scriptstyle a.s.}}{{\to}}\mu\quad\mbox{ as}\quad n,m\to\infty$ if and only if $\begin{cases}E|X|^{\frac{1}{\alpha}},&\quad\mbox{ for}\quad 0<\alpha<\beta\leq 1,\\\\[6.0pt] E|X|^{\frac{1}{\alpha}}\log^{+}|X|,&\quad\mbox{ for}\quad 0<\alpha=\beta\leq 1.\end{cases}$ and $E\,X=\mu$. Proof. Since complete convergence always implies almost sure convergence, the sufficiency follows immediately for the case $\alpha<1/2$. Thus, let in the following $1/2\leq\alpha\leq\beta\leq 1$. We first consider the symmetric case (and recall Section 2. In analogy with [11], p. 538, the moment assumptions permit us to choose an array $\\{\eta_{k,l},\,k,l\geq 1\\}$ of nonincreasing reals in $(0,1)$ converging to 0, and such that $\sum_{k,l=1}^{\infty}P(|X_{k,l}|>\eta_{k,l}k^{\alpha}l^{\beta})<\infty.$ Defining $Y_{k,l}=X_{k,l}I\\{|X_{k,l}|\leq\eta_{k,l}k^{\alpha}l^{\beta}\\}\quad\mbox{ and}\quad S_{m,n}^{\prime}=\sum_{k,l=0}^{m,n}Y_{k,l}^{m,n}\,,$ it thus remains to prove the theorem for the truncated sequence. This will be achieved via the multiindex Kolmogorov convergence criterion (see e.g [4]) and the multiindex Kronecker lemma (cf. [16]). The first series has just been taken care of, the second one vanishes since we are in the symmetric case, so it remains to check the third series. Toward that end, let, for $k,l\geq 1$, $Z_{k,l}=\frac{(m-k)^{\alpha-1}(n-l)^{\beta-1}}{m^{\alpha}n^{\beta}}Y_{k,l}\,.$ Then $\displaystyle|Z_{k,l}|\leq\frac{(m-k)^{\alpha-1}(n-l)^{\beta-1}}{m^{\alpha}n^{\beta}}k^{\alpha}l^{\beta}\eta_{k,l}\leq\eta_{k,l}\leq\eta_{00}.$ (5.1) Now, for any $\varepsilon>0$, arbitrarily small, we may choose our $\eta$-sequence such that $\eta_{00}<\varepsilon$, so that an application of the (iterated) Kahane-Hoffman-Jørgensen inequality (cf. [8], Theorem 3.7.5) yields $\displaystyle P\Big{(}\Big{|}\sum_{k,l=0}^{m,n}Z_{k,l}\Big{|}>3^{j}\varepsilon\Big{)}$ $\displaystyle\leq$ $\displaystyle C_{j}\bigg{(}P\Big{(}\Big{|}\sum_{k,l=0}^{m,n}Z_{k,l}\Big{|}>\varepsilon\Big{)}\bigg{)}^{2^{j}}$ $\displaystyle\leq$ $\displaystyle C_{j}\bigg{(}\frac{\sum_{k,l=0}^{m,n}\big{(}(m-k)^{(\alpha-1)}(n-l)^{\beta-1}\big{)}^{1/\alpha}E|X|^{1/\alpha}}{\big{(}\varepsilon m^{\alpha}n^{\beta}\big{)}^{1/\alpha}}\bigg{)}^{2^{j}}$ $\displaystyle=$ $\displaystyle C_{j}^{\prime}\bigg{(}\frac{\sum_{k,l=0}^{m,n}k^{(1-1/\alpha)}l^{(\beta-1)/\alpha}}{mn^{\beta/\alpha}}\bigg{)}^{2^{j}}$ $\displaystyle=$ $\displaystyle\begin{cases}C_{j}^{\prime\prime}\Big{(}\frac{1}{(mn)^{\frac{1}{\alpha}-1}}\Big{)}^{2^{j}},&\quad\mbox{ for}\quad\frac{1}{2}<\alpha<\beta<1,\\\\[6.0pt] C_{j}^{\prime\prime}\Big{(}\frac{\log m}{nm}\Big{)}^{2^{j}},&\quad\mbox{ for}\quad\frac{1}{2}=\alpha<\beta<1,\\\\[6.0pt] C_{j}^{\prime\prime}\Big{(}\frac{\log m\log n}{nm}\Big{)}^{2^{j}},&\quad\mbox{ for}\quad\frac{1}{2}=\alpha=\beta,\end{cases}$ (since the usual first term in the RHS vanishes in view of (5.1)). By choosing $j$ sufficiently large it then follows that $\sum_{m,n}\,\sum_{k,l=0}^{m,n}P\Big{(}\Big{|}\sum_{k,l=0}^{m,n}Z_{k,l}\Big{|}>3^{j}\varepsilon\Big{)}<\infty.$ By replacing $3^{j}\varepsilon$ by $\varepsilon$ we have thus, due to the arbitrariness of $\varepsilon$, shown that $\displaystyle P\big{(}|Z_{k,l}|>\varepsilon\mbox{ i.o.}\big{)}=0\quad\mbox{ for any}\quad\varepsilon>0,$ (5.2) from which the desired almost sure convergence follows via the multiindex Kronecker lemma referred to above. This proves the sufficiency in the symmetric case from which the general case follows by the standard desymmetrization procedure hinted at in the proof of Theorem 4.1. Finally, suppose that almost sure convergence holds as stated. It then follows that $\frac{A_{0}^{\alpha-1}A_{0}^{\beta-1}X_{m,n}}{A_{m}^{\alpha}A_{n}^{\beta}}\stackrel{{\scriptstyle a.s.}}{{\to}}0\quad\mbox{ as}\quad m,n\to\infty,$ and, hence, also that $\frac{X_{m,n}}{m^{\alpha}n^{\beta}}\stackrel{{\scriptstyle a.s.}}{{\to}}0\quad\mbox{ as}\quad m,n\to\infty,$ which, in view of i.i.d. assumption and the second Borel-Cantelli lemma, tells us that $\sum_{m,n}P(|X|>m^{\alpha}n^{\beta})<\infty,$ which, in turn, is equivalent to the given moment conditions. This concludes the proof of the theorem. $\Box$ ## 6 Concluding remarks We close with some comments on the present and related work. * • Convergence in probability has earlier been established in [11] via approximation with indicator variables, and under the assumption of finite mean. Our proof is simpler (more elementary) and presupposes only a Feller condition. * • As pointed out above, almost sure convergence was established in three steps ([14], [1] and [2]) with different proofs. Our proof, which also works for the case $d=1$, takes care of the whole proof in one go (since our proof also works for the case $\alpha<1/2$). * • For simplicity we have confined ourselves to the case $d=2$. The same ideas can be modified for the case $d>2$ and $(C,\alpha_{1},\alpha_{2},\ldots,\alpha_{d})$-summability. However, the moment conditions then depend on the number of $\alpha$:s that are equal to the smallest one (corresponding to $\alpha<\beta$ or $\alpha=\beta$ in the present paper); see [9] for Kolmogorov-Marcinkiewicz-Zygmund laws. * • Results on complete convergence are special cases of results on convergence rates. In this vein our results are extendable to results concerning $\sum_{m,n}n^{r-2}m^{r-2}P\big{(}\Big{|}\sum_{k,l=0}^{m,n}A_{m-k}^{\alpha-1}A_{n-l}^{\beta-1}X_{k,l}-\mu\Big{|}>A_{m}^{\alpha}A_{n}^{\beta}\varepsilon\big{)}<\infty\quad\mbox{ for every}\quad\varepsilon>0$ (cf. [7] for the case $d=1$). For the proofs one would need i.a. extensions of the relevant computations in the appendix below. ## Appendix A Appendix In this appendix we collect a number of so-called elementary but tedious calculations. First, let $0<\alpha\leq\beta<1$. Then $\displaystyle\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(k^{\alpha-1}l^{\beta-1}|X|>m^{\alpha}n^{\beta})<\infty\quad\mbox{ $\Longleftrightarrow$}\quad$ $\displaystyle\int_{1}^{\infty}\int_{1}^{\infty}\int_{1}^{x}\int_{1}^{y}P(|X|>u^{1-\alpha}v^{1-\beta}x^{\alpha}y^{\beta})\,dudvdxdy<\infty\quad\mbox{ $\Longleftrightarrow$}\quad$ $\displaystyle\hskip 56.9055pt\Big{[}u^{1-\alpha}x^{\alpha}=z,\qquad v^{1-\beta}y^{\beta}=w\Big{]}$ $\displaystyle\int_{1}^{\infty}\int_{1}^{\infty}\int_{x^{\alpha}}^{x}\int_{y^{\beta}}^{y}\Big{(}\frac{z}{x}\Big{)}^{\frac{\alpha}{1-\alpha}}\Big{(}\frac{w}{y}\Big{)}^{\frac{\beta}{1-\beta}}P(|X|>zw)\,dzdwdxdy<\infty\quad\mbox{ $\Longleftrightarrow$}\quad$ $\displaystyle\int_{1}^{\infty}\int_{1}^{\infty}\bigg{(}\int_{z}^{z^{1/\alpha}}\frac{dx}{x^{\frac{\alpha}{1-\alpha}}}\bigg{)}\bigg{(}\int_{w}^{w^{1/\beta}}\frac{dy}{y^{\frac{\beta}{1-\beta}}}\bigg{)}z^{\frac{\alpha}{1-\alpha}}w^{\frac{\beta}{1-\beta}}P(|X|>zw)\,dzdw<\infty\,.$ (A.1) In case $0<\alpha<\beta=1$ we have $\displaystyle\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(k^{\alpha-1}|X|>m^{\alpha}n)<\infty\quad\mbox{ $\Longleftrightarrow$}\quad$ $\displaystyle\int_{1}^{\infty}\int_{1}^{\infty}\bigg{(}\int_{z}^{z^{1/\alpha}}\frac{dx}{x^{\frac{\alpha}{1-\alpha}}}\bigg{)}z^{\frac{\alpha}{1-\alpha}}\,w\,P(|X|>zw)\,dzdw<\infty\,.$ (A.2) Next we note that $\displaystyle\int_{y}^{y^{1/\gamma}}\frac{dx}{x^{\frac{\gamma}{1-\gamma}}}\sim C\,\begin{cases}y^{\frac{1-2\gamma}{\gamma(1-\gamma)}},&\quad\mbox{ for}\quad 0<\gamma<\frac{1}{2},\\\ \log y,&\quad\mbox{ for}\quad\gamma=\frac{1}{2},\\\ y^{\frac{1-2\gamma}{1-\gamma}},&\quad\mbox{ for}\quad\frac{1}{2}<\gamma<1,\end{cases}$ (A.3) so that $\displaystyle\hskip-24.0pt\bigg{(}\int_{z}^{z^{1/\alpha}}\frac{dx}{x^{\frac{\alpha}{1-\alpha}}}\bigg{)}\bigg{(}\int_{w}^{w^{1/\beta}}\frac{dy}{y^{\frac{\beta}{1-\beta}}}\bigg{)}z^{\frac{\alpha}{1-\alpha}}w^{\frac{\beta}{1-\beta}}$ $\displaystyle\hskip 24.0pt\sim C\,\begin{cases}z^{\frac{1-\alpha}{\alpha}}w^{\frac{1-\beta}{\beta}},&\quad\mbox{ for}\quad 0<\alpha,\beta<\frac{1}{2},\\\ (zw)^{\frac{1-\alpha}{\alpha}},&\quad\mbox{ for}\quad 0<\alpha=\beta<\frac{1}{2},\\\ zw\log z\log w=\frac{zw}{2}\big{(}(\log zw)^{2}&\\\ \hskip 24.0pt-(\log z)^{2}-(\log w)^{2}\big{)},&\quad\mbox{ for}\quad\alpha=\beta=\frac{1}{2},\\\ z^{\frac{1-\alpha}{\alpha}}w\log w,&\quad\mbox{ for}\quad\alpha<\beta=\frac{1}{2},\\\ z^{\frac{1-\alpha}{\alpha}}w,&\quad\mbox{ for}\quad\alpha<\frac{1}{2}<\beta\leq 1,\\\ zw\log z,&\quad\mbox{ for}\quad\alpha=\frac{1}{2}<\beta\leq 1,\\\ zw,&\quad\mbox{ for}\quad\frac{1}{2}<\alpha\leq\beta\leq 1,\end{cases}$ from which it follows that $\displaystyle\hskip-24.0pt\int_{1}^{\infty}\int_{1}^{\infty}\bigg{(}\int_{z}^{z^{1/\alpha}}\frac{dx}{x^{\frac{\alpha}{1-\alpha}}}\bigg{)}\bigg{(}\int_{w}^{w^{1/\beta}}\frac{dy}{y^{\frac{\beta}{1-\beta}}}\bigg{)}z^{\frac{\alpha}{1-\alpha}}x^{\frac{\beta}{1-\beta}}P(|X|>zw)\,dzdw$ $\displaystyle\hskip 85.35826pt=\Big{[}x=zw,\qquad y=z\Big{]}$ $\displaystyle=\begin{cases}\int_{1}^{\infty}\int_{1}^{x}x^{\frac{1-\beta}{\beta}}y^{\frac{1}{\alpha}-\frac{1}{\beta}-1}P(|X|>x)\,dydx\\\\[4.0pt] \hskip 24.0pt=C\int_{1}^{\infty}x^{\frac{1}{\alpha}-1}P(|X|>x)\,dx,&\quad\mbox{ for}\quad 0<\alpha<\beta<\frac{1}{2},\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}x^{\frac{1-\alpha}{\alpha}}\frac{1}{y}P(|X|>x)\,dydx\\\\[4.0pt] \hskip 24.0pt=C\int_{1}^{\infty}x^{\frac{1-\alpha}{\alpha}}\log xP(|X|>x)\,dx,&\quad\mbox{ for}\quad 0<\alpha=\beta<\frac{1}{2},\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}\big{(}\frac{1}{2}x(\log x)^{2}\frac{1}{y}-x\frac{(\log y)^{2}}{y}\big{)}P(|X|>x)\,dxdy&\\\\[4.0pt] \hskip 24.0pt=\frac{1}{6}\int_{1}^{\infty}x(\log x)^{3}P(|X|>x)\,dx,&\quad\mbox{ for}\quad\alpha=\beta=\frac{1}{2},\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}xy^{\frac{1}{\alpha}-2}(\log x-\log y)P(|X|>x)\,dydx&\\\\[4.0pt] \hskip 24.0pt=C\int_{1}^{\infty}x^{\frac{1}{\alpha}-1}P(|X|>x)\,dx,&\quad\mbox{ for}\quad\alpha<\beta=\frac{1}{2},\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}xy^{\frac{1}{\alpha}-2}P(|X|>x)\,dydx\\\\[4.0pt] \hskip 24.0pt=C\int_{1}^{\infty}x^{\frac{1}{\alpha}-1}P(|X|>x)\,dx,&\quad\mbox{ for}\quad\alpha<\frac{1}{2}<\beta\leq 1,\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}x\frac{\log y}{y}P(|X|>x)\,dydx\\\\[4.0pt] \hskip 24.0pt=\frac{1}{2}\int_{1}^{\infty}x(\log x)^{2}P(|X|>x)\,dx,&\quad\mbox{ for}\quad\alpha=\frac{1}{2}<\beta\leq 1,\\\\[6.0pt] \int_{1}^{\infty}\int_{1}^{x}x\frac{1}{y}P(|X|>x)\,dydx\\\\[4.0pt] \hskip 24.0pt=\frac{1}{2}\int_{1}^{\infty}x\log xP(|X|>x)\,dx,&\quad\mbox{ for}\quad\frac{1}{2}<\alpha\leq\beta\leq 1.\end{cases}$ (A.4) Summarizing this we have shown that, for $0<\alpha\leq\beta<1$, $\displaystyle\hskip-24.0pt\sum_{m,n}\,\sum_{k,l=1}^{m,n}P(A_{k}^{\alpha-1}A_{l}^{\beta-1}|X|>A_{m}^{\alpha}A_{n}^{\beta})<\infty\quad\mbox{ $\Longleftrightarrow$}\quad$ (A.5) $\displaystyle\hskip 48.0pt\begin{cases}E|X|^{\frac{1}{\alpha}},&\quad\mbox{ for}\quad 0<\alpha<1/2,\,\alpha<\beta\leq 1,\\\\[6.0pt] E|X|^{\frac{1}{\alpha}}\log^{+}|X|,&\quad\mbox{ for}\quad 0<\alpha=\beta<\frac{1}{2},\\\\[6.0pt] E|X|^{2}(\log^{+}|X|)^{3},&\quad\mbox{ for}\quad\alpha=\beta=\frac{1}{2},\\\\[6.0pt] E|X|^{2}(\log^{+}|X|)^{2},&\quad\mbox{ for}\quad\alpha=\frac{1}{2}<\beta\leq 1,\\\\[6.0pt] E|X|^{2}\log^{+}|X|,&\quad\mbox{ for}\quad\frac{1}{2}<\alpha\leq\beta\leq 1.\end{cases}$ (A.6) ### Acknowledgement The work on this paper has been supported by Kungliga Vetenskapssamhället i Uppsala. Their support is gratefully acknowledged. In addition, the second author likes to thank his partner Allan Gut for the great hospitality during two wonderful and stimulating weeks at the University of Uppsala. ## References * [1] Chow, Y.S. and Lai, T.L. (1973). Limiting behavior of weighted sums of independent random variables. _Ann. Probab._ 1, 810-824. * [2] Déniel, Y. and Derriennic, Y. (1988). Sur la convergence presque sure, au sens de Cesàro d’ordre $\alpha$, $0<\alpha<1$, de variables aléatoires indépendantes et identiquement distribuées. _Probab. Th. Rel. Fields_ 79, 629-636. * [3] Feller, W. (1971). _An Introduction to Probability Theory and Its Applications, Vol 2_ , 2nd ed. Wiley, New York. * [4] Gabriel J.-P. (1977). An inequality for sums of independent random variables indexed by finite dimensional filtering sets and its applications to the convergence of series. _Ann. Probab._ 5, 779-786. * [5] Gut, A. (1978). Marcinkiewicz laws and convergence rates in the law of large numbers for random variables with multidimensional indices. _Ann. Probab._ 6, 469-482. * [6] Gut, A. (1992). Complete convergence for arrays. _Period. Math. Hungar._ 25, 51-75. * [7] Gut, A. (1993). Complete convergence and Cesàro summation for i.i.d. random variables. _Probab. Th. Rel. Fields_ 97, 169-178. * [8] Gut, A. (2007). Probability: A Graduate Course, Corr. 2nd printing. Springer-Verlag, New York. * [9] Gut, A. and Stadtmüller, U. (2008). An asymmetric Marcinkiewicz-Zygmund LLN for random fields. _Report U.U.D.M._ 2008:38, Uppsala University. * [10] Hardy, G.H. (1949). _Divergent Series._ Oxford University Press. * [11] Heinkel, B. (1990). An infinite-dimensional law of large numbers in Cesaro’s sense. _J. Theoret. Probab._ 3, 533-546. * [12] Kolmogorov, A.N. (1928). Über die Summen durch den Zufall bestimmter unabhängiger Größen. _Math. Ann._ 99, 309-319. * [13] Kolmogorov, A.N. (1930). Bemerkungen zu meiner Arbeit “Über die Summen zufälliger Größen”. _Math. Ann._ 102, 484-488. * [14] Lorentz G.G. (1955). Borel and Banach properties of methods of summation. _Duke Math. J._ 22, 129-141. * [15] Marcinkiewicz, J. and Zygmund, A. Sur les fonctions indépendantes. _Fund. Math._ 29, 60-90 (1937). * [16] Moore, C.N. (1966). _Summable Series and Convergence Factors._ Dover, New York. * [17] Nerman, O. (1981). On the convergence of supercritical general (C-M-J) branching processes. _Z. Wahrsch. verw. Gebiete_ 57, 365-395. * [18] Smythe, R. (1973). Strong laws of large number for $r$-dimensional arrays of random variables. _Ann. Probab._ 1, 164-170. * [19] Stadtmüller, U. and Thalmaier, M. (2008). Strong laws for delayed sums of random fields. Preprint, University of Ulm. * [20] Thalmaier, M. (2008): _Grenzwertsätze für gewichtete Summen von Zufallsvariablen und Zufallsfeldern_. Dissertation, University of Ulm. * [21] Zygmund, A. (1968). _Trigonometric Series._ Cambridge University Press. Allan Gut, Department of Mathematics, Uppsala University, Box 480, SE-751 06 Uppsala, Sweden; Email: allan.gut@math.uu.se URL: http://www.math.uu.se/~allan Ulrich Stadtmüller, Ulm University, Department of Number Theory and Probability Theory, D-89069 Ulm, Germany; Email ulrich.stadtmueller@uni-ulm.de URL: http://www.mathematik.uni- ulm.de/matheIII/members/stadtmueller/stadtmueller.html
arxiv-papers
2009-04-03T09:46:21
2024-09-04T02:49:01.651169
{ "license": "Public Domain", "authors": "Allan Gut (Uppsala University), Ulrich Stadtmueller (Ulm University)", "submitter": "Ulrich Stadtmueller", "url": "https://arxiv.org/abs/0904.0538" }
0904.0553
# Spectral Energy Distributions and Age Estimates of 39 Globular Clusters in M31 Jun Ma,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn Zhou Fan,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn 22affiliation: Graduate University, Chinese Academy of Sciences, Beijing, 100039, P. R. China Richard de Grijs,33affiliation: Department of Physics & Astronomy, The University of Sheffield, Hicks Building, Hounsfield Road, Sheffield S3 7RH, UK 11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn Zhenyu Wu,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn Xu Zhou,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn Jianghua Wu,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn Zhaoji Jiang,11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn and Jiansheng Chen11affiliation: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China; majun@vega.bac.pku.edu.cn ###### Abstract This paper supplements Jiang et al. (2003), who studied 172 M31 globular clusters (GCs) and globular cluster candidates from Battistini et al. (1987) on the basis of integrated photometric measurements in the Beijing-Arizona- Taiwan-Connecticut (BATC) photometric system. Here, we present multicolor photometric CCD data (in the BATC system) for the remaining 39 M31 GCs and candidates. In addition, the ages of 35 GCs are constrained by comparing our accurate photometry with updated theoretical stellar synthesis models. We use photometric measurements from GALEX in the far- and near-ultraviolet and 2MASS infrared $JHK_{s}$ data, in combination with optical photometry. Except for two clusters, the ages of the other sample GCs are all older than 1 Gyr. Their age distribution shows that most sample clusters are younger than 6 Gyr, with a peak at $\sim 3$ Gyr, although the ‘usual’ complement of well-known old GCs (i.e., GCs of similar age as the majority of the Galactic GCs) is present as well. ###### Subject headings: galaxies: individual (M31) – galaxies: star clusters – galaxies: stellar content ††slugcomment: AJ, in press ## 1\. Introduction The process of galaxy formation and evolution ranks among the most important outstanding problems in astrophysics (e.g., Perrett et al., 2002). One way to better understand the underlying questions is by studying globular clusters (GCs). GCs are often considered the fossils of the galaxy formation process, since they tend to form in the very early stage of their host galaxy’s evolution (Barmby et al., 2000). A GC is a densely packed, gravitationally bound, roughly spherical system of several thousand to about one million stars. They can be observed out to great distances, which implies that they can be used to study and probe the properties of extragalactic systems. The most distant GC systems studied to date are located in the Coma Cluster; their study has been facilitated by Hubble Space Telescope (HST) Wide Field and Planetary Camera-2 (WFPC2) observations (Baum et al., 1995; Kavelaars et al., 2000; Harris et al., 2000; Woodworth & Harris, 2000). M31 (NGC 224), the Andromeda galaxy, is an early-type spiral galaxy (type Sb), located at a distance of $\sim 780$ kpc (Stanek & Garnavich, 1998; Macri, 2001). It is the nearest and largest spiral galaxy in the Local Group of galaxies and has been the subject of many GC studies and surveys. Hubble (1932) first discovered 140 GC candidates characterized by $m_{\rm pg}\leq 18$ mag. Subsequently, a number of studies (Seyfert & Nassau, 1945; Hiltner, 1958; Mayall & Eggen, 1953; Kron & Mayall, 1960) identified $\sim 160$ GC candidates in M31. Vetes̆nik (1962) compiled the first major M31 GC catalog, containing about 300 GC candidates and including $UBV$ photometric data. The most extensive GC surveys have since been published by Sargent et al. (1977), Crampton et al. (1985), and the Bologna group (Battistini et al., 1980, 1987, 1993). In particular, Crampton et al. (1985) and Battistini et al. (1980, 1987, 1993) provided photometric data in either $UBV$ or $UBVR$. These surveys were mostly based on visual searches of photographic plates and are fairly complete down to $V=18$ mag ($M_{V}\sim-6.5$ mag) (Fusi Pecci et al., 1993), although a number of recent studies searched for fainter GCs in M31 (e.g., Mochejska et al., 1998; Barmby & Huchra, 2001; Kim et al., 2007). However, Galleti et al. (2006) showed that a significant number of class-D and E GCs with $V\gtrsim 17$ are still to be confirmed (and hence the GC luminosity function is incomplete), and that large surveys are needed to reach a complete sample of M31 GCs. Following on from the first extensive spectroscopic survey of M31 GCs by van den Bergh (1969), a significant number of authors (e.g., Huchra et al., 1982, 1991; Dubath & Grillmair, 1997; Federici et al., 1993; Jablonka et al., 1998; Barmby et al., 2000; Perrett et al., 2002; Galleti et al., 2006; Lee et al., 2008, and references therein) embarked on studies of their spatial, kinematic, and metal-abundance properties. The first comprehensive catalog including photometric and spectroscopic data for M31 GCs was assembled by Barmby et al. (2000). The Revised Bologna Catalog (RBC) of M31 GCs was recently published by Galleti et al. (2004) and has since been revised a number of times (Galleti et al., 2005, 2006, 2007). In the primary catalog (Galleti et al., 2004), all known M31 GCs and candidates were compiled based on a literature survey, leading to a total of 1164 entries including 337 confirmed GCs, 688 GC candidates, and 10 objects with undetermined classification. In addition, Galleti et al. (2004) identified 693 known and candidate GCs in M31 using the 2MASS database and included their 2MASS $JHK_{s}$ magnitudes. The latest RBC (V3.5) was updated on March 27, 2008, and includes the newly discovered star clusters from Mackey et al. (2006), Kim et al. (2007), and Huxor et al. (2008). In total, 1567 GCs and GC candidates (509 confirmed GCs and 1058 GC candidates) are known in M31; 421 former GC candidates turned out to be stars, asterisms, galaxies, Hii regions, or extended clusters. In addition, the RBC V3.5 includes photometric data of M31 GCs and GC candidates in the far- and near-ultraviolet (FUV and NUV) from the Nearby Galaxies Survey (NGS) of the Galaxy Evolution Explorer (GALEX) (Rey et al., 2007). Very recently, Caldwell et al. (2009) presented a new catalog of 670 likely star clusters in the field of M31, all with updated high-quality coordinates accurate to $0.2^{\prime\prime}$, based on images from either the Local Group Survey (Massey, 2006) or the Digital Sky Survey. An accurate and reliable analysis of integrated stellar populations (such as star clusters) is key to understanding the formation and evolutionary process in galaxies. By means of comparisons of integrated populations with models of homogeneous stellar systems, i.e., simple stellar populations (SSPs), recent studies have achieved some success in determining ages and masses for extragalactic star clusters (e.g., de Grijs et al., 2003a, b, c; Bik et al., 2003; Ma et al., 2006; Fan et al., 2006; Ma et al., 2007). Ma et al. (2006) and Fan et al. (2006) derived age estimates for M31 GCs by fitting SSP models (Bruzual & Charlot, 2003, henceforth BC03) to their photometric measurements in a large number of intermediate- and broad-band passbands from the optical to the near-infrared (NIR). For instance, Ma et al. (2007) constrained the age of the M31 GC S312 (B379), using multicolor photometry from the NUV to the NIR, to $9.5^{+1.15}_{-0.99}$ Gyr. S312 (B379) is among the first extragalactic GCs for which the age was estimated accurately using main-sequence photometry, i.e., Brown et al. (2004) estimated its age at $10^{+2.5}_{-1}$ Gyr. This was based on their analysis of the cluster’s color-magnitude diagram (CMD) below the main-sequence turn-off (MSTO) using extremely deep images obtained with the Advanced Camera for Surveys (ACS) on board the HST. They performed a quantitative comparison of their resolved stellar photometry with the isochrones of VandenBerg et al. (2006). In this paper we first describe our new observations and the relevant data- processing steps, as well as the complementary data used from the literature (§2). In §3 we quantitatively compare the spectral energy distributions (SEDs) of the GCs in our sample with the galev SSP models. Finally, our results and a summary are presented in §4. ## 2\. Database ### 2.1. The sample The GC sample used in this paper was taken from the Bologna catalog of Battistini et al. (1987), which contains 827 M31 GCs and GC candidates. In addition, our sample also supplements that of Jiang et al. (2003), who studied 172 GC candidates from Battistini et al. (1987) on the basis of integrated photometric measurements in the Beijing-Arizona-Taiwan-Connecticut (BATC) photometric system. In Jiang et al. (2003), all GC candidates of classes A and B (353 objects) in Battistini et al. (1987) (i.e., their Table IV) were adopted as their original sample. However, of these only 223 objects are in their observed CCD fields. They also noted that B007 is a galaxy, and B055, B132 and B147 are virtually stars (Barmby et al., 2000). These four objects were therefore not included in Jiang et al. (2003)’s final sample. In summary, 219 class-A or B GCs were observed by Jiang et al. (2003), of which 47 were excluded because of missing photometric measurements in some filters. In this paper we analyze these 47 GC candidates on the basis of newly observed data in the BATC photometric system combined with GALEX FUV/NUV photometry, broad-band $UBVRI$, and NIR $JHK_{s}$ (2MASS) data. However, we did not manage to obtain accurate photometric measurements for a number of objects because of either the dominance of a nearby very bright object (B095, B176, and B202), the GC candidate being very faint and superimposed on a very high background (B119 and B324), or the GC candidate being located near M32 (B124) or NGC 205 (B331), both also resulting in a very high contribution. In addition, object B330 is faint and located very close to a brighter object, rendering accurate photometry impossible. Thus, here we analyze the multicolor photometric properties of 39 GC candidates. Figure 1 shows the spatial distributions of both our sample GCs (circles) and the Jiang et al. (2003) GCs (plus signs) across the M31 field. Figure 1.— Spatial distribution of the GC candidates in M31. Circles and plus signs represent the samples discussed in this paper and by Jiang et al. (2003), respectively. The large ellipse is the M31 disk/halo boundary as defined by Racine (1991); the two small ellipses are the $D_{25}$ isophotes of NGC 205 (northwest) and M32 (southeast). ### 2.2. Observations and data reduction To obtain photometric measurements in the BATC photometric system for the 39 GC candidates for which Jiang et al. (2003) did not obtain photometry in a number of filters, we re-observed the objects. The BATC photometric system uses a Ford Aerospace 2048$\times$2048 CCD camera with a pixel size of 15 $\mu$m, mounted at the focus of the 0.6/0.9m $f$/3 Schmidt telescope at Xinglong Station (National Astronomical Observatories of China; NAOC). The CCD field of view is $58^{\prime}\times 58^{\prime}$, with a pixel size of $1.7^{\prime\prime}$. The multicolor BATC filter system includes 15 intermediate-band filters covering the wavelength range from 3300Å to 1 $\mu$m. These filters were specifically designed to avoid contamination from the brightest and most variable night-sky emission lines. The CCD camera is not sensitive at the shortest wavelengths covered by the BATC filters. For this reason, neither Jiang et al. (2003) nor we used the two bluest filters ($a$ and $b$) for our observations. Finding charts of the sample GCs and GC candidates in the BATC $g$ band (centered at 5795Å), obtained with the NAOC 60/90cm Schmidt telescope, are shown in Fig. 2. Thirteen hours of imaging of the M31 field of Jiang et al. (2003) were obtained through the usable set of 13 intermediate-band filters from November 15, 2003 to December 13, 2003. Bias subtraction and flat fielding using dome flats were done with the BATC automatic data-reduction software, pipeline i, originally developed for the BATC Multicolor Sky Survey (Fan et al., 1996; Zheng et al., 1999). The dome flat-field images were taken using a diffuser plate in front of the Schmidt telescope’s corrector plate. This flat-fielding technique was verified using photometry obtained for other galaxies and spectrophotometric observations (see, e.g., Fan et al., 1996; Zheng et al., 1999; Wu et al., 2002; Yan et al., 2000; Zhou et al., 2001, 2004). Spectrophotometric calibration of the M31 images was done by observations of four F-type subdwarfs, HD 19445, HD 84937, BD ${+26^{\circ}2606}$, and BD ${+17^{\circ}4708}$ (Oke & Gunn, 1983). Our magnitudes are therefore defined in the spectrophotometric AB magnitude system (i.e., the Oke & Gunn $\tilde{f_{\nu}}$ monochromatic system), $m_{\rm BATC}=-2.5{\rm log}\tilde{F_{\nu}}-48.60,$ (1) where $\tilde{F_{\nu}}$ is the appropriately averaged monochromatic flux in units of erg s-1 cm-2 Hz-1 at the effective wavelength of the specific passband. In the BATC system $\tilde{F_{\nu}}$ is defined as (Yan et al., 2000) $\tilde{F_{\nu}}=\frac{\int{\rm d}({\rm log}\nu)f_{\nu}r_{\nu}}{\int{\rm d}({\rm log}\nu)r_{\nu}},$ (2) which relates the magnitude to the number of photons detected rather than to the input flux (Fukugita et al., 1996). In Eq. (2), $r_{\nu}$ is the system’s response and $f_{\nu}$ the object’s SED. Spectrophotometric calibration of the M31 images using the Oke-Gunn standard stars was done during photometric nights (see for details Yan et al., 2000; Zhou et al., 2001). Using these standard-star images, we iteratively obtained atmospheric extinction curves and the variation of these extinction coefficients as a function of the time of night (cf. Yan et al., 2000; Zhou et al., 2001), $m_{\rm BATC}=m_{\rm inst}+[K+\Delta K({\rm UT})]X+C,$ (3) where $X$ is the airmass and $[K+\Delta K({\rm UT})]$ the time-dependent extinction term. The instrumental magnitudes ($m_{\rm inst}$) of selected bright, isolated, and unsaturated stars on the M31 images observed on photometric nights can be readily transformed to the BATC system ($m_{\rm BATC}$). The calibrated magnitudes of these stars were then used as secondary standards to uniformly combine images from calibrated nights with their counterparts observed on non-photometric nights. Table 1 lists the parameters of the BATC filters and the observational statistics; column 6 provides the scatter, in magnitudes, for the photometric observations of the four primary standard stars in each filter. Figure 2.— Finding charts of the sample GCs and GC candidates in the BATC $g$ band, obtained with the NAOC 60/90cm Schmidt telescope. The field of view of each image is $11^{\prime}\times 11^{\prime}$. ### 2.3. Integrated photometry For each M31 GC candidate we used the phot routine in DAOPHOT (Stetson, 1987) to obtain the integrated photometry. To avoid contamination from nearby objects, we adopted an aperture of $10.2^{\prime\prime}$ diameter, corresponding to 6 pixels. Inner and outer radii for background determination were taken at 8 and 13 pixels from the GC center. Given the small aperture used for the GC observations, aperture corrections were determined as follows. We used isolated stars to determine the magnitude difference between diameter of 6 pixels and the fully integrated magnitude of these stars in each of the 13 BATC filters used. The SEDs for our sample of 39 GCs and GC candidates were then corrected for the filter-specific differences, and these values are given in Table 2. Columns 2–14 give the magnitudes in the 13 BATC passbands used for our observations. For each object the second line lists the $1\sigma$ uncertainties in magnitude for the corresponding passband. The errors for each filter are given by DAOPHOT. The magnitudes of B129 in the $c$ and $d$ filters, and that of B195 in $p$ filter could not be obtained owing to low signal-to-noise ratios in these filters. ### 2.4. GALEX, broad-band, and 2MASS photometry To estimate the ages of the M31 sample GCs and GC candidates accurately, we use as many photometric data points covering as wide a wavelength range as possible (cf. de Grijs et al., 2003b; Anders et al., 2004). In addition, Kaviraj et al. (2007) showed that the combination of FUV and NUV photometry with optical observations in the standard broad bands enables one to efficiently break the age-metallicity degeneracy. Worthey (1994) showed that the age-metallicity degeneracy associated with optical broad-band colors is $\Delta{\rm age}/\Delta Z\sim 3/2$ (see also MacArthur et al., 2004). However, de Jong (1996) showed that this degeneracy can be partially broken by adding NIR photometry to optical colors, which was recently confirmed by Wu et al. (2005). Cardiel et al. (2003) found that the inclusion of an infrared (IR) passband can improve the predictive power of the stellar population diagnostics by $\sim 30$ times compared to using optical photometry alone. Since NIR photometry is less sensitive to interstellar extinction than the classical optical passbands, Kissler-Patig et al. (2002) and Puzia et al. (2002) also suggested that it provides useful complementary information that can help to disentangle the age-metallicity degeneracy (also see Galleti et al., 2004). Rey et al. (2007) published GALEX NUV and FUV photometric data for 485 and 273 M31 GCs, respectively. The photometric data for 28 (NUV) and 17 (FUV) of our M31 sample GCs in common is listed in Table 3\. Again, for each object the second line lists the photometric uncertainties for the corresponding passband. The GALEX photometric system is calibrated to match the spectrophotometric AB system. To date, the study of M31 GCs has been largely based on the excellent Bologna catalog (Battistini et al., 1980, 1987, 1993). Updates to the original RBC were provided by Galleti et al. (2004) who take as their photometric reference the dataset of Barmby et al. (2000) in order to obtain the most homogeneous set of photometric measurements available. Barmby et al. (2000) published optical and IR photometric data for 285 M31 GCs (see their Table 3), obtained with the 4-Shooter CCD mosaic camera and the SAO IR imager on the 1.2m telescope at the Fred Lawrence Whipple Observatory. Photometric measurements in the $UBVRI$ bands were published by Barmby et al. (2000) for most of our sample objects. Therefore, we preferentially adopt the $UBVRI$ measurements of Barmby et al. (2000). For the remaining GCs we follow Galleti et al. (2004), who updated the Bologna catalog with homogenised optical ($UBVRI$) photometry collected from the most recent photometric references available. Galleti et al. (2004) did not include the photometric uncertainties. Although we refer to the original papers, the uncertainties associated with the same object but based on the use of different photometric systems are often very different. In addition, Galleti et al. (2004) transformed their $UBVRI$ photometry to the reference system of Barmby et al. (2000) by applying offsets derived from objects in common between the relevant catalog and the data set of Barmby et al. (2000). The measurements are therefore internally consistent, and referencing the original uncertainties may be irrelevant. Therefore, we only adopted photometric uncertainties as suggested by Galleti et al. (2004), i.e., 0.05 mag in $BVRI$ and 0.08 mag in $U$. In fact, these photometric uncertainties do not affect our results significantly, as we showed in Fan et al. (2006) (see their §4.3 for details). Galleti et al. (2004) identified 693 known and candidate GCs in M31 using the 2MASS database, and determined their 2MASS $JHK_{s}$ photometric magnitudes (transformed to the CIT photometric system) (Elias et al., 1982, 1983). However, we need the original 2MASS $JHK_{s}$ magnitudes for our sample GCs to compare our observational SEDs with the SSP models, so we reversed this transformation using the same procedures. Since Galleti et al. (2004) did not provide the 2MASS $JHK_{s}$ uncertainties, we obtained these by comparing the photometric magnitudes with Fig. 2 of Carpenter et al. (2001). They show the observed photometric rms uncertainties as a function of magnitude for stars brighter than their observational completeness limits. We include the broad- band and 2MASS photometry (and the associated uncertainties) of the sample GCs in Table 3. We also list the new classification flags, following RBC V3.5 notation. From Table 3 we learn that B052 and B062 are classified as galaxies based on their radial velocities. We will therefore not estimate their ages below. ### 2.5. Comparison with previously published photometry The BATC intermediate-band system can easily be transformed to the $UBVRI$ broad-band system. Zhou et al. (2003) derived the relationships between these two systems using standard stars from the catalogs of Landolt (1983, 1992) and Galadí-Enríquez et al. (2000): $m_{B}=m_{d}+0.2201(m_{c}-m_{e})+0.1278\pm 0.076,$ (4) $m_{V}=m_{g}+0.3292(m_{f}-m_{h})+0.0476\pm 0.027.$ (5) To check our photometry we derived the magnitudes in $B$ and $V$ based on Eqs. (4) and (5). We transformed the magnitudes of our 39 GCs and GC candidates in the BATC $c,d$, $e$ bands to $B$-band photometry, and BATC $f,g$, and $h$-band measurements into $V$-band data. Fig. 3 shows a comparison of our $V$ and $(B-V)$ photometry with previously published measurements of Barmby et al. (2000) and Galleti et al. (2004). The mean $V$ magnitude and $(B-V)$ color differences (in the sense of this paper minus Barmby et al. (2000) or Galleti et al. (2004)) are $\langle\Delta V\rangle=-0.066\pm 0.013$ mag and $\langle\Delta(B-V)\rangle=-0.040\pm 0.017$ mag, respectively, thus showing excellent agreement. Figure 3.— Comparison of our newly obtained cluster photometry with previous measurements by Barmby et al. (2000) (triangles) and Galleti et al. (2004) (crosses). The dashed lines enclose $\pm 0.2$ mag in $V$ and $\pm 0.3$ mag in $B-V$. ### 2.6. Metallicities and reddening values To estimate the ages of our sample GCs accurately we required that our GCs have both independently determined metallicities and reddening values. We used three homogeneous sources for spectroscopic metallicities (Huchra et al., 1991; Barmby et al., 2000; Perrett et al., 2002) and one reference (Fan et al., 2008). Huchra et al. (1991) obtained spectroscopy of 150 M31 GCs and candidates with the Multiple Mirror Telescope (MMT). The system they used has a resolution of 8–9Å and enhanced blue sensitivity. To obtain many of the strongest and most metallicity-sensitive spectral features of interest in the ultraviolet, they extended their observations to the atmospheric cut-off at 3200Å (see details in Brodie & Huchra, 1990). The metallicities of these 150 objects were determined using six absorption-line indices from integrated cluster spectra employing the method of Brodie & Huchra (1990). Barmby et al. (2000) observed 61 M31 GCs and candidates spectroscopically using the Keck Low Resolution Imaging Spectrometer (LRIS) and the MMT Blue Channel spectrograph. With Keck LRIS, they used a 600 $\ell$ mm-1 grating with a 1.2Å pixel-1 dispersion from 3670–6200Å, and a resolution of 4–5Å. With the MMT Blue Channel, they used a 300 $\ell$ mm-1 grating with a 3.2Å pixel-1 dispersion from 3400–7200 Å, and a resolution of 9–11Å. They obtained the cluster metallicities on the basis of the Brodie & Huchra (1990) method as well. Perrett et al. (2002) determined metallicities for more than 200 M31 GCs and candidates using the Wide Field Fibre Optic Spectrograph (WYFFOS) at the 4.2m William Herschel Telescope. Their spectral range covers $\sim$ 3700–5600Å using two gratings, one of which (H2400B, 2400 $\ell$ mm-1) yields a dispersion of 0.8Å pixel-1 and a spectral resolution of 2.5Å over the range 3700–4500Å, and the other (R1200R, 1200 $\ell$ mm-1) yields a dispersion of 1.5Å pixel-1 and a spectral resolution of 5.1Å over the range 4400–5600Å. Perrett et al. (2002) calculated 12 absorption-line indices, again using the method of Brodie & Huchra (1990). Through a comparison of the line indices with published M31 GC [Fe/H] values from previous studies (Bònoli et al., 1987; Brodie & Huchra, 1990; Barmby et al., 2000), they found that the line indices of the CH (G band), Mg$b$, and Fe53 lines best represented their observed GCs. Therefore, Perrett et al. (2002) determined the metallicities of their sample targets using an unweighted mean of these three [Fe/H] values. Using metallicities from the literature (Huchra et al., 1991; Barmby et al., 2000; Perrett et al., 2002) combined with the RBC, Fan et al. (2008) determined 443 reddening values and intrinsic colors, as well as 209 metallicities for individual clusters without spectroscopic observations. To use all metallicities as coherently as possible we ranked the sources of M31 GCs metallicities, choosing Perrett et al. (2002) metallicities whenever available because of the large number of metallicity determinations. Metallicities from Barmby et al. (2000) and Huchra et al. (1991) were preferred if Perrett et al. (2002) determinations were not available. If spectroscopic metallicities were missing, we used Fan et al. (2008). Metallicities were not available for B089 and B226. As a consequence, we do not attempt to determine their ages (see details in §4). The final set of metallicities for the sample clusters is included in Table 4. For the reddening values of the sample GCs we refer to Barmby et al. (2000) and Fan et al. (2008). Barmby et al. (2000) determined the reddening for each cluster using correlations between optical and IR colors and metallicity, and by defining various ‘reddening-free’ parameters using their large database of multicolor photometry. Barmby et al. (2000) found that the M31 and Galactic GC extinction laws, and the M31 and Galactic GC color-metallicity relations are similar. They estimated the reddening to M31 objects with spectroscopic data using the relationship between intrinsic optical color and metallicity for Galactic clusters. For objects without spectroscopic data they used the relationships between the reddening-free parameters and certain intrinsic colors based on Galactic GC data. Following the methods in Barmby et al. (2000), Fan et al. (2008) (re-)determined reddening values for 443 clusters and cluster candidates. We choose Fan et al. (2008) reddening values whenever available because their reddening values comprise a homogeneous data set and they are larger than those of Barmby et al. (2000). The reddening values for the sample clusters are listed in Table 4. The values of extinction coefficient $R_{\lambda}$ are obtained by interpolating the interstellar extinction curve of Cardelli et al. (1989). ## 3\. Age determination ### 3.1. Stellar populations and synthetic photometry The most direct method to constrain the ages of different stellar populations involves comparing the observed luminosity levels of the MSTOs. Unfortunately, this approach is limited to the nearest GCs, where individual stars can be resolved and measured down to a few magnitudes fainter than the MSTO. Even in M31, the nearest large spiral galaxy, the MSTO is only reached for one GC (S312) (also see Brown et al., 2004; Rey et al., 2007; Ma et al., 2007). However, since the pioneering work of Tinsley (1968, 1972) and Searle et al. (1973) evolutionary population synthesis modeling has become a powerful tool for the interpretation of integrated spectrophotometric observations of galaxies as well as their components (see e.g. Anders et al., 2004). In evolutionary synthesis models, SSPs are modeled on the basis of a collection of evolutionary tracks of stars of different initial masses and a set of stellar spectra at different evolutionary stages. To estimate the ages of our sample GCs we compare their SEDs with the galev SSP models (e.g., Kurth et al., 1999; Schulz et al., 2002; Anders & Fritze-v. Alvensleben, 2003). The galev SSPs are based on the Padova isochrones (with the most recent versions using the updated Bertelli et al. (1994) isochrones, which include the thermally-pulsing asymptotic giant-branch [TP-AGB] phase), and a Salpeter (1955) stellar initial mass function with a lower-mass limit of $0.10~{}{\rm M}_{\odot}$ and the upper-mass limit between 50 and 70 ${\rm M}_{\odot}$, depending on metallicity. The full set of models spans the wavelength range from 91Å to 160 $\mu$m. These models cover ages from $4\times 10^{6}$ to $1.6\times 10^{10}$ yr, with an age resolution of 4 Myr for ages up to 2.35 Gyr, and 20 Myr for greater ages. Since our observational data consists of integrated luminosities through a given set of filters, we convolved the theoretical SSP SEDs with the GALEX FUV and NUV, broad-band $UBVRI$, BATC, and 2MASS $JHK_{s}$ filter response curves to obtain synthetic ultraviolet, optical, and NIR photometry for comparison. The synthetic magnitude in the AB magnitude system for the $i^{\rm th}$ filter can be computed as $m_{i}=-2.5\log\frac{\int_{\lambda}F_{\lambda}\varphi_{i}(\lambda){\rm d}\lambda}{\int_{\lambda}\varphi_{i}(\lambda){\rm d}\lambda}-48.60,$ (6) where $F_{\lambda}$ is the theoretical SED and $\varphi_{i}$ the response curve of the $i^{\rm th}$ filter of the GALEX FUV/NUV, $UBVRI$, BATC, and 2MASS $JHK_{s}$ photometric systems. Here, $F_{\lambda}$ changes as a function of age and metallicity. ### 3.2. Fitting results We use a $\chi^{2}$ minimization test to examine which galev SSP models are most compatible with the observed SEDs, following $\chi^{2}=\sum_{i=1}^{23}{\frac{[m_{\lambda_{i}}^{\rm intr}-m_{\lambda_{i}}^{\rm mod}(t)]^{2}}{\sigma_{i}^{2}}},$ (7) where $m_{\lambda_{i}}^{\rm mod}(t)$ is the integrated magnitude in the $i^{\rm th}$ filter of a theoretical SSP at age $t$, $m_{\lambda_{i}}^{\rm intr}$ represents the intrinsic integrated magnitude in the same filter, and $\sigma_{i}^{2}=\sigma_{{\rm obs},i}^{2}+\sigma_{{\rm mod},i}^{2}.$ (8) Here, $\sigma_{{\rm obs},i}^{2}$ is the observational uncertainty, and $\sigma_{{\rm mod},i}^{2}$ is the uncertainty associated with the model itself, for the $i^{\rm th}$ filter. Charlot et al. (1996) estimated the uncertainty associated with the term $\sigma_{{\rm mod},i}^{2}$ by comparing the colors obtained from different stellar evolutionary tracks and spectral libraries. Following Wu et al. (2005), Ma et al. (2006), and Fan et al. (2006) we adopt $\sigma_{{\rm mod},i}^{2}=0.05$. In fact, the values $\sigma_{{\rm mod},i}^{2}$ adopted do not change the best fits, but only affect the $\chi^{2}$ values. The galev SSP models include five initial metallicities, $Z=0.0004,0.004,0.008,0.02$ (solar metallicity), and 0.05. Spectra for other metallicities can be obtained by linear interpolation of the appropriate spectra for any of these metallicities. In addition, if the metallicity of a cluster is poorer than $Z=0.0004$, we only use the model of $Z=0.0004$. The best fits to the SEDs of our GCs are presented in Fig. 4. Figure 4.— Best-fitting integrated SEDs of the galev SSP models shown in relation to the intrinsic SEDs for our sample GCs. The photometric data points are represented by the symbols with error bars (vertical error bars for uncertainties and horizontal ones for the approximate wavelength coverage of each filter). Open circles represent the calculated magnitude of the model SEDs for each filter. Figure 4.— Continued. ## 4\. Results and summary In the previous Section we determined the ages of 35 M31 GCs and GC candidates. The results are listed in Table 5. The metallicity of B089 and B226, and the reddening of B089 had not been determined previously. From Fig. 5, which shows the age distribution of the sample clusters (see also Table 5) we conclude that, except for two clusters, the ages of the other sample GCs are all older than 1 Gyr. Most sample GCs are younger than 6 Gyr, with a peak at $\sim 3$ Gyr. The ‘usual’ complement of well-known old GCs (i.e., GCs of similar age as the majority of the Galactic GCs) is also present. Figure 5.— Age distribution of our sample GCs and GC candidates in M31. As discussed in §2.6, to estimate the ages of our sample GCs accurately we required that our GC sample have both independently determined metallicities and reddening values. For metallicity, we used Huchra et al. (1991), Barmby et al. (2000), and Perrett et al. (2002) as our reference data set. Since all of these authors determined the M31 GC metallicities using the calibration of Brodie & Huchra (1990), all three metallicity determinations are on the same [Fe/H] scale and there are no systematic offsets among any of these data sets (see details in Perrett et al., 2002). However, individual metallicity differences exist, which may affect our age estimates. Twelve GCs and GC candidates have two metallicity determinations, of which B004, B219, and B238 exhibit the largest differences ($>0.2$ dex). The metallicities of B004, B219, and B238 from Perrett et al. (2002) are $-0.31\pm 0.74$, $-0.01\pm 0.57$, and $-0.57\pm 0.66$ dex, compared to $-1.26\pm 0.59$, $-0.53\pm 0.53$, and $-1.22\pm 0.76$ dex from Huchra et al. (1991). Large metallicity differences lead to large age differences. The ages of B004, B219, and B238 are estimated at $4.10\pm 0.55$, $2.50\pm 0.15$, and $5.00\pm 0.45$ Gyr (based on the metallicities of Perrett et al., 2002), compared to $14.40\pm 0.75$, $11.60\pm 1.45$ and $14.40\pm 0.80$ Gyr (metallicities of Huchra et al., 1991). This implies that the accuracy of the metallicity determinations is very important for the corresponding age estimates. The age differences for the other 10 GCs are less than 1 Gyr based on the metallicities of both Perrett et al. (2002) and Huchra et al. (1991), except for B045: $8.80\pm 1.45$ Gyr versus $6.30\pm 0.45$ Gyr based on Perrett et al. (2002) and Huchra et al. (1991) metallicities, respectively. In general, the three different sources of spectroscopic metallicities provide homogeneous age estimates. For B004, B219, and B238 the signal-to-noise ratios of the observations of Huchra et al. (1991) and Perrett et al. (2002) are too low. High-quality spectral observations of these three GCs are needed. In addition, we point out that the metallicity calibration of Brodie & Huchra (1990) is solely based on old GCs. However, the sample GCs and GC candidates discussed in this paper are estimated to be young or of intermediate age, so that the age estimates may be somewhat biased by the adopted calibration. Barmby et al. (2000) discovered that M31 contains GCs exhibiting strong Balmer lines and A-type spectra, from which one infers that these GCs must be very young. Beasley et al. (2004) and Puzia et al. (2005) confirmed this conclusion of Barmby et al. (2000). Burstein et al. (2004) and Fusi Pecci et al. (2005) increased the sample of young M31 GCs to 67. Very recently, Caldwell et al. (2009) determined the ages and reddening values of 140 young clusters in M31 by comparing the observed spectra with model spectra, and these clusters are less than 2 Gyr old. Most have ages between $10^{8}$ and $10^{9}$ yr. The ages of the M31 clusters determined in this paper are in agreement with previous determinations. Many M31 GCs are resolved in HST observations. Some authors, including Ajhar et al. (1996), Fusi Pecci et al. (1996), Rich et al. (1996), Holland et al. (1997), Jablonka et al. (2000), Williams & Hodge (2001a), Williams & Hodge (2001b), and Rich et al. (2005), used WFPC2 images to construct CMDs for determination of the clusters’ metallicities, reddening values, and ages. However, these CMDs are usually not deep enough to show conspicuous MSTOs and thus be useful for robust age determinations. In fact, only Williams & Hodge (2001a) and Williams & Hodge (2001b) managed to estimate the ages for four blue massive, compact star clusters and 79 candidate young star clusters by fitting isochrones to the stellar photometry. Our sample contains four GCs in common with Ajhar et al. (1996) (B006 and B045), Fusi Pecci et al. (1996) (also B006 and B045), and Rich et al. (2005) (B012 and B233). However, only B012 (Rich et al., 2005) could be older than about 8 Gyr (see Gallart et al. 2005), given the presence of a prominent blue horizontal branch, which compares rather poorly with the age obtained here ($\sim 2$ Gyr). However, even with multi-passband photometry spanning from the FUV to $K_{s}$, we can only determine cluster ages in a statistical sense (also see Gallagher & Grebel, 2002; de Grijs et al., 2005). This discrepancy of a few Gyr highlights the difficulty of obtaining age estimates of unresolved intermediate-age clusters based on multi-passband photometry, given that the color evolution of SSPs is only minimally age dependent once the population has reached an age of $\sim 1-3$ Gyr. In addition, although the general age distribution of an entire cluster population (in a given galaxy) can be retrieved fairly self-consistently, the clusters’ individual age determinations depend rather strongly on the approach taken to fitting their ages (cf. de Grijs et al., 2005). This, combined with a strong dependence on the adopted reddening and metallicity, results in individual age estimates of intermediate-age clusters associated with large uncertainties. Cluster ages can also be derived by comparing observed with model spectra. Cross-identification of Beasley et al. (2004), Puzia et al. (2005), and Caldwell et al. (2009) with the sample in this paper reveals that only six GCs (and GC candidates) overlap with Puzia et al. (2005) (B006, B012, B045, and B232) and Caldwell et al. (2009) (B049 and B195). The age deerminations of two of these (B012 and B232) are inconsistent between Puzia et al. (2005) and this paper: $10.2\pm 2.9$ Gyr and $9.0\pm 3.3$ Gyr obtained by Puzia et al. (2005) compared to $2.0\pm 0.1$ Gyr and $2.0\pm 0.1$ Gyr, respectively, obtained in this paper. The ages of the other GCs are consistent among the different determinations. In fact, the ages of GCs derived by different authors based on a range of methods are not always consistent. For example, the ages of B292 and B327 derived by Beasley et al. (2004) and Puzia et al. (2005) are $2.748\pm 1.151$ Gyr and $0.080\pm 0.929$ Gyr (Beasley et al., 2004) compared to $9.2\pm 3.3$ Gyr and $5.4\pm 1.4$ Gyr (Puzia et al., 2005), respectively. On the other hand, Caldwell et al. (2009) estimated the age of B327 at $0.050$ Gyr. In addition, the ages of clusters derived in the same paper but based on different line-index measurements are not always consistent either and may indeed differ significantly (see the upper panels of Fig. 5 in Puzia et al., 2005). ## Acknowledgments We are indebted to the referee for thoughtful comments and insightful suggestions that improved this paper greatly. This study has been supported by the Chinese National Natural Science Foundation through grants 10873016, 10803007, 10473012, 10573020, 10633020, 10673012, and 10603006, and by National Basic Research Program of China (973 Program), No. 2007CB815403. ## References * Ajhar et al. (1996) Ajhar, E. A., Grillmair, C. J., Lauer, T. R., Baum, W. A., Faber, S. M., Holtzman, J. A., Lynds, C. R., & O’Neil, E. J. 1996, AJ, 111, 1110 * Anders & Fritze-v. Alvensleben (2003) Anders, P., & Fritze-v. Alvensleben, U. 2003, A&A, 401, 1063 * Anders et al. (2004) Anders, P., Bissantz, N., Fritze-v. Alvensleben, U., & de Grijs, R. 2004, MNRAS, 347, 196 * Barmby et al. (2000) Barmby, P., Huchra, J., Brodie, J., Forbes, D., Schroder, L., & Grillmair, C. 2000, AJ, 119, 727 * Barmby & Huchra (2001) Barmby, P., & Huchra, J. P. 2001, AJ, 122, 2458 * Battistini et al. (1980) Battistini, P., Bònoli, F., Braccesi, A., Fusi Pecci, F., Malagnini, M. L., & Marano, B. 1980, A&AS, 42, 357 * Battistini et al. (1987) Battistini, P., Bònoli F., Braccesi, A., Federici, L., Fusi Pecci, F., Marano, B., & Börngen, F. 1987, A&AS, 67, 447 * Battistini et al. (1993) Battistini, P., Bònoli, F., Casavecchia, M., Ciotti, L., Federici, L., & Fusi Pecci F. 1993, A&A, 272, 77 * Baum et al. (1995) Baum, W. A., Hammergren, M., Groth, E. J., Ajhar, E. A., & Lauer, T. R., et al. 1995, AJ, 110, 2537 * Beasley et al. (2004) Beasley, M. A., et al. 2004, AJ, 128, 1623 * Bertelli et al. (1994) Bertelli, G., Bressan, A., Chiosi, C., Fagotto, F., & Nasi, E. 1994, A&AS, 106, 275 * Bik et al. (2003) Bik, A., Lamers, H. J. G. L. M., Bastian, N., Panagia, N., & Romaniello, M. 2003, A&A, 397, 473 * Bònoli et al. (1987) Bònoli, F., Delpino, F., Federici, L., & Fusi Pecci, F. 1987, A&A, 185, 25 * Brodie & Huchra (1990) Brodie, J. P., & Huchra, J. P. 1990, ApJ, 362, 503 * Brown et al. (2004) Brown, T. M., et al. 2004, ApJ, 613, L125 * Bruzual & Charlot (2003) Bruzual, A. G., & Charlot, S. 2003, MNRAS, 344, 1000 (BC03) * Burstein et al. (2004) Burstein, D., et al. 2004, ApJ, 614, 158 * Caldwell et al. (2009) Caldwell, N., Harding, P., Morrison, H., Rose, J. A., Schiavon, R., Kriessler, J. 2009, AJ, 137, 94 * Cardelli et al. (1989) Cardelli, J. A., Clayton, G. C., & Mathis, J. S. 1989, ApJ, 345, 245 * Cardiel et al. (2003) Cardiel, N., Gorgas, J., Sánchez-Blázquez, P., Cenarro, A. J., Pedraz, S., Bruzual, A. G., & Klement, J. 2003, A&A, 409, 511 * Carpenter et al. (2001) Carpenter, J. M., Hillenbrand, L. A., & Skrutskie, M. F. 2001, AJ, 121, 3160 * Charlot et al. (1996) Charlot, S., Worthey, G., & Bressan, A. 1996, ApJ, 457, 625 * Crampton et al. (1985) Crampton, D., Cowley, A. P., Schade, D., & Chayer, P. 1985, ApJ, 288, 494 * de Grijs et al. (2003a) de Grijs, R., Bastian, N., & Lamers, H. J. G. L. M. 2003a, MNRAS, 340, 197 * de Grijs et al. (2003b) de Grijs, R., Fritze-v. Alvensleben, U., Anders, P., Gallagher, J. S., Bastian, N., Taylor, V. A., & Windhorst, R. A. 2003b, MNRAS, 342, 259 * de Grijs et al. (2003c) de Grijs, R., Anders, P., Lynds, R., Bastian, N., Lamers, H. J. G. L. M., & O’Neill, E. J. Jr. 2003c, MNRAS, 343, 1285 * de Grijs et al. (2005) de Grijs, R., Anders, P., Lamers, H. J. G. L. M., Bastian, N., Parmentier, G., Sharina, M. E., & Yi, S., 2005, MNRAS, 359, 874 * de Jong (1996) de Jong, R. S. 1996, A&A, 313, 377 * Dubath & Grillmair (1997) Dubath, P., & Grillmair, C. J. 1997, A&A, 321, 379 * Elias et al. (1982) Elias, J. H., Frogel, J. A., Matthews, K., & Neugebauer, G. 1982, AJ, 87, 1029 * Elias et al. (1983) Elias, J. H., Frogel, J. A., Hyland, A. R., & Jones, T. J. 1983, AJ, 88, 1027 * Fan et al. (1996) Fan, X., et al. 1996, AJ, 112, 628 * Fan et al. (2006) Fan, Z., Ma, J., de Grijs, R., Yang, Y., & Zhou, X. 2006, MNRAS, 371, 1648 * Fan et al. (2008) Fan, Z., Ma, J., de Grijs, R., & Zhou, X. 2008, MNRAS, 385, 1973 * Federici et al. (1993) Federici, L., Bonoli, F., Ciotti, L., Fusi Pecci, F., Marano, B., Lipovetsky, V. A., Neizvestny, S. I., & Spassova, N. 1993, A&A, 274, 87 * Fukugita et al. (1996) Fukugita, M., et al. 1996, AJ, 111, 1748 * Fusi Pecci et al. (1993) Fusi Pecci, F., Cacciari, C., Federici, L., & Pasquali, A. 1993, in: The Globular Cluster-Galaxy Connection, eds. G. H. Smith, J. P. Brodie, Vol. 48, p. 410 * Fusi Pecci et al. (1996) Fusi Pecci, F., et al. 1996, AJ, 112, 1461 * Fusi Pecci et al. (2005) Fusi Pecci, F., Bellazzini, M., Buzzoni, A., De Simone, E., Federici, L., & Galleti, S. 2005, AJ, 130, 554 * Galadí-Enríquez et al. (2000) Galadŕ-Enrŕquez, D., Trullols, E., & Jordi, C. 2000, A&AS, 146, 169 * Gallagher & Grebel (2002) Gallagher, J. S., & Grebel, E. K. 2002, IAU Symp. 207, Extragalactic Star Clusters, ed. D. Geisler, E. K. Grebel, & D. Minniti (San Francisco: ASP), 745 * Gallart et al. (2005) Gallart, C., Zoccali, M., & Aparicio, A. 2005, ARA&A, 43, 387 * Galleti et al. (2004) Galleti, S., Federici, L., Bellazzini, M., Fusi Pecci, F., & Macrina, S. 2004, A&A, 426, 917 * Galleti et al. (2005) Galleti, S., Bellazzini, M., Federici, L., & Fusi Pecci, F. 2005, A&A, 436, 535 * Galleti et al. (2006) Galleti, S., Federici, L., Bellazzini, M., Buzzoni, A., & Fusi Pecci, F. 2006, A&A, 456, 985 * Galleti et al. (2007) Galleti, S., Bellazzini, M., Federici, L., Buzzoni, A., & Fusi Pecci, F. 2007, A&A, 471, 127 * Harris et al. (2000) Harris, W. E., Kavelaars, J. J., Hanes, D. A., Hesser, J. E., & Pritchet C. J. 2000, ApJ, 533, 137 * Hiltner (1958) Hiltner, W. A. 1958, ApJ, 128, 9 * Holland et al. (1997) Holland, S., Fahlman, G. G., & Richer, H. B. 1997, AJ, 114, 1488 * Hubble (1932) Hubble, E. P. 1932, ApJ, 76, 44 * Huchra et al. (1982) Huchra, J., Stauffer, J., & van Speybroeck, L. 1982, ApJ, 259, L57 * Huchra et al. (1991) Huchra, J. P., Brodie, J. P., & Kent, S. M. 1991, ApJ, 370, 495 * Huxor et al. (2008) Huxor, A. P., Tanvir, N. R., Ferguson, A. M. N., Irwin, M. J., Ibata, R., Bridges, T., & Lewis, G. F. 2008, MNRAS, 385, 1989 * Jablonka et al. (1998) Jablonka, P., Bica, E., Bonatto, C., Bridges, T. J., Langlois, M., & Carter, D. 1998, A&A, 335, 867 * Jablonka et al. (2000) Jablonka, P., Courbin, F., Meylan, G., Sarajedini, A., Bridges, T. J., & Magain, P. 2000, A&A, 359, 131 * Jiang et al. (2003) Jiang, L., Ma, J., Zhou, X., Chen, J., Wu, H., & Jiang Z. 2003, AJ, 125, 727 * Kavelaars et al. (2000) Kavelaars, J. J., Harris, W. E., Hanes, D. A., Hesser, J. E., & Pritchet, C. J. 2000, ApJ, 533, 125 * Kaviraj et al. (2007) Kaviraj, S., Rey, S. C., Rich, R. M., Yoon, S. J., & Yi, S. K. 2007, MNRAS, 381, L74 * Kim et al. (2007) Kim, S., et al. 2007, AJ, 134, 706 * Kissler-Patig et al. (2002) Kissler-Patig, M., Brodie, J. P., & Minniti, D. 2002, A&A, 391, 441 * Kron & Mayall (1960) Kron, G. E., & Mayall N. U. 1960, AJ, 65, 581 * Kurth et al. (1999) Kurth, O. M., Fritze-v. Alvensleben, U., & Fricke, K. J. 1999, A&AS, 138, 19 * Landolt (1983) Landolt, A. U. 1983, AJ, 88, 439 * Landolt (1992) Landolt, A. U. 1992, AJ, 104, 340 * Lee et al. (2008) Lee, M. G., Hwang, H. S., Kim, S. C., Park, H. S., Geisler, D., Sarajedini, A., & Harris, W. E. 2008, ApJ, 674, 886 * Ma et al. (2006) Ma, J., de Grijs, R., Yang, Y., Zhou, X., Chen, J., Jiang, Z., Wu, Z., & Wu, J. 2006, MNRAS, 368, 1443 * Ma et al. (2007) Ma, J., et al. 2007, ApJ, 659, 359 * MacArthur et al. (2004) MacArthur, L. A., Courteau, S., Bell, E., & Holtzman, J. A. 2004, ApJS, 152, 175 * Mackey et al. (2006) Mackey, A. D., Huxor, A., Ferguson, A. M. N., Tanvir, N. R., Irwin, M., Ibata, R., Bridges, T., Johnson, R. A., & Lewis, G. ApJ, 653, 105 * Mayall & Eggen (1953) Mayall, N. U., & Eggen, O. J. 1953, PASP, 65, 24 * Macri (2001) Macri, L. M. 2001, ApJ, 549, 721 * Massey (2006) Massey, P., Olsen, K. A. G., Hodge, P. W., Strong, S, B., Jacoby, G. H., Schlingman, W., & Smith, R. C. 2006, AJ, 131, 2478 * Mochejska et al. (1998) Mochejska, B. J., Kaluzny, J., Krockenberger, M., Sasselov, D. D., & Stanek, K. Z. 1998, AcA, 48, 455 * Oke & Gunn (1983) Oke, J. B., & Gunn J. E. 1983, ApJ, 266, 713 * Perrett et al. (2002) Perrett, K. M., Bridges, T. J., Hanes, D. A., Irwin, M. J., Brodie, J. P., Carter, D., Huchra, J. P., & Watson, F. G. 2002, AJ, 123, 2490 * Puzia et al. (2002) Puzia, T. H., Saglia, R. P., Kissler-Patig, M., Maraston, C., Greggio, L., Renzini, A., & Ortolani, S. 2002, A&A, 395, 45 * Puzia et al. (2005) Puzia, T. H., Perrett, K. M., & Bridges, T. J. 2005, A&A, 434, 909 * Racine (1991) Racine, R. 1991, AJ, 101, 865 * Rey et al. (2007) Rey, S. C., et al. 2007, ApJS, 173, 643 * Rich et al. (1996) Rich, R. M., Mighell, K. J., Freedman, W. L., & Neill, J. D. 1996, AJ, 111, 768 * Rich et al. (2005) Rich, R. M., Corsi, C. E., Cacciari, C., Federici, L., Fusi Pecci, F., Djorgovski, S. G., & Freedman, W. L. 2005, AJ, 129, 2670 * Salpeter (1955) Salpeter, E. E. 1955, ApJ, 121, 161 * Sargent et al. (1977) Sargent, W. L. W., Kowal, C. T., Hartwick, F. D. A., & van den Bergh, S. 1977, AJ, 82, 947 * Schulz et al. (2002) Schulz, J., Fritze-v. Alvensleben, U., Möller, C. S., & Fricke, K. J. 2002, A&A, 392, 1 * Searle et al. (1973) Searle, L., Sargent, W. L. W., & Bagnuolo, W. G. 1973, ApJ, 179, 427 * Seyfert & Nassau (1945) Seyfert, C. K., & Nassau, J. J. 1945, ApJ, 102, 377 * Stanek & Garnavich (1998) Stanek K. Z., & Garnavich, P. M. 1998, ApJ, 503, 131 * Stetson (1987) Stetson, P. B. 1987, PASP, 99, 191 * Tinsley (1968) Tinsley, B. M. 1968, ApJ, 151, 547 * Tinsley (1972) Tinsley, B. M. 1972, ApJ, 178, 319 * VandenBerg et al. (2006) VandenBerg, D. A., Bergbusch, P. A., & Dowler, P. D. 2006, ApJS, 162, 375 * van den Bergh (1969) van den Bergh, S. 1969, ApJS, 19, 145 * Vetes̆nik (1962) Vetes̆nik, M. 1962, Bull. Astron. Inst. Czech., 13, 182 * Williams & Hodge (2001a) Williams, B. F., & Hodge, P. W. 2001a, ApJ, 548, 190 * Williams & Hodge (2001b) Williams, B. F., & Hodge, P. W. 2001b, ApJ, 559, 851 * Woodworth & Harris (2000) Woodworth, S. C., & Harris, W. E. 2000, AJ, 119, 2699 * Worthey (1994) Worthey, G. 1994, ApJS, 95, 107 * Wu et al. (2002) Wu, H., et al. 2002, AJ, 123, 1364 * Wu et al. (2005) Wu, H., Shao, Z. Y., Mo, H. J., Xia, X. Y., & Deng, Z. G. 2005, ApJ, 622, 244 * Yan et al. (2000) Yan, H. J., et al. 2000, PASP, 112, 691 * Zheng et al. (1999) Zheng, Z. Y., et al. 1999, AJ, 117, 2757 * Zhou et al. (2001) Zhou, X., Jiang, Z. J., Xue, S. J., Wu, H., Ma, J., & Chen, J. S. 2001, ChJAA, 1, 372 * Zhou et al. (2003) Zhou, X., et al. 2003, A&A, 397, 361 * Zhou et al. (2004) Zhou, X., et al. 2004, AJ, 127, 3642 Table 1BATC filter parameters and observational statistics Filter | $\lambda_{\rm central}$ (Å) | FWHM (Å) | Na | Exp.b | rmsc ---|---|---|---|---|--- $c$ | 4210 | 320 | 3 | 01:00 | 0.015 $d$ | 4540 | 340 | 3 | 01:00 | 0.009 $e$ | 4925 | 390 | 3 | 01:00 | 0.015 $f$ | 5270 | 340 | 3 | 01:00 | 0.006 $g$ | 5795 | 310 | 3 | 01:00 | 0.003 $h$ | 6075 | 310 | 3 | 01:00 | 0.003 $i$ | 6656 | 480 | 3 | 01:00 | 0.003 $j$ | 7057 | 300 | 3 | 01:00 | 0.008 $k$ | 7546 | 330 | 3 | 01:00 | 0.004 $m$ | 8023 | 260 | 3 | 01:00 | 0.003 $n$ | 8480 | 180 | 6 | 02:00 | 0.004 $o$ | 9182 | 260 | 6 | 02:00 | 0.003 $p$ | 9739 | 270 | 6 | 02:00 | 0.009 a Number of exposures for each BATC filter b Exposure time (in hr:min) cZero-point error (in mag) Table 2BATC intermediate-band photometry of our sample of 39 GCs and GC candidates in M31. Name | $c$ | $d$ | $e$ | $f$ | $g$ | $h$ | $i$ | $j$ | $k$ | $m$ | $n$ | $o$ | $p$ ---|---|---|---|---|---|---|---|---|---|---|---|---|--- B004 | 17.71 | 17.49 | 17.22 | 17.06 | 16.72 | 16.61 | 16.44 | 16.34 | 16.21 | 16.03 | 16.09 | 15.91 | 16.01 | 0.130 | 0.012 | 0.008 | 0.009 | 0.009 | 0.008 | 0.008 | 0.009 | 0.010 | 0.009 | 0.021 | 0.010 | 0.024 B006 | 16.68 | 16.17 | 15.84 | 15.67 | 15.29 | 15.25 | 15.09 | 14.98 | 14.82 | 14.67 | 14.70 | 14.58 | 14.53 | 0.009 | 0.005 | 0.004 | 0.004 | 0.004 | 0.004 | 0.004 | 0.003 | 0.004 | 0.003 | 0.008 | 0.005 | 0.008 B008 | 17.83 | 17.33 | 17.04 | 16.88 | 16.51 | 16.43 | 16.26 | 16.14 | 16.01 | 15.87 | 15.73 | 15.80 | 15.73 | 0.016 | 0.010 | 0.007 | 0.008 | 0.008 | 0.007 | 0.008 | 0.008 | 0.009 | 0.007 | 0.015 | 0.011 | 0.019 B010 | 17.48 | 17.21 | 16.94 | 16.79 | 16.50 | 16.44 | 16.25 | 16.17 | 16.10 | 15.95 | 16.00 | 15.83 | 15.82 | 0.014 | 0.010 | 0.007 | 0.008 | 0.008 | 0.007 | 0.008 | 0.008 | 0.011 | 0.008 | 0.019 | 0.012 | 0.023 B012 | 15.90 | 15.58 | 15.34 | 15.20 | 14.91 | 14.85 | 14.71 | 14.63 | 14.55 | 14.40 | 14.45 | 14.36 | 14.35 | 0.006 | 0.004 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.004 | 0.003 | 0.007 | 0.004 | 0.007 B013 | 18.35 | 17.86 | 17.51 | 17.36 | 16.99 | 16.92 | 16.75 | 16.64 | 16.47 | 16.33 | 16.36 | 16.24 | 16.19 | 0.022 | 0.012 | 0.009 | 0.010 | 0.010 | 0.010 | 0.009 | 0.010 | 0.012 | 0.009 | 0.029 | 0.015 | 0.027 B016 | 18.64 | 18.08 | 17.78 | 17.62 | 17.24 | 17.15 | 16.95 | 16.82 | 16.68 | 16.51 | 16.56 | 16.33 | 16.33 | 0.027 | 0.016 | 0.011 | 0.012 | 0.012 | 0.011 | 0.011 | 0.010 | 0.014 | 0.010 | 0.028 | 0.016 | 0.029 B019 | 15.75 | 15.45 | 15.15 | 14.99 | 14.61 | 14.53 | 14.38 | 14.25 | 14.11 | 13.96 | 13.89 | 13.80 | 13.76 | 0.006 | 0.004 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.006 | 0.004 | 0.007 B020 | 15.61 | 15.29 | 15.06 | 14.92 | 14.54 | 14.48 | 14.36 | 14.24 | 14.12 | 13.95 | 13.99 | 13.92 | 13.85 | 0.006 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.003 | 0.006 | 0.004 | 0.007 B022 | 17.96 | 17.74 | 17.53 | 17.40 | 17.09 | 17.05 | 16.96 | 16.89 | 16.80 | 16.65 | 16.65 | 16.59 | 16.61 | 0.022 | 0.016 | 0.013 | 0.014 | 0.014 | 0.013 | 0.015 | 0.016 | 0.022 | 0.017 | 0.042 | 0.028 | 0.047 B026 | 18.58 | 18.09 | 17.70 | 17.55 | 17.15 | 17.06 | 16.88 | 16.72 | 16.54 | 16.37 | 16.27 | 16.18 | 16.19 | 0.031 | 0.023 | 0.016 | 0.018 | 0.020 | 0.015 | 0.017 | 0.015 | 0.018 | 0.018 | 0.033 | 0.022 | 0.035 B035 | 18.45 | 17.98 | 17.68 | 17.55 | 17.17 | 17.06 | 16.92 | 16.81 | 16.62 | 16.49 | 16.52 | 16.39 | 16.33 | 0.026 | 0.015 | 0.011 | 0.011 | 0.012 | 0.011 | 0.011 | 0.011 | 0.013 | 0.011 | 0.030 | 0.018 | 0.028 B045 | 16.88 | 16.41 | 16.08 | 15.94 | 15.55 | 15.48 | 15.30 | 15.19 | 15.06 | 14.92 | 14.93 | 14.77 | 14.75 | 0.010 | 0.006 | 0.004 | 0.005 | 0.005 | 0.004 | 0.004 | 0.004 | 0.005 | 0.004 | 0.009 | 0.007 | 0.010 B047 | 18.36 | 17.95 | 17.68 | 17.59 | 17.23 | 17.15 | 17.02 | 16.96 | 16.86 | 16.69 | 16.77 | 16.70 | 16.73 | 0.025 | 0.015 | 0.011 | 0.011 | 0.013 | 0.011 | 0.012 | 0.012 | 0.016 | 0.015 | 0.038 | 0.023 | 0.035 B049 | 17.93 | 17.76 | 17.70 | 17.61 | 17.43 | 17.42 | 17.30 | 17.25 | 17.16 | 17.12 | 17.28 | 16.92 | 17.92 | 0.025 | 0.022 | 0.020 | 0.021 | 0.024 | 0.019 | 0.021 | 0.024 | 0.026 | 0.021 | 0.061 | 0.040 | 0.412 B050 | 17.68 | 17.32 | 17.03 | 16.87 | 16.49 | 16.42 | 16.27 | 16.14 | 16.01 | 15.84 | 15.78 | 15.70 | 15.73 | 0.020 | 0.014 | 0.011 | 0.010 | 0.012 | 0.010 | 0.011 | 0.011 | 0.013 | 0.012 | 0.026 | 0.017 | 0.028 B052 | 19.02 | 18.24 | 17.64 | 17.27 | 16.92 | 16.76 | 16.53 | 16.38 | 16.23 | 16.04 | 15.89 | 15.73 | 15.65 | 0.046 | 0.020 | 0.012 | 0.011 | 0.012 | 0.010 | 0.009 | 0.009 | 0.012 | 0.009 | 0.020 | 0.013 | 0.021 B062 | 18.86 | 18.17 | 17.66 | 17.24 | 16.96 | 16.74 | 16.52 | 16.44 | 16.31 | 16.13 | 15.98 | 15.83 | 15.79 | 0.042 | 0.021 | 0.014 | 0.010 | 0.013 | 0.010 | 0.011 | 0.011 | 0.014 | 0.011 | 0.026 | 0.016 | 0.024 B074 | 17.55 | 17.16 | 16.91 | 16.80 | 16.43 | 16.35 | 16.22 | 16.14 | 16.03 | 15.89 | 15.92 | 15.84 | 15.80 | 0.014 | 0.010 | 0.007 | 0.007 | 0.008 | 0.007 | 0.008 | 0.008 | 0.009 | 0.008 | 0.027 | 0.013 | 0.020 B081 | 17.05 | 17.01 | 16.87 | 16.81 | 16.59 | 16.42 | 16.44 | 16.18 | 16.08 | 16.01 | 15.95 | 15.53 | 15.86 | 0.016 | 0.015 | 0.013 | 0.013 | 0.015 | 0.014 | 0.024 | 0.034 | 0.032 | 0.029 | 0.040 | 0.049 | 0.107 B089 | 18.24 | 18.22 | 18.16 | 18.16 | 18.11 | 18.16 | 18.16 | 18.16 | 18.07 | 18.01 | 18.49 | 18.17 | 18.34 | 0.027 | 0.026 | 0.026 | 0.024 | 0.039 | 0.034 | 0.041 | 0.045 | 0.050 | 0.047 | 0.126 | 0.090 | 0.163 Table 2Continued. Name | $c$ | $d$ | $e$ | $f$ | $g$ | $h$ | $i$ | $j$ | $k$ | $m$ | $n$ | $o$ | $p$ ---|---|---|---|---|---|---|---|---|---|---|---|---|--- B100 | 18.82 | 18.31 | 18.04 | 17.92 | 17.63 | 17.61 | 17.31 | 17.25 | 17.24 | 17.21 | 17.24 | 16.95 | 16.91 | 0.050 | 0.030 | 0.026 | 0.026 | 0.027 | 0.025 | 0.026 | 0.048 | 0.031 | 0.033 | 0.065 | 0.037 | 0.170 B129 | … | … | 18.41 | 17.71 | 16.83 | 16.59 | 16.07 | 15.79 | 15.47 | 15.21 | 14.99 | 14.71 | 14.62 | … | … | 0.090 | 0.059 | 0.034 | 0.030 | 0.022 | 0.019 | 0.016 | 0.014 | 0.014 | 0.012 | 0.014 B156 | 17.67 | 17.32 | 17.09 | 16.82 | 16.53 | 16.64 | 16.44 | 16.35 | 16.17 | 16.20 | 16.18 | 16.13 | 16.40 | 0.018 | 0.011 | 0.008 | 0.008 | 0.008 | 0.010 | 0.012 | 0.014 | 0.012 | 0.031 | 0.021 | 0.035 | 0.008 B168 | 19.50 | 18.76 | 18.23 | 17.96 | 17.29 | 17.13 | 16.78 | 16.60 | 16.28 | 16.07 | 15.95 | 15.80 | 15.69 | 0.083 | 0.053 | 0.030 | 0.026 | 0.025 | 0.017 | 0.015 | 0.015 | 0.014 | 0.010 | 0.027 | 0.013 | 0.020 B170 | 18.27 | 17.90 | 17.61 | 17.46 | 17.11 | 17.06 | 16.84 | 16.76 | 16.66 | 16.52 | 16.46 | 16.38 | 16.44 | 0.025 | 0.020 | 0.012 | 0.013 | 0.014 | 0.012 | 0.012 | 0.014 | 0.015 | 0.014 | 0.033 | 0.018 | 0.141 B195 | 18.97 | 18.78 | 18.61 | 18.57 | 18.38 | 18.36 | 18.35 | 18.11 | 18.20 | 18.04 | 17.96 | 17.96 | … | 0.046 | 0.035 | 0.028 | 0.035 | 0.044 | 0.033 | 0.044 | 0.044 | 0.062 | 0.059 | 0.109 | 0.074 | … B199 | 18.27 | 18.00 | 17.80 | 17.62 | 17.44 | 17.41 | 17.22 | 17.10 | 17.06 | 17.00 | 17.05 | 16.87 | 17.06 | 0.024 | 0.018 | 0.012 | 0.013 | 0.016 | 0.013 | 0.014 | 0.016 | 0.018 | 0.017 | 0.039 | 0.022 | 0.060 B207 | 18.04 | 17.74 | 17.53 | 17.36 | 17.14 | 17.10 | 16.93 | 16.84 | 16.81 | 16.73 | 16.71 | 16.59 | 16.64 | 0.020 | 0.014 | 0.011 | 0.012 | 0.014 | 0.013 | 0.014 | 0.015 | 0.020 | 0.015 | 0.039 | 0.023 | 0.053 B212 | 16.17 | 15.91 | 15.69 | 15.51 | 15.31 | 15.28 | 15.10 | 15.01 | 14.96 | 14.91 | 14.84 | 14.76 | 14.80 | 0.007 | 0.005 | 0.004 | 0.004 | 0.004 | 0.004 | 0.004 | 0.004 | 0.005 | 0.004 | 0.011 | 0.006 | 0.012 B219 | 17.25 | 16.90 | 16.63 | 16.44 | 16.15 | 16.05 | 15.88 | 15.76 | 15.62 | 15.46 | 15.46 | 15.32 | 15.33 | 0.013 | 0.008 | 0.006 | 0.006 | 0.007 | 0.006 | 0.006 | 0.006 | 0.007 | 0.006 | 0.014 | 0.008 | 0.018 B226 | 19.13 | 18.51 | 18.10 | 17.77 | 17.55 | 17.43 | 17.15 | 17.05 | 16.97 | 16.82 | 16.63 | 16.56 | 16.49 | 0.044 | 0.029 | 0.015 | 0.015 | 0.018 | 0.015 | 0.016 | 0.016 | 0.022 | 0.016 | 0.041 | 0.021 | 0.045 B230 | 16.44 | 16.33 | 16.13 | 15.98 | 15.75 | 15.68 | 15.56 | 15.47 | 15.41 | 15.21 | 15.21 | 15.20 | 15.20 | 0.009 | 0.006 | 0.005 | 0.005 | 0.006 | 0.005 | 0.005 | 0.006 | 0.007 | 0.005 | 0.015 | 0.008 | 0.020 B232 | 16.15 | 16.02 | 15.80 | 15.65 | 15.34 | 15.28 | 15.17 | 15.06 | 14.98 | 14.80 | 14.74 | 14.76 | 14.71 | 0.008 | 0.005 | 0.004 | 0.005 | 0.005 | 0.005 | 0.005 | 0.005 | 0.006 | 0.006 | 0.011 | 0.008 | 0.016 B233 | 16.41 | 16.19 | 15.94 | 15.81 | 15.44 | 15.38 | 15.26 | 15.15 | 15.01 | 14.85 | 14.85 | 14.73 | 14.90 | 0.010 | 0.008 | 0.007 | 0.006 | 0.007 | 0.006 | 0.007 | 0.006 | 0.008 | 0.007 | 0.010 | 0.015 | 0.019 B236 | 17.86 | 17.69 | 17.52 | 17.38 | 17.08 | 17.03 | 16.88 | 16.75 | 16.47 | 16.40 | 16.45 | 16.76 | 16.22 | 0.021 | 0.017 | 0.012 | 0.012 | 0.015 | 0.012 | 0.012 | 0.018 | 0.023 | 0.040 | 0.021 | 0.039 | 0.164 B237 | 17.92 | 17.70 | 17.45 | 17.31 | 17.01 | 16.94 | 16.79 | 16.70 | 16.63 | 16.48 | 16.50 | 16.42 | 16.47 | 0.020 | 0.015 | 0.012 | 0.012 | 0.015 | 0.013 | 0.015 | 0.015 | 0.016 | 0.018 | 0.033 | 0.024 | 0.145 B238 | 17.39 | 17.02 | 16.73 | 16.58 | 16.23 | 16.13 | 15.97 | 15.88 | 15.74 | 15.66 | 15.58 | 15.58 | 15.45 | 0.014 | 0.007 | 0.006 | 0.006 | 0.007 | 0.012 | 0.007 | 0.016 | 0.016 | 0.014 | 0.019 | 0.011 | 0.055 B239 | 17.88 | 17.79 | 17.51 | 17.43 | 17.01 | 16.90 | 16.77 | 16.66 | 16.52 | 16.43 | 16.33 | 16.32 | 16.15 | 0.156 | 0.062 | 0.040 | 0.037 | 0.033 | 0.025 | 0.017 | 0.032 | 0.032 | 0.026 | 0.037 | 0.063 | 0.103 Table 3GALEX, broad-band, and 2MASS photometry of the 39 M31 GCs and GC candidates. Name | $c$††footnotemark: | FUV | NUV | $U$ | $B$ | $V$ | $R$ | $I$ | $J$ | $H$ | $K_{s}$ ---|---|---|---|---|---|---|---|---|---|---|--- B004 | 1 | … | 22.25 | 18.29 | 17.87 | 16.95 | 16.36 | 15.73 | 14.91 | 14.36 | 14.19 | | … | 0.07 | 0.03 | 0.01 | 0.01 | 0.02 | 0.01 | 0.02 | 0.07 | 0.05 B006 | 1 | … | 21.41 | 16.94 | 16.49 | 15.53 | 14.97 | 14.31 | 13.48 | 12.75 | 12.61 | | … | 0.04 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.03 | 0.03 B008 | 1 | … | 22.59 | 18.16 | 17.66 | 16.56 | 16.21 | 15.51 | 14.68 | 14.17 | 13.98 | | … | 0.12 | 0.08 | 0.05 | 0.05 | 0.05 | 0.05 | 0.05 | 0.07 | 0.06 B010 | 1 | 21.93 | 20.87 | 17.65 | 17.50 | 16.66 | 16.12 | 15.48 | 14.76 | 14.41 | 14.07 | | 0.08 | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.07 | 0.06 B012 | 1 | 20.10 | 19.02 | 15.99 | 15.86 | 15.13 | 14.62 | 14.08 | 13.36 | 12.79 | 12.72 | | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.03 | 0.03 B013 | 1 | … | … | 18.56 | 18.06 | 17.19 | 16.60 | 15.96 | 15.18 | 14.61 | 14.34 | | … | … | 0.05 | 0.02 | 0.01 | 0.02 | 0.02 | 0.03 | 0.07 | 0.05 B016 | 1 | … | … | 18.86 | 18.58 | 17.58 | 16.85 | 16.15 | 15.18 | 14.18 | 14.05 | | … | … | 0.08 | 0.04 | 0.01 | 0.03 | 0.02 | 0.08 | 0.07 | 0.10 B019 | 1 | 20.81 | 19.97 | 16.36 | 15.94 | 14.93 | 14.31 | 13.74 | 12.86 | 12.10 | 11.96 | | 0.04 | 0.02 | 0.01 | 0.01 | 0.01 | 0.05 | 0.01 | 0.02 | 0.03 | 0.02 B020 | 1 | 20.05 | 19.20 | 15.98 | 15.74 | 14.91 | 14.37 | 13.65 | 12.97 | 12.26 | 12.21 | | 0.02 | 0.01 | 0.08 | 0.05 | 0.05 | 0.05 | 0.05 | 0.02 | 0.03 | 0.03 B022 | 1 | 22.69 | 21.20 | 18.14 | 18.09 | 17.36 | 16.97 | 16.35 | 15.75 | 15.04 | 15.48 | | 0.16 | 0.04 | 0.08 | 0.02 | 0.01 | 0.02 | 0.02 | 0.08 | 0.10 | 0.12 B026 | 1 | … | … | 19.14 | 18.60 | 17.53 | 16.88 | 16.22 | 15.10 | 14.48 | 14.00 | | … | … | 0.06 | 0.02 | 0.01 | 0.03 | 0.02 | 0.08 | 0.07 | 0.05 B035 | 1 | … | 22.61 | 18.52 | 18.37 | 17.48 | 16.81 | 16.24 | 15.30 | 14.67 | 14.42 | | … | 0.10 | 0.08 | 0.03 | 0.01 | 0.02 | 0.02 | 0.08 | 0.07 | 0.10 B045 | 1 | … | 21.07 | 17.09 | 16.72 | 15.78 | 15.19 | 14.54 | 13.73 | 13.00 | 12.89 | | … | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.04 | 0.03 B047 | 1 | 22.68 | 21.30 | 18.32 | 18.23 | 17.51 | 16.88 | 16.30 | 15.86 | 15.24 | 15.47 | | 0.15 | 0.04 | 0.06 | 0.02 | 0.01 | 0.03 | 0.02 | 0.08 | 0.10 | 0.12 B049 | 1 | … | 21.55 | 18.26 | 18.08 | 17.56 | 17.11 | 16.87 | 15.61 | 15.33 | 14.68 | | … | 0.06 | 0.09 | 0.04 | 0.01 | 0.04 | 0.04 | 0.08 | 0.10 | 0.10 B050 | 1 | … | 22.18 | 18.09 | 17.76 | 16.84 | 16.27 | 15.66 | 14.72 | 14.22 | 13.96 | | … | 0.09 | 0.05 | 0.02 | 0.01 | 0.02 | 0.01 | 0.03 | 0.07 | 0.05 B052 | 4 | … | … | 19.80 | 18.62 | 17.21 | 16.54 | 15.77 | 14.70 | 14.01 | 13.40 | | … | … | 0.08 | 0.02 | 0.01 | 0.02 | 0.02 | 0.04 | 0.07 | 0.05 B062 | 4 | … | … | 19.33 | 18.58 | 17.24 | 16.61 | 15.82 | 14.89 | 14.21 | 13.66 | | … | … | 0.08 | 0.02 | 0.01 | 0.02 | 0.01 | 0.04 | 0.07 | 0.05 B074 | 1 | 22.12 | 20.75 | 17.54 | 17.40 | 16.65 | 16.14 | 15.58 | 14.83 | 13.95 | 14.11 | | 0.07 | 0.02 | 0.03 | 0.01 | 0.01 | 0.01 | 0.01 | 0.02 | 0.04 | 0.04 B081 | 1 | 21.73 | 20.47 | 17.60 | 17.34 | 16.80 | 16.36 | 15.73 | 14.82 | 14.01 | 13.96 | | 0.13 | 0.04 | 0.02 | 0.01 | 0.01 | 0.02 | 0.02 | 0.03 | 0.07 | 0.05 B089 | 2 | 19.89 | 19.62 | 17.96 | 18.28 | 18.18 | 18.22 | 17.70 | … | … | … | | 0.03 | 0.02 | 0.05 | 0.04 | 0.03 | 0.06 | 0.06 | … | … | … Table 3Continued. Name | $c$ | FUV | NUV | $U$ | $B$ | $V$ | $R$ | $I$ | $J$ | $H$ | $K_{s}$ ---|---|---|---|---|---|---|---|---|---|---|--- B100 | 1 | 22.37 | … | 18.94 | 19.05 | 17.91 | … | 17.77 | 15.85 | 14.70 | 14.67 | | 0.19 | … | 0.08 | 0.07 | 0.05 | … | 0.07 | 0.08 | 0.07 | 0.10 B129 | 1 | … | … | … | 19.56 | 17.40 | … | 14.69 | 13.25 | 12.40 | 12.19 | | … | … | … | 0.05 | 0.05 | … | 0.05 | 0.03 | 0.03 | 0.04 B156 | 1 | … | 20.99 | 17.89 | 17.63 | 16.84 | 16.37 | 15.87 | … | … | … | | … | 0.09 | 0.02 | 0.02 | 0.01 | 0.02 | 0.05 | … | … | … B168 | 1 | … | … | 20.82 | 19.23 | 17.63 | 16.69 | 15.72 | 14.52 | 13.43 | 13.37 | | … | … | 0.08 | 0.06 | 0.01 | 0.03 | 0.02 | 0.06 | 0.04 | 0.08 B170 | 1 | … | … | 18.90 | 18.37 | 17.39 | 16.80 | 16.17 | 15.38 | 14.75 | 14.61 | | … | … | 0.06 | 0.02 | 0.01 | 0.02 | 0.02 | 0.08 | 0.07 | 0.10 B195 | 2 | … | … | 19.94 | 18.97 | 18.57 | 18.02 | 17.59 | … | … | … | | … | … | 0.08 | 0.06 | 0.01 | 0.07 | 0.05 | … | … | … B199 | 1 | … | 21.53 | 18.45 | 18.37 | 17.60 | 17.03 | 16.57 | 16.06 | 15.42 | 15.39 | | … | 0.10 | 0.08 | 0.03 | 0.01 | 0.03 | 0.02 | 0.10 | 0.10 | 0.12 B207 | 1 | 21.64 | 21.04 | 18.26 | 18.07 | 17.33 | 16.81 | 16.33 | 15.67 | 14.42 | 14.78 | | 0.11 | 0.06 | 0.03 | 0.02 | 0.01 | 0.02 | 0.02 | 0.05 | 0.07 | 0.08 B212 | 1 | 20.27 | 19.16 | 16.23 | 16.22 | 15.48 | 15.00 | 14.48 | 13.82 | 13.17 | 13.11 | | 0.05 | 0.02 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.04 | 0.05 B219 | 1 | … | 21.59 | 17.74 | 17.32 | 16.39 | 15.82 | 15.19 | 14.32 | 13.71 | 13.51 | | … | 0.10 | 0.08 | 0.05 | 0.05 | 0.05 | 0.05 | 0.02 | 0.04 | 0.04 B226 | 2 | 22.09 | 21.61 | 19.08 | 19.04 | 17.65 | … | 16.32 | 15.21 | 14.47 | 14.14 | | 0.14 | 0.09 | 0.08 | 0.05 | 0.05 | … | 0.05 | 0.08 | 0.07 | 0.10 B230 | 1 | 20.69 | 19.46 | 16.78 | 16.77 | 16.05 | 15.61 | 15.13 | 14.43 | 13.92 | 13.85 | | 0.08 | 0.03 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.02 | 0.04 | 0.05 B232 | 1 | 20.67 | 19.49 | 16.53 | 16.38 | 15.70 | 15.20 | 14.65 | 13.94 | 13.36 | 13.25 | | 0.06 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.03 | 0.04 | 0.05 B233 | 1 | 21.27 | 20.04 | 16.82 | 16.61 | 15.80 | 15.27 | 14.76 | 13.90 | 13.32 | 13.21 | | 0.05 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.01 | 0.02 | 0.04 | 0.03 B236 | 1 | … | 21.07 | 18.21 | 18.20 | 17.38 | 16.97 | 16.24 | … | … | … | | … | 0.07 | 0.08 | 0.02 | 0.01 | 0.02 | 0.02 | … | … | … B237 | 1 | … | 21.25 | 18.03 | 17.87 | 17.10 | 16.57 | 16.05 | 15.47 | 15.06 | 14.91 | | … | 0.05 | 0.02 | 0.02 | 0.01 | 0.02 | 0.02 | 0.04 | 0.10 | 0.09 B238 | 1 | … | 21.91 | 17.73 | 17.39 | 16.42 | 15.86 | 15.22 | 14.46 | 13.72 | 13.67 | | … | 0.08 | 0.02 | 0.01 | 0.01 | 0.01 | 0.01 | 0.04 | 0.04 | 0.05 B239 | 1 | … | … | 18.49 | 18.10 | 17.08 | 16.65 | 16.09 | 15.31 | 14.55 | 14.55 | | … | … | 0.04 | 0.02 | 0.01 | 0.02 | 0.02 | 0.04 | 0.07 | 0.08 ${\dagger}$ New classification flag, following RBC V3.5 notation. 1 = confirmed GC, 2 = GC candidate, 4 = confirmed galaxy Table 4Reddening values and metallicities for our 39 M31 GCs and GC candidates. Name | $E(B-V)$ | ref.a | $\rm[Fe/H]$ | ref.b ---|---|---|---|--- B004 | 0.07$\pm$ 0.02 | 1 | $-0.31\pm$ 0.74 | 1 B006 | 0.09$\pm$ 0.02 | 1 | $-0.58\pm$ 0.10 | 1 B008 | 0.21 | 2 | $-0.41\pm$ 0.38 | 1 B010 | 0.22$\pm$ 0.01 | 1 | $-1.77\pm$ 0.14 | 1 B012 | 0.12$\pm$ 0.01 | 1 | $-1.65\pm$ 0.19 | 1 B013 | 0.13$\pm$ 0.02 | 1 | $-1.01\pm$ 0.49 | 1 B016 | 0.30$\pm$ 0.02 | 1 | $-0.78\pm$ 0.19 | 1 B019 | 0.20$\pm$ 0.01 | 1 | $-1.09\pm$ 0.02 | 1 B020 | 0.12$\pm$ 0.01 | 1 | $-1.07\pm$ 0.10 | 3 B022 | 0.04$\pm$ 0.03 | 1 | $-1.64\pm$ 0.07 | 4 B026 | 0.15$\pm$ 0.02 | 1 | $0.01\pm$ 0.38 | 1 B035 | 0.27$\pm$ 0.05 | 2 | $-0.20\pm$ 0.54 | 1 B045 | 0.18$\pm$ 0.01 | 1 | $-1.05\pm$ 0.25 | 1 B047 | 0.09$\pm$ 0.02 | 1 | $-1.62\pm$ 0.41 | 1 B049 | 0.16$\pm$ 0.02 | 1 | $-2.14\pm$ 0.55 | 1 B050 | 0.24$\pm$ 0.01 | 1 | $-1.42\pm$ 0.37 | 1 B052 | 0.23$\pm$ 0.04 | 1 | $0.12\pm$ 0.17 | 4 B062 | 0.26$\pm$ 0.03 | 1 | $-0.47\pm$ 0.11 | 4 B074 | 0.19$\pm$ 0.01 | 1 | $-1.88\pm$ 0.06 | 1 B081 | 0.11$\pm$ 0.02 | 1 | $-1.74\pm$ 0.40 | 1 B089 | … | … | … | … B100 | 0.48$\pm$ 0.08 | 1 | $-2.21\pm$ 0.10 | 4 B129 | 1.16$\pm$ 0.06 | 1 | $-1.21\pm$ 0.32 | 1 B156 | 0.10$\pm$ 0.02 | 1 | $-1.51\pm$ 0.38 | 1 B168 | 0.54$\pm$ 0.05 | 1 | $-0.12\pm$ 0.21 | 4 B170 | 0.10$\pm$ 0.02 | 1 | $-0.54\pm$ 0.24 | 1 B195 | 0.12$\pm$ 0.00 | 1 | $-1.48\pm$ 0.63 | 4 B199 | 0.10$\pm$ 0.02 | 1 | $-1.59\pm$ 0.11 | 1 B207 | 0.05$\pm$ 0.02 | 2 | $-0.81\pm$ 0.59 | 1 B212 | 0.13$\pm$ 0.01 | 1 | $-1.75\pm$ 0.13 | 3 B219 | 0.05$\pm$ 0.03 | 1 | $-0.01\pm$ 0.57 | 1 B226 | 1.08$\pm$ 0.06 | 1 | … | … B230 | 0.15$\pm$ 0.01 | 1 | $-2.17\pm$ 0.16 | 1 B232 | 0.14$\pm$ 0.01 | 1 | $-1.83\pm$ 0.14 | 1 B233 | 0.17$\pm$ 0.01 | 1 | $-1.59\pm$ 0.32 | 3 B236 | 0.07$\pm$ 0.05 | 1 | $-1.01\pm$ 0.17 | 4 B237 | 0.14$\pm$ 0.02 | 1 | $-2.09\pm$ 0.28 | 1 B238 | 0.11$\pm$ 0.02 | 1 | $-0.57\pm$ 0.66 | 1 B239 | 0.09$\pm$ 0.01 | 1 | $-1.18\pm$ 0.61 | 2 aThe reddening values are taken from Fan et al. (2008) (ref.=1) and Barmby et al. (2000) (ref.=2). bThe metallicities are taken from Perrett et al. (2002) (ref.=1), Barmby et al. (2000) (ref.=2), Huchra et al. (1991) (ref.=3), and Fan et al. (2008) (ref.=4). Table 5Ages estimates for 35 GCs and GC candidates in M31. Name | Age | $\chi_{\rm min}^{2}$ | Name | Age | $\chi_{\rm min}^{2}$ ---|---|---|---|---|--- | (Gyr) | (per degree of freedom) | | (Gyr) | (per degree of freedom) B004 | $4.10\pm 0.55$ | 3.13 | B100 | $0.50\pm 0.10$ | 14.38 B006 | $12.50\pm 0.65$ | 1.39 | B129 | $15.10\pm 0.70$ | 9.00 B008 | $2.00\pm 0.10$ | 6.54 | B156 | $4.90\pm 0.65$ | 2.09 B010 | $1.80\pm 0.10$ | 1.08 | B168 | $12.60\pm 0.20$ | 3.27 B012 | $2.00\pm 0.10$ | 1.54 | B170 | $4.00\pm 0.45$ | 1.39 B013 | $12.00\pm 2.00$ | 0.96 | B195 | $0.70\pm 0.15$ | 0.82 B016 | $2.40\pm 0.30$ | 1.95 | B199 | $3.30\pm 0.55$ | 1.38 B019 | $2.10\pm 0.10$ | 12.01 | B207 | $1.20\pm 0.10$ | 7.99 B020 | $1.80\pm 0.10$ | 7.50 | B212 | $1.80\pm 0.10$ | 0.75 B022 | $3.40\pm 0.15$ | 4.11 | B219 | $2.50\pm 0.15$ | 3.06 B026 | $3.50\pm 0.25$ | 3.28 | B230 | $1.60\pm 0.10$ | 4.59 B035 | $1.00\pm 0.10$ | 3.97 | B232 | $2.00\pm 0.10$ | 2.62 B045 | $8.80\pm 1.45$ | 0.78 | B233 | $2.30\pm 0.10$ | 3.73 B047 | $2.80\pm 0.20$ | 4.22 | B236 | $2.00\pm 0.25$ | 2.63 B049 | $1.60\pm 0.10$ | 7.82 | B237 | $3.50\pm 0.35$ | 1.41 B050 | $16.00\pm 0.30$ | 2.12 | B238 | $5.00\pm 0.45$ | 2.01 B074 | $2.10\pm 0.15$ | 2.12 | B239 | $14.50\pm 2.05$ | 1.70 B081 | $2.10\pm 0.20$ | 7.82 | | |
arxiv-papers
2009-04-03T12:37:24
2024-09-04T02:49:01.657846
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Jun Ma (1), Zhou Fan (1), Richard de Grijs (2), Zhenyu Wu (1), Xu Zhou\n (1), Jianghua Wu (1), et al. ((1)National Astronomical Observatories, Chinese\n Academy of Sciences; (2)Department of Physics & Astronomy, The University of\n Sheffield, Hicks Building, Hounsfield Road, Sheffield S3 7RH, UK)", "submitter": "Jun Ma", "url": "https://arxiv.org/abs/0904.0553" }
0904.0633
The Dynamic Radio Sky: An Opportunity for Discovery J. Lazio1 (NRL), J. S. Bloom (UC Berkeley), G. C. Bower (UC Berkeley), J. Cordes (Cornell, NAIC), S. Croft (UC Berkeley), S. Hyman (Sweet Briar), C. Law (UC Berkeley), & M. McLaughlin (WVU) Submitted to Astro2010: The Astronomy and Astrophysics Decadal Survey 1 Contact information: 202-404-6329, Joseph.Lazio@nrl.navy.mil; Image credit: Hallinan et al., NRAO/AUI/NSF ###### Executive Summary The time domain of the sky has been only sparsely explored. Nevertheless, recent discoveries from limited surveys and serendipitous discoveries indicate that there is much to be found on timescales from nanoseconds to years and at wavelengths from meters to millimeters. These observations have revealed unexpected phenomena such as rotating radio transients and coherent pulses from brown dwarfs. Additionally, archival studies have found not-yet identified radio transients without optical or high-energy hosts. In addition to the known classes of radio transients, possible other classes of objects include extrapolations from known classes and exotica such as orphan $\gamma$-ray burst afterglows, radio supernovae, tidally-disrupted stars, flare stars, magnetars, and transmissions from extraterrestrial civilizations. Over the next decade, meter- and centimeter-wave radio telescopes with improved sensitivity, wider fields of view, and flexible digital signal processing will be able to explore radio transient parameter space more comprehensively and systematically. ## 1 Frontier Question: What New Sources and Phenomena Populate the Sky? The available parameter space for transient surveys is extensive: transients have been detected at, and are predicted for, all radio wavelengths; timescales range from nanoseconds to the longest timescales probed; and transients may originate from nearly all astrophysical environments including the solar system, star-forming regions, the Galactic center, and other galaxies. _By observing the sky so as to preserve information about the time domain, the past decade has illustrated that there is a considerable potential for discovery. Over the next decade, a combination of increased sensitivity, field of view, and algorithmic developments likely would yield transformational discoveries in a wide range of astronomical fields._ ## 2 Science Opportunity: The Dynamic Sky Transient emission—bursts, flares, and pulses on time scales of less than about 1 month—marks compact sources or the locations of explosive or dynamic events. Transient sources offer insight into a variety of fundamental questions including * • Mechanisms of particle acceleration; * • Possible physics beyond the Standard Model; * • The physics of accretion and outflow; * • Stellar evolution and death; * • The nature of strong field gravity; * • The nuclear equation of state; * • The cosmological star formation history; * • Probing the intervening medium(a); and * • The possibility of extraterrestrial (ET) civilizations. Much of astronomy’s progress over the last half of the $20^{\mathrm{th}}$ Century resulted from opening new spectral windows. With essentially the entire spectrum having been explored at some level, we must look to other parts of parameter space—such as increased sensitivity, field of view, or the time domain—for future transformational discoveries. The time domain appears ripe for new exploration as observations over the past decade have emphasized that the sky may be quite dynamic—known sources have been discovered to behave in new ways and what may be entirely new classes of sources have been discovered. Radio observations triggered by high-energy observations (e.g., observations of $\gamma$-ray burst [GRB] afterglows), monitoring programs of known high-energy transients (e.g., radio monitoring of X-ray binaries), giant pulses from the Crab pulsar, a small number of dedicated radio transient surveys, and the serendipitous discovery of transient radio sources (e.g., near the Galactic center, brown dwarfs) all suggest that the sky is likely to be quite active on timescales from nanoseconds to years and at wavelengths from meters to millimeters. ## 3 Scientific Context: The Transient Sky Classes of transients are diverse, ranging from nearby stars to cosmological distances (GRBs), and touching upon nearly every aspect of astronomy, astrophysics, and astrobiology. Table 1 lists a series of known, hypothesized, and exotic classes of radio transients. In the remainder of this section, we provide two case studies and brief discussions of other classes of transients. Table 1: Illustrations of Classes of Transients Known Classes | Extrapolations of Known Physics | Exotica ---|---|--- brown dwarfs, flare stars | extrasolar planets | signals from ET civilizations pulsar giant pulses, intermittant pulsars, magnetar flares, X-ray binaries | giant pulses, flares from neutron stars in other galaxies | electromagnetic counterparts to gravitational wave events radio supernovae, GRB afterglows | prompt emission from GRBs, orphan GRB afterglows | annihilating black holes variability from interstellar propagation | variability from intergalactic propagation | ### 3.1 Case Study: Rotating Radio Transients—A New Population of Neutron Stars The first pulsars were discovered through visual inspection of pen chart recordings, which revealed the presence of individual radio pulses spaced by the neutron star rotation period. It was soon realized that Fourier methods were far more sensitive to the periodic emission believed to be characteristic of all radio pulsars, and periodicity searches have been used in the discovery of over 1800 radio pulsars. In 2003, the Parkes Multibeam Survey had covered the entire Galactic plane visible from Parkes, finding over 700 new pulsars. The data were then re- analyzed for single, dispersed pulses, revealing a new population of neutron stars only detectable through their individual radio bursts (McLaughlin et al. 2006). The average pulse rates of these 11 sources were (3 min)-1 to (3 hr)-1. Periods ranging from 0.7–7 s were eventually inferred from the differences between the pulse arrival times. These periods are comparable to those of traditional radio pulsars, and confirmed the neutron star nature of these sources, dubbed Rotating Radio Transients (RRATs). Since the discovery of the original 11 RRATs, interest in single radio pulse searches has increased dramatically. Single pulse searches are incorporated in the pipeline of current pulsar surveys, and a great deal of archival pulsar search data has been reanalyzed. Currently, roughly 30 RRATs are known, with this number increasing steadily. What makes RRATs so different from normal pulsars, and how might they be related to other classes of neutron stars? Perhaps fundamental properties such as magnetic field or age contribute to the radio sporadicity, or their emission could be due to external influences such as a debris disk (Cordes & Shannon 2008). Another fundamental issue is the total number of these sources. Their sporadicity makes them difficult to detect, and it is likely that the population of RRATs outnumbers that of normal pulsars, leading Keane & Kramer (2008) to conclude that the neutron star population is _not_ consistent with the Galactic supernova rate. In summary, the RRATs are an example of an unexpected source class discovered through simple but new transient detection algorithms. ### 3.2 Case Study: Unexplained Transient Events Figure 1: Illustration of the diversity of the light curves for transients toward the Galactic center (Hyman et al. 2002, 2005, 2009). The transient GCRT J1745$-$3009 burst several times (duration $\sim 10$ min.) during a 6-hr observation, with subsequent bursts detected over the next 1.5 yr; GCRT J1742$-$3001 brightened and faded over several months, preceded 6 months earlier by intermittent bursts; and GCRT J1746$-$2757 was detected in only a single epoch. None of these objects has been identified nor has a multi- wavelength counterpart been found. The background image is the Galactic center at 330 MHz, and the total time devoted to the monitoring project, in both new and archival observations, is about 150 hr. Figures 1 and 2 illustrate the potential diversity of objects to be discovered. These transients were discovered in a combination of new and archival observations toward the Galactic center (Figure 1) or in archival observations of a “blank field” (Figure 2). Archival data have proven particularly valuable resources for these programs as both span 1–2 decades of time. Most of the transients shown in these figures have no multi-wavelength counterparts, nor are they associated with any known transient classes. Possible explanations for the various transients range from rare, extremely luminous flares from Galactic M dwarfs and brown dwarfs to GRB afterglows. Figure 2: Two radio transients found in a survey of 944 epochs of a blank field from the VLA archives (Bower et al. 2007); there is no clear object class identification for these or eight other transients. (Top) Contours indicate the transients’ locations on the deep radio image. (Bottom) The positions of the radio transients overlaid on deep Keck G and R band images. RT 19840613 is offset by 3 kpc from the nucleus of a spiral galaxy at $z=0.04$; RT 19860115 has no radio or optical counterpart. ### 3.3 Diverse Populations: Opportunity for Discovery Flare Stars, Brown Dwarfs, and Extrasolar Planets: Active stars and star systems have long been known to produce radio flares attributed to particle acceleration from magnetic field activity (Güdel 2002). More recently, flares from late-type stars (dM) and brown dwarfs have been discovered (Berger et al. 2001; Hallinan et al. 2007), in some cases with periodicities indicative of rotation. The radio emission from these late-type stellar objects is far stronger than expected from the Benz-Güdel relation for X-ray and radio emission from main-sequence stars. Finally, Jupiter is radio bright below 40 MHz, and many stars with “hot Jupiters” show signatures of magnetic star-planet interactions (Shkolnik et al. 2005), so extrasolar planets may also be radio sources (Zarka 2007). Pulsar Giant Pulses—Relativistic Magnetohydymamics and the Intergalactic Medium: While all pulsars show pulse-to-pulse intensity variations, some pulsars emit so-called “giant” pulses, with strengths 100 or even 1000 times the mean pulse intensity. The Crab was the first pulsar found to exhibit this phenomenon, and giant pulses have since been detected from numerous other pulsars (Cognard et al. 1996; Romani & Johnston 2001; Johnston & Romani 2003). Pulses with flux densities of order $10^{3}$ Jy at 5 GHz and with durations of only 2 ns have been detected from the Crab (Hankins et al. 2003). These “nano-giant” pulses imply brightness temperatures of 1038 K, by far the most luminous emission from any astronomical object. In addition to being probes of particle acceleration in the pulsar magnetosphere, giant pulses may serve as probes of the local intergalactic medium (McLaughlin & Cordes 2003). Radio Supernovae and GRBs: Observations of the kind possible with the new radio telescopes (i.e., frequent monitoring of large areas of sky) can be used to find those GRBs and supernovae that emit in the radio, as well as to follow up on such transients detected at other wavelengths. Multi-wavelength, multi-epoch observations (e.g., Cenko et al. 2006) can provide information on progenitors, the surrounding medium, and models of GRB energetics and beaming. Of special interest is finding so-called “orphan afterglows,” those without $\gamma$-ray trigger. The demographics of orphan afterglows directly inform the geometry and hence energetics of the events (e.g., Levinson et al. 2002). Intraday Variability, AGN Central Engines, and Interstellar & Intergalactic Media: Intraday variability (IDV)—interstellar scintillation of extremely compact components ($\sim 10$ $\mu$as) in AGN—occurs at frequencies near 5 GHz. The typical modulation amplitude is a few percent, but occasional sources display much larger modulations (Kedziora-Chudczer et al. 2001; Lovell et al. 2003); in _extreme scattering events_ , modulations greater than 50% on time scales of days to months are obtained (Fielder et al. 1987). The existence of compact components in AGN may prove to be a sensitive probe of their central engines, innermost regions of the jet, or both, complementing $\gamma$-ray observations. Finally, in order for AGN to be sufficiently compact to scintillate, their signals must not have been affected substantially by propagation through the _intergalactic medium_. Given that the dominant baryonic component of the Universe is likely to be in a warm-hot intergalactic medium, the presence of IDV can also constrain the properties of the intergalactic medium. Annihilating Black Holes: Annihilating black holes are predicted to produce radio bursts (Rees 1977). Advances in $\gamma$-ray detectors has renewed interest in possible high- energy signatures from primordial black holes (Dingus et al. 2002; Linton et al. 2006). Observations at the extremes of the electromagnetic spectrum are complementary as radio observations attempt to detect the pulse from an individual primordial black hole, while high-energy observations generally search for the integrated emission. Gravitational Wave Events: The progenitors for gravitational wave events may generate associated electromagnetic signals or pulses. For example, the in-spiral of a binary neutron star system, one of the key targets for LIGO, may produce electromagnetic pulses, both at high energies and in the radio due to the interaction of the magnetospheres of the neutron stars (e.g., Hansen & Lyutikov 2001). More generally, the combined detection of both electomagnetic and gravitational wave signals may be required to produce localizations and understanding of the gravitational wave emitters (Kocsis et al. 2008). See also the whitepaper on the GW-EM connection (Bloom et al. 2009). Extraterrestrial transmitters: While none are known, searches for extraterrestrial intelligence (SETI) have found non-repeating signals that are otherwise consistent with the expected signal from an ET transmitter. Cordes et al. (1997) show how ET signals could appear transient, even if intrinsically steady. ## 4 Advancing the Science: Exploring Phase Space _Over the next decade, great progress is possible in the study of transients. Specific steps include (1) Explicit time-domain processing of data coupled with algorithmic developments, particularly in the area of identification and classification of transients; and (2) Exploitation of telescopes with higher sensitivities, wider fields of view, or both._ The transient detection figure of merit at radio wavelengths is $\mathrm{FoM}_{t}=\Omega\left(\frac{A_{\mathrm{eff}}}{T_{\mathrm{sys}}}\right)^{2}K(\eta W,\tau W),$ (1) which is a function of the telescope sensitivity $A_{\mathrm{eff}}/T_{\mathrm{sys}}$, instantaneous solid angle $\Omega$, typical time duration of the transient $W$, event rate $\eta$, and the time per telescope pointing (“dwell time”) $\tau$. The function $K(\eta W,\tau W)$ incorporates the likelihood of detecting a particular kind of transient. Roughly, one can separate transients surveys into two classes: (1) Burst searches that probe timescales of less than about 1 s for which $\Omega$ is large but $A_{\mathrm{eff}}/T_{\mathrm{sys}}$ is small; and (2) Imaging surveys conducted with interferometers that typically probe timescales of tens of seconds and longer and for which $\Omega$ is small but $A_{\mathrm{eff}}/T_{\mathrm{sys}}$ is large. 1. 1. Explicit time-domain processing of data and algorithmic developments: Since the discovery of RRATs, interest in single radio pulse searches has increased dramatically. Searches for single, dispersed pulses now are incorporated in the software pipeline of current pulsar surveys, such as those at Arecibo, the GBT, and Parkes, and archival pulsar data have been reanalyzed. While time- domain processing is not yet standard for many interferometers, the ASKAP, ATA, EVLA, LOFAR, LWA, MWA, and eventually the SKA offer new possibilities for expanding time-domain processing to interferometric imaging. Further, the interferometers offer the possibility of much higher positional information for transients, which is essential for multi-wavelength study. A number of algorithmic improvements would yield improved use of the existing telescopes and likely a higher yield from future telescopes. * • The vast storage and computational requirements of transient searches, particularly in the case of imaging interferometers, requires the development of near real-time transient analysis pipelines. The ATA, LOFAR, and MWA projects are all engaged in the development of such first-generation pipelines. * • The identification, avoidance, and excision of radio frequency interference (RFI) produced by civil or military transmitters operating in the radio spectrum is required. These transmitters are often orders of magnitude stronger than the desired astronomical signal. * • The identification and classification of transients is a challenge that is broader than simply radio wavelength transients. 2. 2. Exploitation of telescopes with higher sensitivities, wider fields of view: Generally, both $A_{\mathrm{eff}}/T_{\mathrm{sys}}$ and $\Omega$ should be large, though depending upon the class of transient and its luminosity function (if known), it may be possible to trade $A_{\mathrm{eff}}/T_{\mathrm{sys}}$ vs. $\Omega$. For instance, X- and $\gamma$-ray instruments with large solid angle coverage and high time resolution have had great success in finding transients, even if the detectors were not particularly sensitive. In the last decade, the field of view of the Arecibo telescope around 1 GHz was expanded by a factor of 7 with a new feed system (ALFA). In the next decade, additional field of view expansion technologies such as _phased-array feeds_ offer the potential of expanding the fields of view of single-dish telescopes such as Arecibo and the GBT by factors of 10 or more. For imaging surveys, LOFAR, the LWA and the MWA promise much higher sensitivities at low radio frequencies for which the fields of view are naturally large ($\sim 10$ deg.2). The ASKAP and ATA both offer the promise of much larger fields of view ($\sim 10$ deg.2) at frequencies near 1 GHz, while the EVLA will provide a factor of 10 in sensitivity improvements across its entire operational range (1–50 GHz). All of these imaging interferometers also can be _sub-arrayed_ , providing improvements in field of view ($\sim 100$ deg.2), at the cost of sensitivity. Looking toward the next decade and to the era of the SKA, the above advances in searches for transient radio sources promise to transform our understanding of the dynamic Universe. ## References * Berger et al. (2001) Berger, E., Ball, S., Becker, K. M., et al. 2001, Nature, 410, 338 * Bower et al. (2007) Bower, G. C., Saul, D., Bloom, J. S., et al. 2008, ApJ, 666, 346 * Bloom et al. (2009) Bloom, J. S., Holz, D. E., Hughes, S. A. 2009, arXiv:0902.1527 * Cenko et al. (2006) Cenko, S. B., et al. 2006, ApJ, 652, 490 * Cognard et al. (1996) Cognard, I., Shrauner, J. A., Taylor, J. H., & Thorsett, S. E. 1996, ApJ, 457, L81 * Cordes & Shannon (2008) Cordes, J. M., & Shannon, R. M. 2008, ApJ, 682, 1152 * Cordes et al. (1997) Cordes, J. M., Lazio, T. J. W., & Sagan, C. 1997, ApJ, 487, 782 * Dingus et al. (2002) Dingus, B., Laird, R., & Sinnis, G. 2002, $34^{\mathrm{th}}$ COSPAR Scientific Assembly, #2744 * Fielder et al. (1987) Fiedler, R. L., Dennison, B., Johnston, K. J., Hewish, A. 1987, Nature, 326, 675 * Güdel (2002) Güdel, M. 2002, ARA&A, 40, 217 * Hallinan et al. (2007) Hallinan, G., Bourke, S., Lane, C., et al. 2007, * Hankins et al. (2003) Hankins, T. H., Kern, J. S., Weatherall, J. C., & Eilek, J. A. 2003, Nature, 422, 141 * Hansen & Lyutikov (2001) Hansen, B. M. S., & Lyutikov, M. 2001, MNRAS, 322, 695 * Hessels et al. (2006) Hessels, J. W. T., Ransom, S. M., Stairs, I. H., et al. 2006, Science, 311, 1901 * Hyman et al. (2009) Hyman, S. D., Wijnands, R., Lazio, T. J. W., Pal, S., Starling, R., Kassim, N. E., & Ray, P. S. 2009, ApJ, in press * Hyman et al. (2005) Hyman, S. D., Lazio, T. J. W., Kassim, N. E., et al. 2005, Nature, 434, 50 * Hyman et al. (2002) Hyman, S. D., Lazio, T. J. W., Kassim, N. E., & Bartleson, A. L. 2002, AJ, 123, 1497 * Johnston & Romani (2003) Johnston, S., & Romani, R. W. 2003, ApJ, 590, L95 * Keane & Kramer (2008) Keane, E. F., & Kramer, M. 2008, MNRAS, 391, 2009 * Kedziora-Chudczer et al. (2001) Kedziora-Chudczer, L. L., Jauncey, D. L., Wieringa, M. H., Tzioumis, A. K., & Reynolds, J. E. 2001, MNRAS, 325, 1411 * Kocsis et al. (2008) Kocsis, B., Haiman, Z., & Menou, K. 2008, ApJ, 684, 870 * Levinson et al. (2002) Levinson, A., Ofek, E. O., Waxman, E., & Gal-Yam, A. 2002, ApJ, 576, 923 * Linton et al. (2006) Linton, E. T., Atkins, R. W., Badran, H. M., et al. 2006, J. Cosmol. Astropart. Phys., 1, 13 * Lovell et al. (2003) Lovell, J. E. J., Jauncey, D. L., Bignall, H. E., et al. 2003, AJ, 126, 1699 * McLaughlin et al. (2006) McLaughlin, M. A., Lyne, A. G., Lorimer, D. R., et al. 2006, Nature, 439, 817 * McLaughlin & Cordes (2003) McLaughlin, M. A., & Cordes, J. M. 2003, ApJ, 596, 982 * Rees (1977) Rees, M. J. 1977, Nature, 266,333 * Romani & Johnston (2001) Romani, R. W., & Johnston, S. 2001, ApJ, 557, L93 * Shkolnik et al. (2005) Shkolnik, E., Walker, G. A. H., Bohlender, D. A., Gu, P.-G., & Kuerster, M. 2005, ApJ, 622, 1075 * Zarka (2007) Zarka, P. 2007, Planet. Space Sci., 55, 598
arxiv-papers
2009-04-03T18:35:26
2024-09-04T02:49:01.671911
{ "license": "Public Domain", "authors": "J. Lazio (NRL), J. S. Bloom (Berkeley), G. C. Bower (Berkeley), J.\n Cordes (Cornell, NAIC), S. Croft (Berkeley), S. Hyman (Sweet Briar), C. Law\n (Berkeley), M. McLaughlin (WVU)", "submitter": "Joseph Lazio", "url": "https://arxiv.org/abs/0904.0633" }
0904.0674
Vol.0 (200x) No.0, 000–000 11institutetext: National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P. R. China 11email: majun@vega.bac.pku.edu.cn 22institutetext: Department of Physics & Astronomy, The University of Sheffield, Hicks Building, Hounsfield Road, Sheffield S3 7RH, UK 33institutetext: Graduate University, Chinese Academy of Sciences, Beijing, 100039, P. R. China 44institutetext: Department of Astronomy and Space Science, Chungnam National University, Daejeon 305-764, Korea 55institutetext: Center for Space Astrophysics, Yonsei University, Seoul 120-749, Korea 66institutetext: California Institute of Technology, MC 405-47, 1200 E. California Boulevard, Pasadena, CA 91125 # Old stellar population synthesis: New age and mass estimates for Mayall II = G1 Jun Ma 11 Richard de Grijs 2211 Zhou Fan 1133 Soo-Chang Rey 44 Zhenyu Wu 11 Xu Zhou 11 Jianghua Wu 11 Zhaoji Jiang 11 Jiansheng Chen 11 Kyungsook Lee 44 S. T. Sohn 5566 (Received 2001 month day; accepted 2001 month day) ###### Abstract Mayall II = G1 is one of the most luminous globular clusters (GCs) in M31. Here, we determine its age and mass by comparing multicolor photometry with theoretical stellar population synthesis models. Based on far- and near- ultraviolet GALEX photometry, broad-band $UBVRI$, and infrared $JHK_{\rm s}$ 2MASS data, we construct the most extensive spectral energy distribution of G1 to date, spanning the wavelength range from 1538 to 20,000Å. A quantitative comparison with a variety of simple stellar population (SSP) models yields a mean age that is consistent with G1 being among the oldest building blocks of M31 and having formed within $\sim$1.7 Gyr after the Big Bang. Irrespective of the SSP model or stellar initial mass function adopted, the resulting mass estimates (of order $10^{7}M_{\odot}$) indicate that G1 is one of the most massive GCs in the Local Group. However, we speculate that the cluster’s exceptionally high mass suggests that it may not be a genuine GC. We also derive that G1 may contain, on average, $(1.65\pm 0.63)\times 10^{2}L_{\odot}$ far-ultraviolet-bright, hot, extreme horizontal-branch stars, depending on the SSP model adopted. On a generic level, we demonstrate that extensive multi- passband photometry coupled with SSP analysis enables one to obtain age estimates for old SSPs to a similar accuracy as from integrated spectroscopy or resolved stellar photometry, provided that some of the free parameters can be constrained independently. ###### keywords: galaxies: individual (M31) – galaxies: star clusters – galaxies: stellar content ## 1 Introduction Globular clusters (GCs) are among the oldest bound stellar systems in the Universe, and they thus provide a fossil record of the earliest stages of galaxy formation and evolution. GCs are internally homogeneous in age and metallicity, i.e. they are simple stellar systems composed of coeval stellar populations. In addition, GCs are the oldest systems in our own and other galaxies for which we can estimate reasonably reliable ages (and realistic uncertainties); they can thus independently provide vitally important information regarding the minimum age of the Universe. In a detailed study of 17 Galactic GCs, Chaboyer et al. (1998) used the improved Hipparcos parallaxes having just become available at that time to determine updated distances, and hence improved ages, of their GC sample. They concluded that the mean age of the oldest GCs is $11.5\pm 1.3$ Gyr, although their age histogram (their fig. 2) shows a tail toward ages as old as $\sim 16$ Gyr. Gratton et al. (2003) obtain improved ages (and distances) for three Galactic GCs, NGC 6397, NGC 6752, and 47 Tuc, and conclude that the age of the oldest GCs is $13.4\pm 0.8$ (random) $\pm 0.6$ (systematic) Gyr, in good agreement with the 3-year results from the Wilkinson Microwave Anisotropy Probe (WMAP). This led them to suggest that the oldest Galactic GCs formed within the first 1.7 Gyr after the Big Bang, at the $1\sigma$ confidence level. We note that this is still fully compatible with the 5-year WMAP results constraining the age of the Universe to $13.73\pm 0.12$ Gyr (Hinshaw et al. 2008). While the ages of the oldest GCs in the Galaxy are now reasonably well determined, this is certainly not the case even for our nearest large neighbour, the Andromeda galaxy (M31). The most direct method for determining the age of a star cluster is by means of individual stellar photometry, since the main-sequence turn-off location is mostly affected by age (see, e.g., Puzia et al. 2002b, and references therein). However, this method has only been applied to Galactic GCs and to GCs associated with the Milky Way’s satellites (e.g., Riich 2001), in which individual stars can be resolved and their photometry determined to satisfactory accuracy, to a few magnitudes fainter than the main-sequence turn-offs. This is difficult, if not impossible, to achieve even for GCs as close as those associated with M31 (but see Brown et al. 2004), at a distance of $D=772\pm 44$ kpc (e.g., Ribas et al. 2005). Fortunately, starting from the pioneering work of Tinsley (1968, 1972) and Searle et al. (1973), evolutionary population synthesis modeling has become a powerful tool to address many outstanding problems in astrophysics, from determining the ages of star clusters to interpreting integrated spectrophotometric observations of galaxies. Therefore, extragalactic GC ages can, in general, also be inferred from composite colors and/or integrated spectroscopy. The evolution of GCs is usually modeled by means of the simple stellar population (SSP) approximation. An SSP is a single generation of coeval stars formed from the same progenitor molecular cloud (thus implying a single metallicity), and governed by a given stellar initial mass function (IMF). GCs are ideal templates to test the compatibility between the population synthesis models and reality. Barmby & Huchra (2000) compared the predicted SSP colors of three stellar population synthesis models to the intrinsic broad-band $UBVRIJHK$ colors of Galactic and M31 GCs, and concluded that the best-fitting models match the cluster colors very well. Subsequently, many authors have used SSP modeling to determine the parameters of cluster populations. For instance, de Grijs et al. (2003a) determined the ages and masses of star clusters in the fossil starburst region B of M82 by comparing the observed cluster spectral energy distributions (SEDs) with both the Starburst99 SSP models (Leitherer et al. 1999) and those developed by Bruzual & Charlot (2000), based on Hubble Space Telescope (HST) observations from the blue optical to the near-infrared (NIR) (see also de Grijs et al. 2003b, 2003c); Bik et al. (2003) and Bastian et al. (2005) estimated ages, initial masses and extinction values for M51 star cluster candidates by comparing the Starburst99 and the Frascati models (Romaniello 1998) for instantaneous star formation with the observed SEDs based on HST/WFPC2 observations in six broad-band and two narrow-band filters. Ma et al. (2006) and Fan et al. (2006) obtained age estimates for M31 GCs by fitting theoretical stellar population synthesis models (Bruzual & Charlot 2003, henceforth BC03) to their photometric measurements in a large number of intermediate- and broad-band passbands from the optical to the NIR. Based on the same method and models, Ma et al. (2007a) constrained the age of the M31 GC S312, using multicolor photometry from the near-ultraviolet (NUV) to the NIR, to $9.5^{+1.15}_{-0.99}$ Gyr. S312 is among the first extragalactic GCs for which the age was estimated accurately using main-sequence photometry, i.e., Brown et al. (2004) estimated the age of S312 at $10^{+2.5}_{-1}$ Gyr by means of a quantitative comparison with the isochrones of VandenBerg et al. (2006). This was based on their analysis of the cluster’s color-magnitude diagram (CMD) below the main-sequence turn-off using extremely deep images obtained with the HST/Advanced Camera for Surveys (ACS). It is a common misconception that spectroscopic age estimates are always much better than those based on broad-band photometry. Schweizer et al. (2004) recently showed convincingly that spectroscopic age determinations are not necessarily better or more accurate than photometrically obtained ages, at least in the age range from $\sim 100-500$ Myr. Anders et al. (2004) published a detailed theoretical investigation of the accuracy of retrieved star cluster properties, including their ages, based on sophisticated fits of SSP models to observed broad-band SEDs spanning varying wavelength ranges. They concluded that if one has access to as large a wavelength range as possible, ideally including both ultraviolet and NIR data points, the resulting age estimates are reasonably accurate, even for ages as old as $\sim 10$ Gyr – particularly if one or more of the other free parameters (e.g., metallicity or extinction) can be constrained reliably and independently (see Anders et al. 2004, e.g., their fig. 14). We will use this promising approach as our basic premise in this paper. Of the Local Group members, M31 is particularly important as it provides a direct comparison with our own Galaxy. In addition, it contains a large number of GCs and GC candidates, including 496 genuine, 367 probable, and 301 possible GCs (Kim et al. 2007). The M31 GC system is among the extragalactic GC systems studied most often (Harris 1991; Brodie & Strader 2006). As one of the brightest M31 GCs, Mayall II = G1 has attracted much scientific interest (see, e.g., Barmby et al. 2007; Ma et al. 2007b, and references therein). In this paper, we first determine the age and mass of G1 by comparing observational SEDs (§2) with population synthesis models (§3). We will use the lessons learned from studies of broad-band photometric SED fits to minimize the associated uncertainties. We discuss our results along the way, as appropriate, and provide a summary in §4. ## 2 Ultraviolet, optical, and infrared observations of G1 ### 2.1 Historical observations G1 was first detected by Mayall & Eggen (1953) (their No. 2, and hence referred to as Mayall II), who searched for nebulous objects associated with M31 using a $6^{\circ}\times 6^{\circ}$ Palomar 48-inch Schmidt plate taken in 1948 and centered on M31. Subsequently, Sargent et al. (1977) rediscovered the cluster (their No. 1, i.e., G1) based on their survey of 29 plates associated with the general field of M31, which had been obtained at the $f/2.7$ prime focus of the Kitt Peak National Observatory’s (KPNO) 4-m telescope. The cluster is located in the halo of M31, at a projected distance of about 40 kpc from the galaxy’s nucleus (see Meylan et al. 2001). ### 2.2 GALEX ultraviolet, optical broad-band, and 2MASS NIR photometry Although the cluster is generally believed to be among the oldest GCs in M31, to the best of our knowledge there is no CMD-based or spectroscopic age estimate available in the literature to date. The lack of a CMD-based age estimate is due to the challenges associated with probing the cluster’s CMD down to below the main-sequence turn-off. The current deepest CMD of the cluster (Meylan et al. 2001) does not reach these faint levels. Although both integrated and spatially-resolved spectra of the cluster are available (e.g., Huchra et al. 1991; Gebhardt et al. 2005; Cohen 2006), they have thus far not been used to determine an age for G1. This may be partially due to the limited wavelength range covered by most of these spectra, and the difficulties one faces when trying to constrain ages in the regime beyond $\sim 10$ Gyr (see below). To constrain the age of G1 accurately, with the smallest uncertainty allowed by the observational data, we use as many photometric data points covering as large a wavelength range as possible. Kaviraj et al. (2007) showed that the combination of far (FUV) and near-ultraviolet photometry with optical observations in the standard broad bands enables one to efficiently break the age-metallicity degeneracy; Worthey (1994) showed that the age-metallicity degeneracy associated with optical broad-band colors is $\Delta{\rm age}/\Delta Z\sim 3/2$ (also see MacArthur et al. 2004). However, de Jong (1996) showed that this degeneracy can be partially broken by adding NIR photometry to the optical colors, which was recently supported by Wu et al. (2005). Cardiel et al. (2003) found that inclusion of an infrared passband can improve the predictive power of the stellar population diagnostics by $\sim$30 times compared to using optical photometry alone. Since NIR photometry is less sensitive to interstellar extinction than the classical optical passbands, Kissler-Patig et al. (2002) and Puzia et al. (2002a) also suggested that it provides useful complementary information that can help to disentangle the age-metallicity degeneracy (also see Galleti et al. 2004). The M31 field was observed as part of the Nearby Galaxies Survey (NGS) by the Galaxy Evolution Explorer (GALEX) in two ultraviolet bands (see for details from Rey et al 2005, 2007). Rey et al. (2007) published photometric data for 485 and 273 M31 GCs in the GALEX NUV and FUV bands, respectively. G1 was detected in these two ultraviolet bands. The GALEX photometric system is calibrated to match the spectrophotometric AB system. van den Bergh (1969) determined photo-electric photometry for 45 M31 GCs, including G1, in the $UBV$ bands. Using CCD imaging from the KPNO 0.9m telescope, Reed, Harris & Harris (1994) published integrated $BVR$ magnitudes and color indices for 41 GCs and GC candidates, including G1, in the outer halo of M31. We compared the photometry of G1 in the $B$ and $V$ bands between these two studies; the results match closely. In this paper, we adopt the CCD $BVR$ photometry of Reed, Harris & Harris (1994), and the photographic $U$-band photometry of van den Bergh (1969), with a photometric uncertainty of 0.08 mag as suggested by Galleti et al. (2004). Based on HST images, Barmby & Huchra (2001) detected and published photometry for 114 GC candidates associated with M31, including 32 new objects. Their $V$-band photometry is in good agreement with that of van den Bergh (1969) and Reed, Harris & Harris (1994), although they do not provide their photometric uncertainties. However, Barmby & Huchra (2001) compared their HST photometry with the ground-based measurements compiled by Barmby et al. (2000), and found that the median offset in $I$ is $0.06\pm 0.04$ mag. Therefore, we adopt $0.06$ mag as the photometric uncertainty in the $I$ band. Using the Two Micron All Sky Survey (2MASS) database, Galleti et al. (2004) identified 693 known and candidate GCs in M31, and listed their 2MASS $JHK_{\rm s}$ magnitudes. Galleti et al. (2004) transformed all 2MASS magnitudes to the CIT photometric system (Elias et al. 1982, 1983) using the color transformations in Carpenter (2001). However, we need the original 2MASS $JHK_{\rm s}$ magnitudes to compare our observational SEDs with the SSP models, so we reversed this transformation using the same procedures. Since Galleti et al. (2004) do not provide the photometric uncertainties in $JHK_{\rm s}$, we obtained these by comparing the magnitudes with fig. 2 of Carpenter et al. (2001), where the observed photometric rms uncertainties in the time series are shown as a function of magnitude, for stars brighter than the observational completeness limits. In fact, the photometric uncertainties adopted do not affect our results significantly, as we showed in Fan et al. (2006) (see their section 4.3 for details). The full set of ultraviolet, optical broad-band, and 2MASS NIR photometry of G1 is listed in Table 1\. The $UBVRI$ and 2MASS magnitudes are given in the Vega system Schneider et al. (1977). For convenience, we converted all observational magnitudes to the AB system, following the procedures recommended in BC03. Table 1: Ultraviolet, optical broad-band, and NIR 2MASS photometry of G1. Filter | Magnitude (uncertainty) | Reference ---|---|--- FUV | 18.972 (0.031) | Rey et al. (2007) NUV | 18.014 (0.012) | $U$ | 14.85 (0.08) | van den Bergh (1969) $B$ | 14.584 (0.013) | Reed, Harris & Harris (1994) $V$ | 13.750 (0.007) | $R$ | 13.191 (0.010) | $I$ | 12.684 (0.060) | Barmby & Huchra (2001) $J$ | 11.858 (0.054) | Galleti et al. (2004) $H$ | 11.127 (0.054) | $K_{\rm s}$ | 11.016 (0.054) | ### 2.3 Reddening and metallicity To obtain the intrinsic SED of G1, the photometric data must first be dereddened. Since G1 is located in the halo of M31, i.e., far away from the galaxy’s disk, it is (for all practical purposes) only affected by Galactic foreground extinction. In fact, some authors have demonstrated that G1 is affected by a negligible amount of reddening. Meylan et al. (2001) used HST/WFPC2 observations in the F555W and F814W filters, and applied Sarajedini (1994)’s method to simultaneously determine the cluster’s reddening and metallicity; they obtained a reddening of $E(V-I)=0.05\pm 0.02$ mag toward G1, which is less than the Galactic foreground extinction. van den Bergh (1969) studied the reddening in the halo of M31 by comparing the colors of clusters with the same line-strength index in the Galaxy and in M31, and obtained a mean reddening of $E(B-V)=0.08\pm 0.02$ mag for the clusters in the halo of M31. Barmby et al. (2000) determined the reddening for each individual cluster using correlations between optical and infrared colors and metallicity, and by defining various ‘reddening-free’ parameters based on their large database of multi-color photometry. For G1, Barmby et al. (2000, also P. Barmby, priv. comm.) obtained $E(B-V)=0.09\pm 0.02$ mag. In this paper, we adopt the reddening value from Barmby et al. (2000). The values for the extinction coefficient, $R_{\lambda}$, were obtained by interpolating the interstellar extinction curve of Cardelli et al. (1989). Cluster SEDs are determined by the combination of their ages and metallicities, which is often referred to as the age-metallicity degeneracy. Therefore, the age of a cluster can only be constrained accurately if the metallicity is known with confidence, from independent determinations. There exist two metallicity determinations for G1. Huchra et al. (1991) derived metallicities for 150 M31 GCs, including G1, using the strengths of six absorption features in the clusters’ integrated spectra. The resulting metallicity of G1 is $\rm[Fe/H]=-1.08\pm 0.09$. Meylan et al. (2001) used HST/WFPC2 photometry to construct deep CMDs for G1, combined with the shape of the red-giant branch as calibrated by Sarajedini et al. (2000), to derive the mean metallicity of G1 on the scale of Zinn & West (1984), $\rm[Fe/H]=-0.95\pm 0.09$. In this paper, we adopt $\rm[Fe/H]=-1.08\pm 0.09$ for G1. ## 3 The stellar population of G1 ### 3.1 Stellar populations and synthetic photometry In this section, we compare the SED of G1 with theoretical stellar population synthesis models. We start by using the BC03 SSP models, which have been upgraded from the earlier Bruzual & Charlot (1993, 1996) versions, and now provide the evolution of the spectra and photometric properties for a wider range of stellar metallicities. BC03 provide 26 SSP models (both of high and low spectral resolution) using the Padova-1994 evolutionary tracks, half of which were computed based on the Salpeter (1955) IMF with lower and upper-mass cut-offs of $m_{\rm L}=0.1~{}M_{\odot}$ and $m_{\rm U}=100~{}M_{\odot}$, respectively. The other thirteen were computed using the Chabrier (2003) IMF with the same mass cut-offs. In addition, BC03 provide 26 SSP models using the Padova-2000 evolutionary tracks. In this paper, we will use all of these SSP models to determine the most appropriate age and mass for G1. These SSP models contain 221 spectra describing the spectral evolution of SSPs from $1.0\times 10^{5}$ yr to 20 Gyr. The evolving spectra include the contribution of the stellar component at wavelengths from 91Å to $160\mu$m. Since our observational data are integrated luminosities through a given set of filters, we convolved the theoretical SSP SEDs of BC03 with the FUV and NUV, broad-band $UBVRI$, and 2MASS $JHK_{\rm s}$ filter response curves to obtain synthetic ultraviolet, optical, and NIR photometry for comparison. The synthetic magnitude in the AB magnitude system for the $i{\rm th}$ filter can be computed as $m_{\lambda_{i}}=-2.5\log\frac{\int_{\lambda}F_{\lambda}\varphi_{i}(\lambda){\rm d}\lambda}{\int_{\lambda}\varphi_{i}(\lambda){\rm d}\lambda}-48.60,$ (1) where $F_{\lambda}$ is the theoretical SED and $\varphi_{i}$ the response curve of the $i{\rm th}$ filter. $F_{\lambda}$ varies as a function of age and metallicity. ### 3.2 Fit results We use a $\chi^{2}$ minimization approach to examine which SSP models are most compatible with the observed SEDs, following $\chi^{2}=\sum_{i=1}^{10}{\frac{[m_{\lambda_{i}}^{\rm intr}-m_{\lambda_{i}}^{\rm mod}(t)]^{2}}{\sigma_{i}^{2}}},$ (2) where $m_{\lambda_{i}}^{\rm mod}(t)$ is the integrated magnitude in the $i{\rm th}$ filter of a theoretical SSP at age $t$, $m_{\lambda_{i}}^{\rm intr}$ represents the intrinsic integrated magnitude in the same filter, and $\sigma_{i}^{2}=\sigma_{{\rm obs},i}^{2}+\sigma_{{\rm mod},i}^{2}.$ (3) Here, $\sigma_{{\rm obs},i}^{2}$ is the observational uncertainty, and $\sigma_{{\rm mod},i}^{2}$ is the uncertainty associated with the model itself, for the $i{\rm th}$ filter. Charlot et al. (1996) estimated the uncertainty associated with the term $\sigma_{{\rm mod},i}^{2}$ by comparing the colors obtained from different stellar evolutionary tracks and spectral libraries. Following Wu et al. (2005), we adopt $\sigma_{{\rm mod},i}^{2}=0.05$. The BC03 SSP models based on the Padova-1994 evolutionary tracks include six initial metallicities, $Z=0.0001,0.0004,0.004,0.008,0.02\,(Z_{\odot})$, and 0.05, corresponding to ${\rm[Fe/H]}=-2.25,-1.65,-0.64,-0.33,+0.09$, and $+0.56$. However, the BC03 SSP models based on the Padova-2000 evolutionary tracks include six partially different initial metallicities, $Z=0.0004$, 0.001, 0.004, 0.008, 0.019 $(Z_{\odot})$, and 0.03, i.e., ${\rm[Fe/H]}=-1.65,-1.25,-0.64,-0.33,+0.07$, and $+0.29$. Spectra for other metallicities can, in principle, be obtained by interpolation of the appropriate spectra for any of these metallicities, although this is not necessarily advisable or straightforward (Frayn & Gilmore 2002). Instead, we adopt the most appropriate model metallicity for the analysis performed in this paper. Since we have good estimates of the metallicity and reddening values of G1 (see §2.3), the cluster age is therefore the sole parameter to be estimated (for a given IMF and extinction law, both of which we assume to be universal). None of the SSP models fit the photometric data point in the GALEX FUV band as well as the other nine data points. (We checked that the image of G1 in the FUV band is not affected by instrumental problems.) Given that G1 contains an old stellar population, the most likely physical explanation for this FUV excess compared to the ‘standard’ BC03 SSP models is the presence of a significant number of FUV-bright, hot, extreme horizontal-branch (EHB) stars giving rise to the well-known ‘ultraviolet upturn’ below $\lambda\simeq 2000$Å (see, e.g., the review of O’Connell 1999, and references therein; see also Landsman et al. 1998; Sohn et al. 2006). (Alternative species, such as AGB- manqué stars or blue stragglers are expected to be fewer in number in any ‘normal’ stellar population.) Since ‘standard’ SSP models do not contain EHB populations, we are forced to deselect the photometric FUV data point when applying our fitting routines. In Fig. 1, we show the intrinsic SED of G1 and the integrated SEDs of the best- fitting models. The dereddened data are shown as the symbols with error bars (vertical errors for photometric uncertainties and horizontal error bars for the approximate wavelength coverage of each filter); open circles represent the calculated magnitudes of the model SED for each filter, obtained by convolving the theoretical SSP SEDs with the appropriate filter response curves. The best reduced-$\chi^{2}$ values and ages are listed in Table 2. The mass of G1, also listed in Table 2, can be estimated by comparing the measured luminosity in the $V$ band with the theoretical mass-to-light ($M/L$) ratios. These $M/L$ ratios are a function of the cluster age and metallicity. The mass-to-light ratios of G1, calculated based on the metallicity adopted and the age obtained in this paper, are listed in Table 2 for the BC03 SSP models. Based on its present luminosity, $V=13.750\pm 0.007$ mag, and extinction, $E(B-V)=0.09$ mag, the cluster’s visual magnitude corrected for the extinction is $V_{0}=13.471\pm 0.007$ mag, assuming a Cardelli et al. (1989) Galactic reddening law with $A_{V}=0.279$ mag. (We note that the NUV data point is also marginally affected by the onset of the UV upturn, which causes a slight mismatch between the observations and the best-fitting theoretical SSP models.) Figure 1: Best-fitting integrated theoretical BC03 SEDs compared to the intrinsic SED of G1. The photometric measurements are shown as the symbols with error bars (vertical for uncertainties and horizontal for the approximate wavelength coverage of each filter). Open circles represent the calculated magnitudes of the model SED for each filter. We did not use the FUV photometric data point for the fits (see text). ### 3.3 Age and mass In the previous section we determined the best-fitting age and mass of G1 based on different theoretical SSP models. From Table 2 we conclude that, within the errors, the ages obtained from the different BC03 models are internally consistent. The mean age of G1 is $18.23\pm{1.76}$ Gyr. This is in excellent agreement with the only other available (rough) age estimate for the cluster by Meylan et al. (2001), who estimated its age to be $\sim$15 Gyr. However, we note that the age of G1 obtained in this paper is older than the current-best estimate of the age of the Universe, of order 13.7 Gyr, as discussed in §3.1. We will discuss this problem in §4. Table 2: Age and mass estimates of G1 based on the BC03 models. Evolutionary Track | IMF | Age | $\chi^{2}/\rm{degree~{}~{}of~{}~{}freedom}$ | $M/L_{V}$ | Mass ---|---|---|---|---|--- | | (Gyr) | | $(M/L_{V})_{\odot}$ | $(10^{7}M_{\odot})$ Padova 1994 | Salpeter (1955) | $19.68\pm{0.75}$ | 3.04 | 5.10 | $1.06\pm{0.07}$ Padova 1994 | Chabrier (2003) | $19.79\pm{0.50}$ | 2.69 | 3.15 | $0.65\pm{0.04}$ Padova 2000 | Salpeter (1955) | $15.44\pm{0.78}$ | 5.36 | 4.14 | $0.86\pm{0.05}$ Padova 2000 | Chabrier (2003) | $18.01\pm{2.00}$ | 5.27 | 2.79 | $0.58\pm{0.04}$ We conclude that the various mass estimates listed in Table 2 place G1 firmly at the top of the cluster mass function in the Local Group. Meylan et al. (2001) presented three estimates of the total mass of G1, (i) a King-model mass (King 1966) of $1.5\times 10^{7}M_{\odot}$, (ii) a virial mass of $0.75\times 10^{7}~{}M_{\odot}$; and (iii) a mass based on a King-Michie model (as defined by Gunn & Griffi 1979) fitted simultaneously to the surface brightness profile and the central velocity dispersion value, estimated between $1.4\times 10^{7}M_{\odot}$ and $1.7\times 10^{7}M_{\odot}$. Our results are in reasonable agreement with Meylan et al. (2001), although we are aware that the King and King-Michie mass estimates of Meylan et al. (2001) are up to a factor of two greater than our photometric mass estimates. This is not too surprising in view of the model assumptions made. Cohen (2006) recently obtained an optical velocity dispersion for the cluster using the Keck/HIRES spectrograph, and derived an aperture-corrected line-of-sight velocity dispersion, $\sigma_{\rm los}=25.5\pm 1.5$ km s-1 (where we have averaged the values she obtained for the two reddest wavelength ranges analyzed; see also Djorgovski et al. 2002). We recently redetermined a projected half-light radius for G1 of $r_{\rm h}=6.5\pm 0.3$ pc (Ma et al. 2007b). Thus, based on these most recent results, the dynamical (virial) mass of G1 is $M_{\rm vir}=(7.37\pm 2.15)\times 10^{6}M_{\odot}$. This is in excellent agreement with the photometric mass estimates obtained in this paper. In turn, this strongly supports the notion that G1 must have had a close-to-‘normal’ stellar IMF, in order for it to have survived dissolution due to internal two-body relaxation until the present time (see also Ma et al. 2006). In particular, this is driven by the observation that if the IMF is too shallow, i.e., if a cluster is significantly depleted in low-mass stars compared to (for instance) the solar neighborhood, it will disperse within a few orbital periods around its host galaxy’s center, and most likely within about a Gyr of its formation (e.g., Gnedin & Ostriker 1997; Goodwin 1997; Smith & Gallagher 2001; Mengel et al. 2002; Rose, Kouwenhoven & de Grijs, in prep.). From the recent work of Ma et al. (2006), the intrinsically most luminous M31 GC, 037-B327, has been suggested to be the most massive GC in the Local Group, with a total mass of $\sim(3.0\pm 0.5)\times 10^{7}M_{\odot}$, also determined photometrically and somewhat depending on the SSP models used, the metallicity and age adopted, and the IMF representation. However, Cohen (2006) pointed out that the photometric mass of this cluster had likely been overestimated due to an incorrect extinction correction. Nevertheless, she also confirmed the nature of 037-B327 as one of the most massive GCs in the Local Group, with a dynamical mass similar to that of G1. It is intriguing that these two most massive GC in M31 both are significantly more massive than the most massive Galactic GC, $\omega$ Cen [$\sim(2.9-5.1)\times 10^{6}M_{\odot}$; Meylan (2002)]. In fact, the high mass of these clusters raises additional, intriguing questions regarding the nature of these objects in general, and of G1 in particular (see also Federici et al. 2007; Ma et al. 2007b, and references therein). It has been speculated that these objects may be nucleated dwarf galaxies instead of genuine GCs. In support of this notion, we point out that Gieles et al. (2006) suggest that there may be a physical upper limit to the mass of a star cluster that is not merely the result of size-of-sample effects. This maximum mass depends to some extent on the galactic environment; for their example galaxies, M51 and the Antennae system, they find a physical upper limit to the stellar mass of $\sim(10^{5}-10^{6})M_{\odot}$. Our values derived for both the photometric and the virial mass of G1 are well above these suggested upper mass limits. This may, therefore, provide an additional (although circumstantial) proverbial nail in the coffin of G1 as a normal GC. ### 3.4 Luminosity of the hot, extreme horizontal-branch stars As discussed in §3.3, none of the BC03 SSP models fit the photometric data point in the GALEX FUV band as well as the other nine data points. EHB stars may be responsible for this excess in FUV band. In fact, Rich et al. (1996) found some bluer horizontal-branch stars extending to $(V-I)=0.0$ mag, based on their HST/WFPC2 observations. In this section, we will calculate the luminosity of the EHB stars. We assume that the excess in the GALEX FUV band is solely due to these EHB stars. The magnitude differences between the four SSP models employed in this paper and the photometric data points are 0.63, 1.00, 0.56, and 0.94 mag, respectively, corresponding $(2.44,1.07,2.11,\mbox{ and }1.00)\times 10^{2}L_{\odot}$, respectively, with a mean number of EHB stars in G1 of $(1.65\pm 0.63)\times 10^{2}L_{\odot}$. ### 3.5 Comparison between G1 and S312 Brown et al. (2004) showed that a 10 Gyr old population in M31 has a main- sequence turnoff at about $m_{\rm F814W}=28.8$ mag. Their deep observations needed exposures of 39.1 hours in F606W and 45.5 hours F814W, spanning 120 orbits of HST/ACS imaging observations (Brown et al. 2003, 2004). In the future, such deep HST observations will only be obtained for a very small number of fields (e.g., Rich et al. 2005). As discussed in §1, Ma et al. (2007a) constrained the age of the M31 GC S312 by comparing multicolor photometry and theoretical stellar population synthesis models. It is encouraging that the age obtained by Ma et al. (2007a) is in good agreement with the previous determination based on main-sequence photometry (Brown et al. 2004), i.e., $9.5^{+1.15}_{-0.99}$ Gyr versus $10^{+2.5}_{-1}$ Gyr. S312 is one of the few extragalactic GCs for which the age can be determined from main-sequence photometry. By comparing the ages of S312 and G1 determined using the same method, we can conclude that S312 is younger than the majority of the Galactic GCs at the same metallicity, and G1 is as old as the oldest Galactic GCs. In fact, if we try to fit the intrinsic SEDs of G1 by the theoretical BC03 SSP SEDs at an age of 10 Gyr, the resulting fit is very poor indeed, particularly in the ultraviolet. Therefore, we conclude that the method used in this paper, by which the ages of both S312 and G1 have been determined, can be used to determine the ages of old stellar populations to satisfactory precision, and in particular to distinguish between young and old populations. ## 4 Summary and Conclusions In this paper, we first determined the age and mass of the M31 GC G1, as well as the realistic uncertainties associated with these estimates, by comparing its multicolor photometry with theoretical stellar population synthesis models. Our multicolor photometric data were obtained from GALEX FUV and NUV, broad-band optical $UBVRI$, and 2MASS $JHK_{\rm s}$ observations, which form an SED covering the wavelength range from 2267 to 20,000Å. Our results confirm that G1 is one of the oldest and most massive GCs in the Local Group – that is, if it is indeed a genuine GC given that its mass is well in excess of the physical maximum mass predicted by the models of Gieles et al. (2006). The age and mass obtained in this paper are somewhat dependent on the SSP model adopted. It is evident that the age of $18.23\pm{1.76}$ Gyr for G1 based on the BC03 models is greater than the currently accepted age of the Universe. However, we must keep in mind that the BC03 SSP models were calculated for ages up to 20 Gyr. In fact, ages derived for objects such as GCs and galaxies in excess of that of the Universe only mean that these objects are among the oldest objects in the Universe. In the context of the BC03 models and their associated age range up to 20 Gyr, our derived age for G1 is consistent with the suggestion by the WMAP team that the oldest GCs may have formed within the first 1.7 Gyr after the Big Bang (see §1). The integrated FUV flux depends mainly on the fractional number of horizontal- branch (HB) stars with temperatures hotter than $T_{e}\sim 10,000$ K, with a modest dependence on their temperature distribution (see Rey et al. 2007 and references therein). Older GCs produce more of these hot HB stars and they are thus more likely to produce stronger FUV fluxes at a given metallicity (see Rey et al. 2007 and references therein) Lee et al. (2003) showed that the addition of FUV photometry to optical data can discriminate cleanly among young ($<$1 Gyr), intermediate-age (3–5 Gyr), and old ($>$ 14 Gyr) GCs. Young and very old GCs exhibit a significant FUV-to-optical spectral continuum slope, but intermediate-age clusters are relatively faint in the FUV (see fig. 2 of Lee et al. 2003). Figure 6 of Rey et al. (2007) implies that the age of G1 may be similar to that of the oldest GCs. Overall, we therefore conclude that G1 is indeed among the oldest and most massive building blocks of M31, and provides a key limitation to the age of the Universe, although we caution that our results also provide circumstantial support to the suggestion that the cluster may not be a genuine GC. ## Acknowledgments We are indebted to the referee for thoughtful comments and insightful suggestions that improved this paper greatly. This work has been supported by the Chinese National Natural Science Foundation through Grant Nos. 10873016, 10803007, 10473012, 10573020, 10633020, 10673012, and 10603006; and by National Basic Research Program of China (973 Program) No. 2007CB815403. RdG acknowledges partial financial support from the Royal Society in the form of a UK-China International Joint Project. SCR acknowledges partial support from KOSEF through the Astrophysical Research Center for the Structure and Evolution of the Cosmos (ARCSEC). This paper makes use of data from the Two Micron All Sky Survey, which is a joint project of the University of Massachusetts and the Infrared Processing and Analysis Center, funded by NASA and the National Science Foundation. This paper is also partially based on archival observations with the NASA/ESA Hubble Space Telescope, obtained at the Space Telescope Science Institute (STScI), which is operated by the Association of Universities for Research in Astronomy, Inc., under NASA contract NAS 5-26555. This research has made use of NASA’s Astrophysics Data System Abstract Service. This reasearch is partially based on archival data from the NASA GALEX mission developed in cooperation with the Centre National d’Etudes Spatiales of France and the Korean Ministry of Science and Technology. ## References * Anders et al. (2004) Anders P., Bissantz N., Fritze-v. Alvensleben U., de Grijs R., 2004, MNRAS, 347, 196 * Barmby et al. (2000) Barmby P., Huchra J., Brodie J., Forbes D., Schroder L., Grillmair, C., 2000, AJ, 119, 727 * Barmby & Huchra (2000) Barmby P., Huchra J. P., 2000, ApJ, 531, L29 * Barmby & Huchra (2001) Barmby P., Huchra J. P., 2001, AJ, 122, 2458 * Barmby et al. (2002) Barmby P., Perrett K. M., Bridges T. J., 2002, MNRAS, 329, 461 * Barmby et al. (2007) Barmby P., McLaughlin D. E., Harris W. E., Harris G. L. H., Forbes D. A., 2007, AJ, 133, 2764 * Bastian et al. (2005) Bastian N., Gieles M., Lamers H. J. G. L. M., Scheepmaker R., de Grijs R., 2005,, A&A, 431, 905 * Bik et al. (2003) Bik A., Lamers H. J. G. L. M., Bastian N., Panagia N., Romaniello M., 2003, A&A, 397, 473 * Brown et al. (2003) Brown T. M. et al., 2003, ApJ, 592, L17 * Brown et al. (2004) Brown T. M. et al., 2004, ApJ, 613, L125 * Brodie & Strader (2006) Brodie J., Strader J., 2006, ARA&A, 44, 193 * Bruzual & Charlot (1993) Bruzual A. G., Charlot S., 1993, ApJ, 405, 538 * Bruzual & Charlot (1996) Bruzual A. G., Charlot S., 1996, unpublished * Bruzual & Charlot (2000) Bruzual G., Charlot S., 2000, in Leitherer C. et al., eds, AAS CDROM Ser. Vol. 7. (Updated version of Bruzual G., Charlot S., 1996, PASP, 108, 996) * Bruzual & Charlot (2003) Bruzual A. G., Charlot S., 2003, MNRAS, 344, 1000 (BC03) * Cardelli et al. (1989) Cardelli J. A., Clayton G. C., Mathis J. S., 1989, ApJ, 345, 245 * Cardiel et al. (2003) Cardiel N., Gorgas J., Sánchez-Blázquez P., Cenarro A. J., Pedraz S., Bruzual A. G., Klement J., 2003, A&A, 409, 511 * Carpenter (2001) Carpenter J. M., 2001, AJ, 121, 2851 * Carpenter et al. (2001) Carpenter J. M., Hillenbrand L. A., Skrutskie M. F., 2001, AJ, 121, 3160 * Chaboyer et al. (1998) Chaboyer B., Demarque P., Kernan P. J., Krauss L. M., 1998, ApJ, 494, 96 * Chabrier (2003) Chabrier G., 2003, PASP, 115, 763 * Charlot et al. (1996) Charlot S., Worthey G., Bressan A., 1996, ApJ, 457, 625 * Cohen (2006) Cohen J. G., 2006, ApJ, 653, L21 * de Grijs et al. (2003a) de Grijs R., Bastian N., Lamers H. J. G. L. M., 2003a, MNRAS, 340, 197 * de Grijs et al. (2003b) de Grijs R., Fritze-v. Alvensleben U., Anders P., Gallagher J. S., Bastian N., Taylor V. A., Windhorst R. A., 2003b, MNRAS, 342, 259 * de Grijs et al. (2003c) de Grijs R., Anders P., Lynds R., Bastian N., Lamers H. J. G. L. M., O’Neill E. J. Jr., 2003c, MNRAS, 343, 1285 * de Jong (1996) de Jong R. S., 1996, A&A, 313, 377 * Djorgovski et al. (1997) Djorgovski S. G., Gal R. R., McCarthy J. K., Cohen J. G., de Carvalho R. R., Meylan G., Bendinelli O., Parmeggiani G., 1997, ApJ, 474, L19 * Elias et al. (1982) Elias J. H., Frogel J. A., Matthews K., Neugebauer G., 1982, AJ, 87, 1029 * Elias et al. (1983) Elias J. H., Frogel J. A., Hyland A. R., Jones T. J., 1983, AJ, 88, 1027 * Fan et al. (2006) Fan Z., Ma J., de Grijs R., Yang Y., Zhou, X., 2006, MNRAS, 371, 1648 * Federici et al. (2007) Federici L., Bellazzini M., Galleti S., Fusi Pecci F., Buzzoni A., Parmeggiani G., 2007, A&A, 473, 429 * Frayn & Gilmore (2002) Frayn C. M., Gilmore G. F., 2002, MNRAS, 337, 445 * Galleti et al. (2004) Galleti S., Federici L., Bellazzini M., Fusi Pecci F., Macrina S., 2004, A&A, 426, 917 * Gieles et al. (2006) Gieles M., Larsen S. S., Bastian N., Stein I. T., 2006, A&A, 450, 129 * Gratton et al. (2003) Gratton R. G., Bragaglia A., Carretta E., Clementini G., Desidera S., Grundahl F., Lucatello S., 2003, A&A, 408, 529 * Gunn & Griffin (1979) Gunn J. E., Griffin R. F., 1979, AJ, 84, 752 * Gnedin & Ostriker (1997) Gnedin O. Y., Ostriker J. P., 1997, ApJ, 474, 223 * Goodwin (1997) Goodwin S. P., 1997, MNRAS, 286, 669 * Harris (1991) Harris W. E., 1991, ARA&A, 29, 543 * Gebhardt et al. (2005) Gebhardt K., Rich R. M. R., Ho, L. C., 2005, ApJ, 634, 1093 * Holland et al. (1997) Holland S., Fahlman G. G., Richer H. B., 1997, AJ, 114, 1488 * Huchra et al. (1991) Huchra J. P., Brodie J. P., Kent S. M., 1991, ApJ, 370, 495 * Kaviraj et al. (2007) Kaviraj S., Rey S. C., Rich R. M., Yoon S. J., Yi S. K., 2007, MNRAS, 381, L74 * Kim et al. (2007) Kim S. et al., 2007, AJ, 134, 706 * King (1966) King I., 1966, AJ, 71, 64 * Kissler-Patig et al. (2002) Kissler-Patig M., Brodie J. P., Minniti D., 2002, A&A, 391, 441 * Kroupa (2001) Kroupa P., 2001, MNRAS, 322, 231 * Landsman et al. (1998) Landsman W., Bohlin R. C., Neff S. G., O’Connell R. W., Roberts M. S., Smith A. M., Stecher T. P., 1998, AJ, 116, 789 * Lee et al. (2003) Lee H. C., Lee Y. W., Gibson B. K., 2003, in Extragalactic Globular Cluster Systems, ed. M. Kissler-Patig (Berlin: Springer), 261 * Leitherer et al. (1999) Leitherer C. et al., 1999, ApJS, 123, 3 * Ma et al. (2006) Ma J., de Grijs R., Yang Y., Zhou X., Chen J., Jiang Z., Wu Z., Wu J., 2006, MNRAS, 368, 1443 * Ma et al. (2007a) Ma J. et al., 2007a, ApJ, 659, 359 * Ma et al. (2007b) Ma J. et al., 2007b, MNRAS, 376, 1621 * MacArthur et al. (2004) MacArthur L. A., Courteau S., Bell E., Holtzman J. A., 2004, ApJS, 152, 175 * Mayall & Eggen (1953) Mayall N. U., Eggen O. J., 1953, PASP, 65, 24 * Mengel et al. (2002) Mengel S., Lehnert M. D., Thatte N., Genzel R., 2002, A&A, 383, 137 * Meylan et al. (2001) Meylan G., Sarajedini A., Jablonka P., Djorgovski S. G., Bridges T., Rich R. M., 2001, AJ, 122, 830 * Meylan (2002) Meylan G., 2002, in: Extragalactic Star Clusters, Geisler D., Grebel E. K., Minniti D., eds., (ASP: San Francisco), IAUS, 207, 555 * O’Connell (1999) O’Connell R. W., 1999, ARA&A, 37, 603 * Puzia et al. (2002a) Puzia T. H., Saglia R. P., Kissler-Patig M., Maraston C., Greggio L., Renzini A., Ortolani S., 2002a, A&A, 395, 45 * Puzia et al. (2002b) Puzia T. H., Zepf S. E., Kissler-Patig M., Hilker M., Minniti D., Goudfrooij P., 2002b, A&A, 391, 453 * Reed, Harris & Harris (1994) Reed L. G., Harris G. L. H., Harris, W. E., 1994, AJ, 107, 555 * Rey et al. (2005) Rey S. C. et al., 2005, ApJ, 619, L119 * Rey et al. (2007) Rey S. C. et al., 2007, ApJS, 173, 643 * Ribas et al. (2005) Ribas I., Jordi C., Vilardell F., Fitzpatrick E. L., Hilditch R. W., Guinan E. F., 2005, ApJ, 635, L37 * Rich et al. (1996) Rich R. M., Mighell K. J., Freedman W. L., Neill J. D., 1996, AJ, 111, 768 * Rich et al. (2001) Rich R. M., Shara M. M., Zurek, D., 2001, AJ, 122, 842 * Rich et al. (2005) Rich R. M., Corsi C. E., Cacciari C., Federici L., Fusi Pecci F., Djorgovski S. G., Freedman, W. L., 2005, AJ, 129, 2670 * Romaniello (1998) Romaniello M., 1998, Ph.D. Thesis, Scuola Normale Superiore di Pisa * Salpeter (1955) Salpeter E. E., 1955, ApJ, 121, 161 * Sarajedini (1994) Sarajedini A., 1994, AJ, 107, 618 * Sarajedini et al. (2000) Sarajedini A., Geisler D., Schommer R., Harding P., 2000, AJ, 120, 2437 * Sargent et al. (1977) Sargent W. L. W., Kowal C. T., Hartwic F. D. A., van den Bergh S., 1977, AJ, 82, 947 * Scalo (1986) Scalo J. M., 1986, Fundamentals of Cosmic Physics, 11, 1 * Schweizer et al. (2004) Schweizer F., Seitzer P., Brodie J. P., 2004, AJ, 128, 202 * Searle et al. (1973) Searle L., Sargent W. L. W., Bagnuolo W. G., 1973, ApJ, 179, 427 * Schneider et al. (1977) Schneider D. et al., 2002, AJ, 123, 458 * Smith & Gallagher (2001) Smith L. J., Gallagher J. S., 2001, MNRAS, 326, 1027 * Sohn et al. (2006) Sohn S. T., O’Connell R. W., Kundu A., Landsman W. B., Burstein D., Bohlin R. C., Frogel J. A., Rose J. A., 2006, AJ, 131, 866 * Tinsley (1968) Tinsley B. M., 1968, ApJ, 151, 547 * Tinsley (1972) Tinsley B. M., 1972, ApJ, 178, 319 * VandenBerg et al. (2006) VandenBerg D. A., Bergbusch P. A., Dowler P. D., 2006, ApJS, 162, 375 * van den Bergh (1969) van den Bergh S., 1969, ApJS, 19, 145 * Zinn & West (1984) Zinn R., West M. J., 1984, ApJS, 55, 45 * Worthey (1994) Worthey G., 1994, ApJS, 95, 107 * Wu et al. (2005) Wu H., Shao Z. Y., Mo H. J., Xia X. Y., Deng Z. G., 2005, ApJ, 622, 244
arxiv-papers
2009-04-04T03:02:40
2024-09-04T02:49:01.678517
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Jun Ma, Richard de Grijs, Zhou Fan, Soo-Chang Rey, Zhenyu Wu, Xu Zhou,\n et al", "submitter": "Jun Ma", "url": "https://arxiv.org/abs/0904.0674" }
0904.0700
LPTh-Ji 09/002 Sphalerons on Orbifolds Amine Ahriche LPTh, University of Jijel, PB 98, Ouled Aissa, DZ-18000 Jijel, Algeria. LPMPS, University of Constantine, Ain El-Bey, DZ-25000 Constantine, Algeria. Faculty of Physics, University of Bielefeld, Postfach 100131, D-33501 Bielefeld, Germany. Abstract In this work, we study the electroweak sphalerons in a 5D background, where the fifth dimension lies on an interval. We consider two specific cases: flat space-time and the anti-de Sitter space-time compactified on $S^{1}/Z_{2}$. In our work, we take the $SU(2)$ gauge-Higgs model, where the gauge fields reside in the 5D bulk; but the Higgs doublet is confined in one brane. We find that the results in this model are close to those of the 4D Standard Model (SM). The existence of the warp effect, as well as the heaviness of the gauge Kaluza-Klein modes make the results extremely close to the SM ones. Keywords: Sphalerons, Kalauza-Klein modes, Warp Factor. ## 1 Introduction The Standard Model (SM) of the electroweak and strong interactions has been very successful in describing nature at energies around the electroweak scale ($\sim 100~{}$GeV). However, it fails in answering many fundamental questions in particle physics, like, e.g., the hierarchy problem and the neutrino mass and its smallness, as well other problems related to cosmology like the baryon asymmetry in the universe and dark matter. Therefore a more fundamental theory, which describes nature at higher scales, needs to become known to explain the problems of particle physics and related topics. It has been realized that the hierarchy problem could be a consequence of the existence of extra dimensions [1]. A popular realization of this concept is the so-called Randall-Sundrum model [2]. There are several variants of this scenario, depending on whether the extra dimension is finite (RS1) or infinite (RS2), and on which of the fields is confined in a brane or lying on the bulk. In the RS1 models, the space-time has the 5D anti-de Sitter ($AdS_{5}$) geometry $\displaystyle ds^{2}$ $\displaystyle=g_{MN}dx^{M}dx^{N}=a^{2}\left(y\right)\eta_{\mu\nu}dx^{\mu}dx^{\nu}-dy^{2}$ (1) $\displaystyle=e^{-2ky}\eta_{\mu\nu}dx^{\mu}dx^{\nu}-dy^{2},$ (2) where $y$ is the fifth dimension that has the properties $y\equiv y+2\pi R$; and $y\equiv-y$; it is compactified on a half-circle $S^{1}/Z_{2}$ with two 4D boundaries ($y=0,\pi R$). The metric $\eta_{\mu\nu}=diag(-1,1,1,1)$ is the usual 4-dimensional one; and $k$ is the $AdS_{5}$ curvature. In this model, the relation between the Planck and the TeV scales seems to be natural, TeV$\sim w^{-1}M_{Pl}=e^{-\pi kR}M_{Pl}$, where the two fixed points of the fifth dimension $y=0,\pi R$ represent the Planck and the TeV branes, respectively. In the first paper [2], only gravity resides in the 5D bulk, while the SM fields are confined in the TeV brane. But problems with some of the SM fields are that propagating in the bulk were also considered, like the case of gauge fields [3, 4], scalars [5], fermions [6], the whole SM content [7]; and even supersymmetry [8]. As mentioned above, the SM fails to explain the origin of matter in the universe [9], it does not fulfill the second and the third Sakharov criteria for baryogenesis [10]. Although, the first criterion, baryon number violation, is achieved through the B+L anomaly [11], where both of the baryon and lepton numbers are violated by 3 units due to the possible transition between two equivalent neighboring vacua of the nontrivial topology of the SU(2) model. It was shown [11] that this transition probability is extremely suppressed, $\sim 10^{-162}$, but this is not the case at higher temperatures. The rate of $B$ violating processes is proportional to $T^{4}$ at the symmetric phase [12] and suppressed like $e^{-E_{Sp}/T}$ in the broken phase [13], where $E_{Sp}$ is the system’s static energy within the so-called sphaleron configuration [14, 15]; a field configuration that corresponds to the top of the barrier between two neighboring vacua. Due to their relevance to the electroweak baryogenesis scenario [9], sphalerons were extensively studied in the literature in extended SM variants as in the SM with a singlet [16, 17], the Minimal Supersymmetric Standard Model [18]; and in the next-to-Minimal Supersymmetric Standard Model [19]. In this work, we will study the sphaleron configuration for a SU(2) gauge- Higgs model in a 5D background, where the gauge fields propagate in the 5D bulk and the Higgs doublet is confined in a brane. We will focus on the warp effect, by comparing the $AdS_{5}$ results with the flat geometry case. In the second section, the model is shown, where the equations of motion (EOM) for the Higgs field and the Kaluza-Klein (KK) gauge modes are given. The sphaleron configuration within this model is expressed in section three. In the fourth section, we show the profile functions of the gauge and Higgs fields, as well the values of the sphaleron energy in different cases. These results will be compared by those of the SM. Finally, we give our conclusion. ## 2 SU(2) Gauge Fields in the Bulk Let us consider a SU(2) Higgs model in the 5D background (2), with a general warp factor $a(y)$. The warp factor $a\left(y\right)=1$ refers to the 5D flat geometry; and $a\left(y\right)=e^{-ky}$ refers to the AdS5 one. We have $\mu=0,3$ and $M=\mu,5$. In our model, only the gauge fields propagate in the bulk and the Higgs field is confined in one brane. The action that obeys the symmetry is $S=\int d^{4}xdy\sqrt{G}\left\\{\mathcal{L}_{bulk}+\Delta(y)\mathcal{L}_{brane}\right\\},$ (3) with $G=\det(g_{MN})$, and $\Delta(y)\equiv 2\delta\left(y\right),2\delta\left(y-\pi R\right)$ refers to the Higgs localization in the Planck or TeV branes respectively. The boundary Lagrangian is given by $\mathcal{L}_{brane}=g^{\mu\nu}\left(D_{\mu}H\right)^{{\dagger}}\left(D_{\nu}H\right)-V\left(H^{{\dagger}}H\right),$ (4) with the covariant derivative $D_{M}H=\left(\partial_{M}-\frac{i}{2}g_{5}\sigma^{a}A_{M}^{a}\right)H;$ (5) and $g_{5}=g\sqrt{\pi R}$ is the 5D SU(2) dimensionful gauge coupling, where $g$ is the 4D one . The bulk Lagrangian is given by $\mathcal{L}_{bulk}=-\frac{1}{4}g^{MN}g^{QW}F_{MQ}^{a}F_{NW}^{a},$ (6) where the 5D field strength is given by $F_{MN}^{a}=\partial_{M}A_{N}^{a}-\partial_{N}A_{M}^{a}+g_{5}\epsilon^{abc}A_{M}^{b}A_{N}^{c}.$ (7) In what follows, we work in the gauge ($\partial^{\mu}A_{\mu}^{a}=0,$ $A_{5}^{a}=0$). The scalar potential has the usual Mexican hat form $V\left(HH^{{\dagger}}\right)=\lambda\left(H^{{\dagger}}H-\upsilon^{2}/2\right)^{2},$ (8) where $\upsilon$ is the Higgs vev. The equations of motion (EOM) can be obtained by the vanishing of the action variation, $\delta S=0$, and we get $\displaystyle\Delta(y)a^{4}\left(y\right)\left[g^{\mu\nu}D_{\mu}D_{\nu}H+\frac{\partial}{\partial H^{{\dagger}}}V\left(H^{{\dagger}}H\right)\right]=0,$ (9) $\displaystyle\frac{i}{2}g_{5}\Delta(y)a^{4}\left(y\right)\left[H^{{\dagger}}\sigma^{a}D_{\mu}H-\left(D_{\mu}H\right)^{{\dagger}}\sigma^{a}H\right]-\partial_{5}a^{2}\left(y\right)\partial_{5}A_{\mu}^{a}+\eta^{\alpha\beta}\partial_{\beta}F_{\alpha\mu}^{a}=0,$ (10) with the boundary condition $\partial_{5}A_{\mu}^{a}=0$ at both boundaries, $y=0,\pi R$. The gauge fields have to be factorized using the KK decomposition as $A_{\mu}^{a}\left(x,y\right)=\sum\limits_{n}A_{\mu}^{a(n)}\left(x\right)\chi^{(n)}(y),$ (11) with $\int_{0}^{\pi R}\chi^{(n)}(y)\chi^{(m)}(y)dy=\delta_{nm}.$ (12) Then, the functions $\chi^{(n)}$ should be the eigenstates of the operator $-\partial_{5}a^{2}\left(y\right)\partial_{5}\chi^{(n)}=M_{n}^{2}\chi^{(n)},$ (13) with the condition $\partial_{5}\chi^{(n)}=0$ at both boundaries; $M_{n}$ are the KK masses. The zero mode $\chi^{(0)}\left(y\right)=1/\sqrt{\pi R}$; does not depend on the space-time geometry. In flat space-time, the heavy modes (13) are given by $\chi^{(n)}\left(y\right)=\sqrt{\frac{2}{\pi R}}\cos\left(\frac{2ny}{R}\right),$ (14) with the eigenvalues $M_{n}^{2}=4n^{2}/R^{2}$. However, in the $AdS_{5}$ space-time, they have the form111This result is given in many works, like for e.g. [3, 4] and [20]. $\displaystyle\chi^{(n)}(y)$ $\displaystyle=\frac{e^{ky}}{a_{n}}\left[J_{1}\left(\alpha_{n}e^{ky}\right)-b_{n}Y_{1}\left(\alpha_{n}e^{ky}\right)\right],$ (15) $\displaystyle b_{n}$ $\displaystyle=J_{0}\left(\alpha_{n}\right)/Y_{0}\left(\alpha_{n}\right),$ (16) with $\alpha_{n}=M_{n}/k$, and $J_{i}$ and $Y_{i}$ are the $i-th$ order Bessel functions of first and second kind, respectively; and $a_{n}$ is a normalization factor which is computed using (12): $a_{n}^{2}=\left.\frac{e^{2ky}}{2k}\left\\{J_{1}\left(\alpha_{n}e^{ky}\right)-b_{n}Y_{1}\left(\alpha_{n}e^{ky}\right)\right\\}^{2}\right|_{y=0}^{y=\pi R}.$ (17) The eigenvalues $M_{n}$ are determined by imposing the boundary condition $\left.\partial_{5}\chi^{(n)}=0\right|_{y=\pi R}$, which are the zeros of the quantity $Y_{0}\left(\alpha_{n}e^{\pi kR}\right)J_{0}\left(\alpha_{n}\right)-J_{0}\left(\alpha_{n}e^{\pi kR}\right)Y_{0}\left(\alpha_{n}\right).$ (18) These eigenvalues can be obtained numerically. When inserting (11) in (3) and integrating over $y$, we get a 4D Lagrangian $\mathcal{L}_{\mathit{4D}}$ as a function of the Higgs doublet and an infinite number of gauge KK modes. The Higgs doublet is coupled to the KK modes through the parameters $\tau_{i}$. In addition to the quartic couplings between the KK modes, which are characterized by the parameters $\xi_{ijkl}$, there exist also new cubic couplings characterized by $\gamma_{ijk}$. This feature does exist only in non-Abelian theories unlike in the Abelian case [3, 4]. The 4D Lagrangian is given explicitly in the appendix. There are some geometry-independent properties of these parameters, like the invariance under the permutation between each two indices. Also we have the equalities: $\gamma_{ij0}=\xi_{00ij}=\delta_{ij}$. The 4D SM can be recovered by keeping only zero modes in (32), since all the indices of zeroth order in (33) are exactly $1$, whatever the nature of space-time. The physics at the electroweak scale is more sensitive to the first (and maybe the second) KK mode interactions; therefore, we will give in the appendix only the numerical values of the coupling of heavy modes with the first and second KK modes. The existence of the warp factor makes a difference in the masses of the KK modes ($M_{i}$) and their couplings ($\gamma_{ijk}$ and $\xi_{ijkl}$). In what follows, we will investigate the behavior of the sphaleron configuration with respect to these differences. ## 3 Sphaleron Solutions It was shown that the 5D anomaly is independent of the bulk physics; the cancelation of the 4D anomaly is sufficient to eliminate the 5D one in orbifold theories [21]. Then the problem of fermionic current non-conservation can be treated as in a 4D theory. In the case of a 5D fermion coupled to an external gauge potential $A_{M}^{a}(x,y)$ on an $S^{1}/Z_{2}$ orbifold, the divergent current is given by [21] $\partial_{M}\mathbf{J}^{M}(x,y)=\frac{1}{2}[\delta(y)+\delta(y-\pi R)]F^{a\mu\nu}\tilde{F}_{\mu\nu}^{a}/16,$ (19) where $\mathbf{J}^{M}$ is the 5D fermionic current and $\tilde{F}_{\mu\nu}^{a}=\frac{1}{2}\epsilon_{\mu\nu\alpha\beta}F^{a\alpha\beta}$ is the dual field strength. The last term in (19) represents the usual 4D chiral anomaly for a Dirac fermion in an external gauge potential $A_{M}^{a}(x,y)$. Since the fermions in our model are confined in one brane, the expression (19) becomes, after the integration over the fifth coordinate $y$, like the usual 4D formula, $\partial_{\mu}J^{\mu}(x)=F^{a\mu\nu(0)}\tilde{F}_{\mu\nu}^{a(0)}/32,$ (20) where the label $(0)$ means that only zero modes are taken into account [21]; and $J^{\mu}$ is the 4D fermionic current. This means that there is no new contribution to the fermionic currents divergences beside the 4D ones. In our model, the Higgs doublet potential on the brane admits of a minimum, therefore the static energy is bounded from below. In this case, NCS=1/2 represents the so-called sphaleron configuration [14, 15]. Our system has a 5D SU(2) gauge symmetry; it is invariant under the gauge transformation $H\rightarrow UH,~{}i\frac{g}{2}\sigma^{a}A_{M}^{a}\rightarrow i\frac{g}{2}\sigma^{a}A_{M}^{a}+\partial_{M}UU^{{\dagger}},$ (21) where $U$ is a SU(2) element. In the gauge $A_{5}^{a}=0$, the matrix U should be independent of the fifth dimension; and only the zero mode will ensure the SU(2) gauge invariance. This means that the sphaleron configuration can be defined for the system ($H$,$~{}A^{a(0)}$) using the 4D transformation matrix $U(\mu,x)$ [15], $U\left(\mu,x\right)=\left(\begin{array}[c]{cc}e^{i\mu}\left(\cos\mu-i\sin\mu\cos\theta\right)&e^{i\varphi}\sin\mu\sin\theta\\\ -e^{-i\varphi}\sin\mu\sin\theta&e^{-i\mu}\left(\cos\mu+i\sin\mu\cos\theta\right)\end{array}\right);$ (22) but this system ($H$,$~{}A^{a(0)}$) is coupled to the heavy KK modes $A^{a(n\neq 0)}$; this effect will be investigated in this work. The sphaleron configuration can be obtained by making $\mu=\pi/2$. For reasons of simplicity, we will not use the sphaleron configuration [15], but another, equivalent, representation [22]: $H\left(x\right)=\frac{\upsilon}{\sqrt{2}}L\left(r\right)\left(\begin{array}[c]{c}0\\\ 1\end{array}\right),~{}A_{0}^{a}=0,~{}A_{k}^{a}\left(x,y\right)=2\frac{\epsilon_{akj}x_{j}}{gr^{2}}\sum_{i}\left[1-f^{(i)}\left(r\right)\right]\chi^{(i)}\left(y\right).$ (23) Here the heavy modes are represented by a similar form as the zero one in order to make the generalization of the orthogonal gauge $x_{i}A_{i}^{a}=0$ consistent for all the KK modes. Then, when inserting (23) in (9) and (10), we get the differential equations governing the $f^{(i)}(r)$ modes and $L(r)$. The field’s profile functions $L$ and $f^{(i)}$ are given by the solutions of the system $\displaystyle\frac{\partial}{\partial\zeta}\zeta^{2}\frac{\partial}{\partial\zeta}L=2L\sum\limits_{n}\sum\limits_{m}\tau_{n}\tau_{m}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right)+\frac{\lambda}{2g^{2}}\zeta^{2}L\left(L^{2}-1\right),$ (24) $\displaystyle\begin{array}[c]{c}\zeta^{2}\frac{\partial^{2}}{\partial\zeta^{2}}f^{(i)}=-\frac{\zeta^{2}}{4}L^{2}\tau_{i}\sum\limits_{m}\tau_{m}\left(1-f^{(m)}\right)-2\left(1-f^{(i)}\right)-\zeta^{2}\frac{M_{i}^{2}}{g^{2}\upsilon^{2}}\left(1-f^{(i)}\right)+6\sum\limits_{m}\sum\limits_{k}\gamma_{imk}\left(1-f^{(m)}\right)\left(1-f^{(k)}\right)\\\ -4\sum\limits_{m}\sum\limits_{k}\sum\limits_{l}\xi_{imkl}\left(1-f^{(m)}\right)\left(1-f^{(k)}\right)\left(1-f^{(l)}\right),\end{array}$ (27) where $\zeta=g\upsilon r$ is the dimensionless radial coordinate, $M_{i}$ are the KK modes eigenmasses; and the $\tau_{i}$ parameters, $\gamma_{ijk}$ and $\xi_{ijkl}$ are given in the appendix. Here, one needs to mention that the equations (24), (27) and (28) are referring to both cases where the Higgs doublet is localized on the Planck or TeV branes. Here one needs to mention that in the TeV brane case, the Higgs doublet as well the 4D brane parameters needs to be redefined (for e.g. $a(\pi R)H\rightarrow H$) in order to be canonically normalized. The static energy of the system is given by $\begin{array}[c]{c}E=\frac{4\pi\upsilon}{g}\int_{0}^{\infty}d\zeta\left[\frac{\zeta^{2}}{2}\left(\frac{\partial}{\partial\zeta}L\right)^{2}+\frac{\lambda}{g^{2}}\frac{\zeta^{2}}{4}\left(L^{2}-1\right)^{2}+L^{2}\sum\limits_{n}\sum\limits_{m}\tau_{n}\tau_{m}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right)\right.\\\ +4\sum\limits_{n}\left\\{\left(\frac{\partial}{\partial\zeta}f^{(n)}\right)^{2}+\left[\frac{2}{\zeta^{2}}+\frac{M_{n}^{2}}{g^{2}\upsilon^{2}}\right]\left(1-f^{(n)}\right)^{2}\right\\}-\frac{16}{\zeta^{2}}\sum\limits_{n}\sum\limits_{m}\sum\limits_{k}\gamma_{nmk}\gamma_{nmk}\left(1-f^{(m)}\right)\left(1-f^{(k)}\right)\left(1-f^{(n)}\right)\\\ +\left.\frac{8}{\zeta^{2}}\sum\limits_{n}\sum\limits_{m}\sum\limits_{k}\sum\limits_{l}\xi_{nmkl}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right)\left(1-f^{(k)}\right)\left(1-f^{(l)}\right)\right].\end{array}$ (28) When comparing equations (24), (27) and (28) with their corresponding equations in [15]; we find that instead of the gauge profile function $f$, we have a summation over an infinite number of $f^{(i)}$; and also the Higgs- gauge, cubic and quartic gauge-gauge couplings get modified as $\begin{array}[c]{c}L^{2}\left(1-f\right)^{2}\rightarrow\sum\limits_{m}\tau_{n}\tau_{m}L^{2}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right),\\\ \left(1-f\right)^{3}\rightarrow\sum\limits_{m}\sum\limits_{k}\gamma_{nmk}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right)\left(1-f^{(k)}\right),\\\ \left(1-f\right)^{4}\rightarrow\sum\limits_{m}\sum\limits_{k}\sum\limits_{l}\xi_{nmkl}\left(1-f^{(n)}\right)\left(1-f^{(m)}\right)\left(1-f^{(k)}\right)\left(1-f^{(l)}\right),\end{array}$ (29) in addition to the presence of mass terms for non-zero gauge KK modes. Indeed, when neglecting the massive gauge KK modes, the EOM (24) and (27) tend to (11); and (28) tends to (10) in [15]. The convergence of the energy functional (28) implies the following boundary conditions on the profiles functions $L$ and $f^{(i)}$. $\displaystyle\mathit{For}\mathit{~{}}\zeta$ $\displaystyle\rightarrow 0:~{}L\sim\zeta;~{}~{}f^{(0)}\sim\zeta^{2};~{}~{}f^{(i)}\sim 1,$ (30) $\displaystyle\mathit{and}\mathit{~{}}\zeta$ $\displaystyle\rightarrow\infty:~{}L\sim 1;~{}f^{(0)}\sim 1;~{}f^{(i)}\sim 1.$ (31) We use the relaxation method to integrate this system of differential equations. The infinite summations in (24), (27) and (28) over the gauge KK modes are practically impossible analytically as well as numerically. We expect that the contributions of the heavy gauge KK modes ($n\geq 1$) are just corrections to the energy of the system ($H,$ $A^{a(0)}$); we will consider only a finite number $N$ of the KK modes and then examine the variation the energy (28), as well as the profile functions $L$ and $f^{(n)}$ with respect to this number $N$ for both cases of flat and warped geometries, with different values of the warp factor and the first KK mass. ## 4 Numerical Results and Discussion In our computations, we will take the Higgs mass to be around $120$ GeV, i.e., $\lambda\simeq 0.12$. For a rigorous comparison between the flat and warped cases, we fix the mass of the first heavy KK mode, which represents in a way the scale of the new physics beyond SM, and we will consider the values $600$ GeV, $2$ TeV and $10$ TeV. In general, the warp factor $w=e^{\pi kR_{w}}$ value is chosen in a way as to represent the hierarchy between the Planck and TeV scales, i.e. $w\sim 10^{16}$. But since we are interested also to investigate its effect on the sphaleron configuration, we will vary the size of the extra dimension to give it different values for the warp factor: $w=10^{4}$, $10^{8}$ and the desired one, $10^{16}$. Figure 1: The masses of the gauge KK modes for the cases of flat and warped geometry with different values of the warp factor w. In Fig. 1, the masses of KK modes are shown for both flat and warped backgrounds, where the first KK heavy mode mass is chosen to be $1$ TeV. It is clear that the flat modes are just multipliers of the first heavy one, while the existence of the warp factor makes the warped mode masses increasing with respect to the warp factor $w$. For the Higgs-gauge and gauge-gauge couplings, they are given in unit of the SU(2) coupling $g$; by the parameters $\tau$, $\gamma$ and $\xi$. All these parameters are of order $\mathcal{O}(1)$ in the flat geometry. In warped geometry, the situation is different, the $\tau$ parameters; that represent the couplings of the Higgs with gauge KK modes, depend on which boundary the Higgs filed is located in. If the Higgs field is located in the Planck brane, these parameters are negative and their modulus is less than unity and decaying with respect to the KK masses, and also with respect to the warp effect. If the Higgs doublet is located in the TeV brane, the values of the $\tau$ parameters are of the order $\mathcal{O}(1)$ but positive for odd modes and negative for the even ones; and their modules are almost stable with respect to the KK masses. The previous difference between the two cases will not change significantly the profile functions of $L$ and $f^{(i)}$ or the sphaleron energy (28). The difference between the sphaleron energy in both cases is less than $0.004$% for $w=10^{16}$ and $M_{1}=1$ TeV. The $\gamma$ parameters that describe the cubic couplings between the gauge KK modes are also small in the $AdS_{5}$ background and decaying with respect to the KK masses. However, the $\xi$ parameters that represent the quartic couplings between the gauge KK modes are large (for e.g. $\xi_{1,1,1,1}\sim 46$) and decaying with respect to the KK masses but still remaining large (for e.g. $\xi_{30,30,30,30}\sim 27$). Figure 2: The profile functions $L$ (upper curve) and $f^{(0)}$ (lower curve) for the SM case, flat geometry and the warped geometry as a function of the dimensionless radial coordinate $\zeta$. Each profile function is almost identical for the different cases. This plot was performed taking into account the first 10 heavy KK modes for both flat and warped geometries for $M_{1}=1$ TeV and $w=10^{16}$. The profile functions $L$ and $f^{(0)}$ are given in Fig. 2. They are very close to the SM ones to a very high precision for both the cases of flat and warped geometries. This feature does not depend on $N$, the number of the heavy modes taken into account to solve (24) and (27). However, the profile functions of the heavy modes $f^{(i)}$, as shown in Fig. 3, are just deviations from 1; and these deviations decrease with respect to the KK masses. Figure 3: From up to down, here are the profile functions $f^{(i)}$, of the first five heavy modes for the flat geometry case (up) and warped geometry (down) for the same values of $M_{1}$ and $w$ taken in Fig. 2, as a function of the dimensionless radial coordinate $\zeta$. We remark that the profile functions of the heavy modes $f^{(i)}$, are more suppressed in the case of warped geometry than in the flat one. However, the suppression effect decreases if we decrease the warp factor; for, e.g., when taking the warp factor to be $w=10^{4}$ instead of $10^{16}$, the maximum of $f^{(1)}$ (the upper curve in the right side of Fig. 3) increases from $1.00037$ to $1.00075$. This suppression increases also if we increase the first KK mode mass. Due to the fact that the profile functions of $L$ and $f^{(0)}$ practically do not change with respect the SM results, and in addition to the suppression of the heavy modes profile functions, one expects that the sphaleron energy should not be very different from the SM value, but this is not guaranteed due to the infinite number of terms in Eq. (28), as well the increasing KK mass values, unless confirmed numerically. To check this, we compute the sphaleron energy (28) taking into account a finite number $N$ of KK modes for the different values of the first heavy KK mode mass and the warped factor mentioned above. The sphaleron energy dependence on the index $N$ is shown in Fig. 4. Figure 4: The dependence of the sphaleron energy on the number of heavy KK modes that are taken into account to estimate (28); for different values of the first KK mode mass. The first remark on the results in Fig. 4; is that the sphaleron energy does differ significantly from the SM value; its largest deviation is in the case of a small mass of the first KK heavy mode with flat geometry (first plot in Fig. 4), which is $-0.06~{}\%$, i.e. much less than $1~{}\%$. Also, the existence and largeness of the warp factor makes the sphaleron energy practically identical to the SM value. However, this feature is due to the sphaleron configuration itself, i.e. $(H,A_{\mu}^{(0)})$, rather than the decoupling effect of the heavy KK modes, because if we consider an extreme case of a flat geometry with a small mass for the first KK mode (for e.g. $300$ GeV, and then $100$ GeV), the sphaleron energy decreases only by $-0.9~{}\%$ and $-6~{}\%$, respectively. This can be explained by the fact that most of the sphaleron energy is coming from the contributions of the gauge zero mode and the Higgs fields; and the profile functions of these fields are determined by self-interactions as well as interactions with each other rather than their interactions with the heavy KK modes. Then one can say that the heavy KK modes are just compensating fields in the EOM (24) and (27), as in the case of the singlet in the model of SM+singlet [17]. This could explain the fact that the contributions of the KK modes to the sphaleron energy (28) are very small even though their cubic ($\gamma$) and quartic ($\xi$) coupling are (very) large. Indeed, the sphaleron energy (28) is more sensitive to the first KK eigenmass rather than to the couplings $\tau$, $\gamma$ and $\xi$. At finite temperature, we do not expect to have a deviation in sphaleron field’s profile functions as well as in the values of sphaleron energy from the results of the SM [13]; and the B+L anomaly is almost the same as in the standard theory. Then the criterion for a strongly first-order phase transition remains the known one, $\upsilon_{c}/T_{c}\geq 1$ [23]. ## 5 Conclusion In this work, the sphaleron configuration for a Higgs model in a 5D space-time is studied, where the Higgs is confined in a brane and the gauge field resides in the 5D bulk. When we made the KK decomposition of the gauge field, we found that possible interactions (cubic and quartic) between different KK modes are possible due to the non-Abelian nature of the symmetry group unlike the Abelian case [3, 4]. The strength of these interactions depends on the space- time nature. The strength of the interaction with the Higgs doublet depends on where it is located in. We defined the sphaleron configuration in this case, where we got the equations like the SM case, but corrected by the existence of the KK heavy modes. Practically the profile functions of the Higgs and zero mode gauge fields do not change when comparing with the SM results; and the heavy mode profile functions are just little deviations from 1\. The suppression of this deviation from unity is proportional to the KK order. Also the existence of a strong warp factor (like $w=10^{16}$) suppresses these deviations by one order of magnitude. We checked also that the sphaleron energy has the same value as the SM one. The heavy KK modes do not practically contribute to the sphaleron energy; and their presence decreases the value of sphaleron energy by $-0.25\%$ for a light mass of the first KK heavy mode (600 GeV) in a flat geometry. The existence of a warp factor; or the increasing of the mass of the first KK heavy mode, which represents somehow the new physics scale, suppresses the deviation from the SM results. This allows us to suppose that at finite temperature, the previous results should differ from those of the SM. In addition to the fact that the 5D B+L anomaly is identical to the 4D one, the criterion of a strong first-order phase transition, $\upsilon_{c}/T_{c}\geq 1$, is still valid for these models. Acknowledgements: I want to thank Mikko Laine for his useful comments as well for the warm hospitality at Bielefeld University. This work was supported by both the German Academic Exchange Service (DAAD) and the Algerian Ministry of Higher Education and Scientific Research under the cnepru-project D0092007148. ## Appendix A Explicit 4D Lagrangian The 4D theory can be obtained by integrating over the fifth dimension. Here we explicitly give the 4D Lagrangian with its different parameters that describe the couplings of the gauge KK modes with themselves as well as with the Higgs doublet. It is given by $\begin{array}[c]{l}\mathcal{L}_{\mathit{4D}}=\eta^{\mu\nu}\partial_{\mu}H^{{\dagger}}\partial_{\nu}H-V\left(H^{{\dagger}}H\right)-\frac{i}{2}g\eta^{\mu\nu}\left[\partial_{\nu}H^{{\dagger}}\sigma^{a}H-H^{{\dagger}}\sigma^{a}\partial_{\nu}H\right]\sum\limits_{n}\tau_{n}A_{\mu}^{a(n)}+\frac{1}{2}\eta^{\mu\nu}\sum\limits_{n}\sum\limits_{m}(\tau_{n}\tau_{m}\frac{g^{2}}{2}H^{{\dagger}}H\\\ +\delta_{nm}M_{n}^{2})A_{\mu}^{a(n)}A_{\nu}^{a(m)}-\frac{1}{2}\eta^{\mu\nu}\eta^{\alpha\beta}\sum\limits_{n}\left[\partial_{\mu}A_{\alpha}^{a(n)}\partial_{\nu}A_{\beta}^{a(n)}-\partial_{\alpha}A_{\mu}^{a(n)}\partial_{\nu}A_{\beta}^{a(n)}\right]-g\eta^{\mu\nu}\eta^{\alpha\beta}\epsilon^{abc}\sum\limits_{n}\sum\limits_{m}\sum\limits_{k}\gamma_{nmk}\times\\\ A_{\nu}^{b(m)}A_{\beta}^{c(k)}\partial_{\mu}A_{\alpha}^{a(n)}-\frac{g^{2}}{4}\eta^{\mu\nu}\eta^{\alpha\beta}\epsilon^{abc}\epsilon^{ade}\sum\limits_{n}\sum\limits_{m}\sum\limits_{k}\sum\limits_{l}\xi_{nmkl}A_{\mu}^{b(n)}A_{\alpha}^{c(m)}A_{\nu}^{d(k)}A_{\beta}^{e(l)}.\end{array}$ (32) The parameters $\tau_{n}$, $\gamma_{nmk}$ and $\xi_{nmkl}$ are given by $\begin{array}[c]{c}\tau_{n}=\sqrt{\pi R}\int\limits_{0}^{\pi R}\sqrt{G}\mathbf{\Delta}\left(y\right)\chi^{(n)}\left(y\right)dy,~{}\gamma_{nmk}=\sqrt{\pi R}\int\limits_{0}^{\pi R}dy\chi^{(n)}\left(y\right)\chi^{(m)}\left(y\right)\chi^{(k)}\left(y\right),\\\ \xi_{nmkl}=\pi R\int\limits_{0}^{\pi R}dy\chi^{(n)}\left(y\right)\chi^{(m)}\left(y\right)\chi^{(k)}\left(y\right)\chi^{(l)}\left(y\right).\end{array}$ (33) In a flat space-time, these parameters can be reduced to $\begin{array}[c]{l}\tau_{n}=1/\sqrt{2},~{}\gamma_{nmk}=\left\\{\delta_{0,m+k-n}+\delta_{0,m-k-n}+\delta_{0,m-k+n}\right\\}/\sqrt{2},\\\ \xi_{nmkl}=\left\\{\delta_{0,n+m-k-l}+\delta_{0,n+m+k-l}+\delta_{0,n+m-k+l}+\delta_{0,n-m+k+l}+\delta_{0,n-m- k-l}\right.\\\ \left.+\delta_{0,n-m+k-l}+\delta_{0,n-m-k+l}\right\\}/2.\end{array}$ (34) In the $AdS_{5}$ space-time, the formulae of the $\tau_{i}$ parameters are given in both the cases where Higgs field is confined in the Planck (Pl) and TeV branes by $\tau_{n}^{(Pl)}=\sqrt{\pi R}\chi^{(n)}(0),~{}\tau_{n}^{(\mathit{TeV})}=\sqrt{\pi R}\chi^{(n)}(\pi R).$ (35) In the following table, we give the first 10 values of the $\tau_{i}$ parameters for different values of the warp factor. $\tau_{n}^{(Pl)}$ i $w=10^{4}$ $w=10^{8}$ $w=10^{16}$ 1 -0.1955 -0.1352 -0.0945 2 -0.1453 -0.0950 -0.0645 3 -0.1236 -0.0782 -0.0523 4 -0.1107 -0.0683 -0.0453 5 -0.1018 -0.0617 -0.0405 6 -0.0952 -0.0568 -0.0371 7 -0.0900 -0.0530 -0.0344 8 -0.0858 -0.0500 -0.0322 9 -0.0823 -0.0473 -0.0304 10 -0.07936 -0.0452 -0.0289 $\tau_{n}^{(TeV)}$ $w=10^{4}$ $w=10^{8}$ $w=10^{16}$ 2.1549 3.0379 4.2930 -2.1509 -3.0363 -4.2924 2.1495 3.0359 4.2923 -2.1488 -3.0356 -4.2922 2.1484 3.0355 4.2921 -2.1481 -3.0354 -4.2921 2.1479 3.0353 4.2921 -2.1477 -3.0353 -4.2921 2.1475 3.0352 4.2920 -2.1474 -3.0352 -4.2920 Table 1: Different values of the parameters $\tau_{i}$ for different values of the warp factor in both the cases where the Higgs doublet is confined in the Planck brane (left) or TeV brane (right). For the parameters $\gamma$ and $\xi$, it is easy to check that they depend only on the warp factor $w$, and not on the first KK mass $M_{1}$. Their formulae are complicated; and therefore they could be computed numerically. As stated above in section 2, it is important to estimate the couplings of the heavy modes with the zero and first one (and maybe the second one). Here we give the numerical values of$~{}\gamma_{1,1,i}$, which represents the cubic coupling of two one modes with a heavier one ($i\geq 2$), or equivalently, the quartic coupling of a zero mode, two one modes and a heavier one. We give also the value of $\xi_{1,1,1,i}$, which represents the quartic coupling of three one modes and a heavier one, taking the value of the warp factor to be $w=10^{4},~{}10^{8},~{}10^{16}$. $\begin{array}[c]{c}w=10^{4}\\\ \begin{tabular}[c]{|c|c|c||c|c|}\hline\cr i&$\gamma_{1,1,i}$&$\xi_{1,1,1,i}$&$\gamma_{1,2,i}$&$\xi_{1,1,2,i}$\\\ \hline\cr 1&2.9616&10.9652&-1.0925&-5.4800\\\ \hline\cr 2&-1.0925&-5.4800&2.0279&6.6308\\\ \hline\cr 3&0.0253&1.3800&-1.1505&-4.6203\\\ \hline\cr 4&5.78$\times 10^{-4}$&-0.0676&0.0364&1.4808\\\ \hline\cr 5&9.46$\times 10^{-4}$&3.95$\times 10^{-3}$&7.45$\times 10^{-4}$&-0.0895\\\ \hline\cr 6&1.49$\times 10^{-4}$&-2.51$\times 10^{-3}$&1.83$\times 10^{-3}$&6.39$\times 10^{-3}$\\\ \hline\cr 7&1.48$\times 10^{-4}$&2.96$\times 10^{-4}$&2.73$\times 10^{-4}$&-4.23$\times 10^{-3}$\\\ \hline\cr 8&4.32$\times 10^{-5}$&-3.59$\times 10^{-4}$&3.33$\times 10^{-4}$&6.06$\times 10^{-4}$\\\ \hline\cr 9&4.01$\times 10^{-5}$&4.54$\times 10^{-5}$&9.21$\times 10^{-5}$&-6.90$\times 10^{-4}$\\\ \hline\cr 10&1.60$\times 10^{-5}$&-8.83$\times 10^{-5}$&9.86$\times 10^{-5}$&1.12$\times 10^{-4}$\\\ \hline\cr\end{tabular}\\\ w=10^{8}\\\ \begin{tabular}[c]{|c|c|c||c|c|}\hline\cr i&$\gamma_{1,1,i}$&$\xi_{1,1,1,i}$&$\gamma_{1,2,i}$&$\xi_{1,1,2,i}$\\\ \hline\cr 1&4.4339&22.7671&-1.4517&-10.8886\\\ \hline\cr 2&-1.4517&-10.8886&3.0403&13.7351\\\ \hline\cr 3&0.0250&2.4249&-1.5438&-9.2595\\\ \hline\cr 4&-4.39$\times 10^{-4}$&-0.0966&0.0365&2.6336\\\ \hline\cr 5&8.48$\times 10^{-4}$&9.39$\times 10^{-3}$&-1.11$\times 10^{-3}$&-0.1304\\\ \hline\cr 6&5.61$\times 10^{-5}$&-3.62$\times 10^{-3}$&1.68$\times 10^{-3}$&0.0152\\\ \hline\cr 7&1.27$\times 10^{-4}$&7.90$\times 10^{-4}$&6.61$\times 10^{-5}$&-6.29$\times 10^{-3}$\\\ \hline\cr 8&2.41$\times 10^{-5}$&-4.99$\times 10^{-4}$&2.91$\times 10^{-4}$&1.57$\times 10^{-3}$\\\ \hline\cr 9&3.35$\times 10^{-5}$&1.43$\times 10^{-4}$&4.43$\times 10^{-5}$&-1.00$\times 10^{-3}$\\\ \hline\cr 10&1.01$\times 10^{-5}$&-1.18$\times 10^{-4}$&8.39$\times 10^{-5}$&3.23$\times 10^{-4}$\\\ \hline\cr\end{tabular}\\\ w=10^{16}\\\ \begin{tabular}[c]{|c|c|c||c|c|}\hline\cr i&$\gamma_{1,1,i}$&$\xi_{1,1,1,i}$&$\gamma_{1,2,i}$&$\xi_{1,1,2,i}$\\\ \hline\cr 1&6.4532&46.5505&-1.990&-21.6920\\\ \hline\cr 2&-1.9899&-21.6920&4.4233&28.0336\\\ \hline\cr 3&0.0308&4.5373&-2.1258&-18.5267\\\ \hline\cr 4&8.10$\times 10^{-4}$&-0.1620&0.0431&4.9618\\\ \hline\cr 5&2.75$\times 10^{-3}$&0.0193&-1.68$\times 10^{-3}$&-0.2216\\\ \hline\cr 6&1.68$\times 10^{-3}$&-6.44$\times 10^{-3}$&3.00$\times 10^{-3}$&0.0317\\\ \hline\cr 7&1.64$\times 10^{-3}$&1.41$\times 10^{-3}$&1.13$\times 10^{-3}$&-0.0110\\\ \hline\cr 8&1.33$\times 10^{-3}$&-1.09$\times 10^{-3}$&1.36$\times 10^{-3}$&3.11$\times 10^{-3}$\\\ \hline\cr 9&0.0988&2.94$\times 10^{-4}$&-1.82$\times 10^{-5}$&-1.73$\times 10^{-3}$\\\ \hline\cr 10&1.01$\times 10^{-3}$&-3.98$\times 10^{-4}$&5.29$\times 10^{-5}$&7.00$\times 10^{-4}$\\\ \hline\cr\end{tabular}\end{array}$ Table 2: Different values of the cubic ($\gamma_{1,1,i}$ and $\gamma_{1,2,i}$) and quartic ($\xi_{1,1,1,i}$ and $\xi_{1,1,2,i}$) gauge-gauge couplings for $w=10^{4}$, $10^{8}$, $10^{16}$. ## References * [1] I. Antoniadis, Phys. Lett. B246, 377 (1990); N. Arkani-Hamed, S. Dimopoulos and G. Dvali, Phys. Lett. B429, 263 (1998); Phys. Rev. D59, 08004 (1999). * [2] L. Randall and R. Sundrum, Phys. Rev. Lett. 83, 3370 (1999). * [3] H. Davoudiasl, J.L. Hewett and T.G. Rizzo, Phys. Lett. B473, 43 (2000). * [4] A. Pomarol, Phys. Lett. B486, 153 (2000). * [5] W.D. Goldberger and M.B. Wise, Phys. Rev. D60, 107505 (1999); Phys. Rev. Lett. 83, 4922 (1999). * [6] Y. Grossman and M. Neubert, Phys. Lett. B474, 361 (2000). * [7] S. Chang, J. Hisano, H. Nakano, N. Okada and Yamaguchi, Phys. Rev. D62, 084025 (2000). * [8] T. Gherghetta and A. Pomarol, Nucl. Phys. B586, 141 (2000). * [9] V.A. Kuzmin, V.A. Rubakov and M.E. Shaposhnikov, Phys. Lett. B155, 36 (1985). * [10] A.D. Sakharov, JETP Lett. 5, 24 (1967). * [11] G. ’t Hooft, Phys. Rev. Lett. 37, 8 (1976); Phys. Rev. D14, 3432 (1976), Erratum-ibid. D18, 2199 (1978). * [12] D. Bodeker, Phys. Lett. B426, 351 (1998); Nucl. Phys. B559, 502 (1999). * [13] S. Braibant, Y. Brihaye, and J. Kunz, Int. J. Mod. Phys. A8, 5563 (1993). * [14] N.S. Manton, Phys. Rev. D28, 2019 (1983). * [15] F.R. Klinkhamer and N.S. Manton, Phys. Rev. D30, 2212 (1984). * [16] J. Choi, Phys. Lett. B345, 253 (1995). * [17] A. Ahriche, Phys. Rev. D75, 083522 (2007). * [18] J.M. Moreno, D.H. Oaknin, and M. Quiros, Nucl. Phys. B483, 267 (1997). * [19] K. Funakubo, A. Kakuto, S. Tao, and F. Toyoda, Prog. Theor. Phys. 114, 1069 (2005). * [20] S.J. Huber and Q. Shafi, Phys. Rev. D63, 045010 (2001). * [21] N. Arkani-Hamed, A.G. Cohen and H. Georgi, Phys. Lett. B516, 395 (2001). * [22] T. Akiba, H. Kikuchi, and T. Yanagida, Phys. Rev. D38, 1937 (1988); 40, 588 (1989). * [23] M.E. Shaposhnikov, Nucl. Phys. B287, 757 (1987); B299, 797 (1988).
arxiv-papers
2009-04-04T10:26:19
2024-09-04T02:49:01.688358
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Amine Ahriche (U. Jijel, U. Constantine & U. Bielefeld)", "submitter": "Amine Ahriche", "url": "https://arxiv.org/abs/0904.0700" }
0904.0707
# Optimal Multi-Modes Switching Problem in Infinite Horizon Brahim EL ASRI Université du Maine, Département de Mathématiques, Equipe Statistique et Processus, Avenue Olivier Messiaen, 72085 Le Mans, Cedex 9, France. e-mail: brahim.elasri@univ-lemans.fr ###### Abstract This paper studies the problem of the deterministic version of the Verification Theorem for the optimal $m$-states switching in infinite horizon under Markovian framework with arbitrary switching cost functions. The problem is formulated as an extended impulse control problem and solved by means of probabilistic tools such as the Snell envelop of processes and reflected backward stochastic differential equations. A viscosity solutions approach is employed to carry out a fine analysis on the associated system of $m$ variational inequalities with inter-connected obstacles. We show that the vector of value functions of the optimal problem is the unique viscosity solution to the system. This problem is in relation with the valuation of firms in a financial market. AMS Classification subjects: 60G40 ; 62P20 ; 91B99 ; 91B28 ; 35B37 ; 49L25. $\bf Keywords$: Real options; Backward stochastic differential equations; Snell envelope; Stopping times ; Switching; Viscosity solution of PDEs; Variational inequalities. ## 1 Introduction First let us deal with an example in order to introduce the problem we consider in this paper: Assume we have a power station/plant which produces electricity and which has several modes of production, e.g., the lower, the middle and the intensive modes. The price of electricity in the market, given by an adapted stochastic process $(X_{t})_{t\geq 0}$, fluctuates in reaction to many factors such as demand level, weather conditions, unexpected outages and so on. On the other hand, electricity is non-storable, once produced it should be almost immediately consumed. Therefore, as a consequence, the station produces electricity in its instantaneous most profitable mode known that when the plant is in mode $i\in{\cal I}$, the yield per unit time $dt$ is given by means of $\psi_{i}(X_{t})dt$ and, on the other hand, switching the plant from the mode $i$ to the mode $j$ is not free and generates expenditures given by $g_{ij}(X_{t})$ and possibly by other factors in the energy market. The switching from one regime to another one is realized sequentially at random times which are part of the decisions. So the manager of the power plant faces two main issues: $(i)$ when should she decide to switch the production from its current mode to another one? $(ii)$ to which mode the production has to be switched when the decision of switching is made? In other words she faces the issue of finding the optimal strategy of management of the plant. This issue is in relation with the price of the power plant in the energy market. Optimal switching problems for stochastic systems were studied by several authors (see e.g. [1, 2, 3, 4, 9, 10, 11, 12, 13, 17, 20, 23, 24] and the references therein). The motivations are mainly related to decision making in the economic sphere. Several variants of the problem we deal with here, including finite and infinite horizons, have been considered during the recent years. In order to tackle those problems, authors use mainly two approaches. Either a probabilistic one [10, 11, 17] or an approach which uses partial differential inequalities (PDIs for short) [1, 2, 4, 12, 20, 24, 23]. In the finite horizon framework Djehiche et al. have studied the multi-modes switching problem in using probabilistic tools. For general stochastic processes, they have shown that a value of the problem and an optimal strategy exits. The partial differential equation version of this work has been carried out by El-Asri and Hamadène [13]. They showed that when the price process $X_{t}$ is solution of a Markovian standard differential equation, then with this problem is associated a system of variational inequalities with interconnected obstacles for which they provide a solution in viscosity sense. This solution is bind to the value function of the problem. The solution of the system is unique. In the case when the horizon is infinite, there still much to do and this is the novelty of this paper. Actually, authors treat mainly the case when the price process $X_{t}$ is of Markovian Itô type, the switching costs are deterministic functions of time $t$ and the profit functions are deterministic functions of $(t,X_{t})$ and have linear growth at most (see e.g. [1, 2, 12, 20, 24]). Therefore the main objective of this paper is to fill in the gap between finite and infinite horizon by providing a complete treatment of the optimal multiple switching problem in infinite horizon when the price is only a continuous process. This is what we did in the first part of this paper. Actually inspired by the work of Djehiche et al. [11], using probabilistic tools such the Snell envelope of processes and BSDEs we provide a verification theorem which shapes the problem and then we have constructed a solution for this latter. This solution provides an optimal strategy for the switching problem. Later on, in the Markovian framework of randomness, i.e. in the case when $X$ is a solution of a SDE, we show that with the value function of the problem is associated an uplet of deterministic functions $(v^{1},\dots,v^{m})$ which is the unique solution of the following system of partial differential inequalities (PDIs for short): $\left\\{\begin{array}[]{l}\min\\{v_{i}(x)-\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(x)+v_{j}(x)),rv_{i}(x)-{\cal A}v_{i}(x)-\psi_{i}(x)\\}=0\\\ \forall x\in I\\!\\!R^{k},\,\,i\in{\cal I}=\\{1,...,m\\},\end{array}\right.$ (1.1) where $\cal A$ an infinitesimal generator associated with a diffusion process and ${\cal I}^{-i}:=\\{1,...,i-1,i+1,...,m\\}$. This system is the deterministic version of the Verification Theorem of the optimal multi-modes switching problem in infinite horizon. This paper is organized as follows: In Section 2, we formulate the problem and we give the related definitions. In Section 3, we introduce the optimal switching problem under consideration and give its probabilistic Verification Theorem. It is expressed by means of a Snell envelope of processes. Then we introduce the approximating scheme which enables to construct a solution for the Verification Theorem. Moreover we give some properties of that solution, especially the dynamic programming principle. Section 4 is devoted to the connection between the optimal switching problem, the Verification Theorem and the associated system of PDIs. This connection is made through backward stochastic differential equations with one reflecting obstacle in the case when randomness comes from a solution of a standard stochastic differential equation. Further we provide some estimate for the optimal strategy of the switching problem which, in combination with the dynamic programming principle, plays a crucial role in the proof of existence of a solution for (1.1) which we address. In Section 5, we show that the solution of PDIs is unique in the class of continuous functions which satisfy a polynomial growth condition. In Section 6, we give some numerical examples.$\Box$ ## 2 Assumptions and formulation of the problem Throughout this paper $k$ is a fixed integer positive constant. Let us now consider the followings assumption: $\bf H1$: $b:R^{k}\rightarrow I\\!\\!R^{k}$ and $\sigma:I\\!\\!R^{k}\rightarrow I\\!\\!R^{k\times d}$ are two continuous functions for which there exists a constant $C\geq 0$ such that for any $x,x^{\prime}\in I\\!\\!R^{k}$ $|b(x)|+|\sigma(x)|\leq C(1+|x|)\quad\mbox{ and }\quad|\sigma(x)-\sigma(x^{\prime})|+|b(x)-b(x^{\prime})|\leq C|x-x^{\prime}|$ (2.1) $\bf H2$: for $i,j\in{\cal I}=\\{1,...,m\\}$, $g_{ij}:I\\!\\!R^{k}\rightarrow I\\!\\!R$ is a continuous function. Moreover we assume that there exists a constant $\alpha>0$ such that for any $x\in I\\!\\!R^{k}$, $\frac{1}{\alpha}\leq g_{ij}(x)\leq\alpha,\quad\forall i,j\in{\cal I},\quad i\neq j.$ (2.2) $\bf H3$: for $i\in{\cal I}$ $\psi_{i}:I\\!\\!R^{k}\rightarrow I\\!\\!R$ is a continuous function of polynomial growth, $i.e.$, there exist a constant $C$ and $\gamma$ such that for each $i\in\cal I$: $|\psi_{i}(x)|\leq C(1+|x|^{\gamma}),\,\,\forall x\in I\\!\\!R^{k}.$ (2.3) We now consider the following system of $m$ variational inequalities with inter-connected obstacles: $\forall\,\,i\in{\cal I}$ $\begin{array}[]{l}\min\\{v_{i}(x)-\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(x)+v_{j}(x)),rv_{i}(x)-{\cal A}v_{i}(x)-\psi_{i}(x)\\}=0\end{array}.$ (2.4) where ${\cal I}^{-i}:={\cal I}-\\{i\\}$, $r$ is a positive discount factor and ${\cal A}$ is the following infinitesimal generator: ${\cal A}=\frac{1}{2}\sum_{i,j=1,k}(\sigma\sigma^{*})_{ij}(x)\frac{\partial^{2}}{\partial x_{i}\partial x_{j}}+\sum_{i=1,k}b_{i}(x)\frac{\partial}{\partial x_{i}}\,;$ (2.5) hereafter the superscript $(^{*})$ stands for the transpose, $Tr$ is the trace operator and finally $<x,y>$ is the inner product of $x,y\in I\\!\\!R^{k}$. The main objective of this paper is to focus on the existence and uniqueness of the solution in viscosity sense of (2.4) whose definition is: ###### Definition 1 Let $(v_{1},...,v_{m})$ be a $m$-uplet of continuous functions defined on $I\\!\\!R^{k}$, $I\\!\\!R$-valued. The $m$-uplet $(v_{1},...,v_{m})$ is called: * $(i)$ a viscosity supersolution (resp. subsolution) of the system (2.4) if for each fixed $i\in{\cal I}$, for any $x_{0}\in I\\!\\!R^{k}$ and any function $\varphi_{i}\in C^{1,2}(I\\!\\!R^{k})$ such that $\varphi_{i}(x_{0})=v_{i}(x_{0})$ and $x_{0}$ is a local maximum of $\varphi_{i}-v_{i}$ (resp. minimum), we have: $\begin{array}[]{l}\min\left\\{v_{i}(x_{0})-\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(x_{0})+v_{j}(x_{0})),\right.\\\ \qquad\qquad\qquad\left.r\varphi_{i}(x_{0})-{\cal A}\varphi_{i}(x_{0})-\psi_{i}(x_{0})\right\\}\geq 0\quad(\mbox{resp.}\leq 0).\end{array}$ (2.6) * $(ii)$ a viscosity solution if it is both a viscosity supersolution and subsolution. $\Box$ There is an equivalent formulation of this definition (see e.g. [6]) which we give since it will be useful later. So firstly we define the notions of superjet and subjet of a continuous function $v$. ###### Definition 2 Let $v\in C(I\\!\\!R^{k})$, $x$ an element of $I\\!\\!R^{k}$ and finally $S_{k}$ the set of $k\times k$ symmetric matrices. We denote by $J^{2,+}v(x)$ (resp. $J^{2,-}v(x)$), the superjets (resp. the subjets) of $v$ at $x$, the set of pairs $(q,X)\in I\\!\\!R^{k}\times S_{k}$ such that: $\begin{array}[]{c}v(y)\leq v(x)+\langle q,y-x\rangle+\frac{1}{2}\langle X(y-x),y-x\rangle+o(|y-x|^{2})\\\ (resp.\quad v(y)\geq v(x)+\langle q,y-x\rangle+\frac{1}{2}\langle X(y-x),y-x\rangle+o(|y-x|^{2})).\Box\end{array}$ Note that if $\varphi-v$ has a local maximum (resp. minimum) at $x$, then we obviously have: $\left(D_{x}\varphi(x),D^{2}_{xx}\varphi(x)\right)\in J^{2,-}v(x)\,\,\,(\mbox{resp. }J^{2,+}v(x)).\Box$ We now give an equivalent definition of a viscosity solution of the elliptic system with inter-connected obstacles (2.4). ###### Definition 3 Let $(v_{1},...,v_{m})$ be a $m$-uplet of continuous functions defined on $I\\!\\!R^{k}$ and $I\\!\\!R$-valued. The $m$-uplet $(v_{1},...,v_{m})$ is called a viscosity supersolution (resp. subsolution) of (2.4) if for any $i\in{\cal I}$, $x\in I\\!\\!R^{k}$ and $(q,X)\in J^{2,-}v_{i}(t,x)$ (resp. $J^{2,+}v_{i}(x)$), $min\left\\{v_{i}(x)-\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(x)+v_{j}(x)),rv_{i}(x)-\frac{1}{2}Tr[\sigma^{*}X\sigma]-\langle b,q\rangle-\psi_{i}(x)\right\\}\geq 0\,\,(resp.\leq 0).$ It is called a viscosity solution if it is both a viscosity subsolution and supersolution .$\Box$ As pointed out previously we will show that system (2.4) has a unique solution in viscosity sense. This system is the deterministic version of the verification theorem of the optimal $m$-states switching problem in infinite horizon which is well documented in [11] in the case of finite horizon and which we will describe briefly in the next section. ## 3 The optimal $m$-states switching problem ### 3.1 Setting of the problem Let $(\Omega,{\cal F},P)$ be a fixed probability space on which is defined a standard $d$-dimensional Brownian motion $B=(B_{t})_{t\geq 0}$ whose natural filtration is $({\cal F}_{t}^{0}:=\sigma\\{B_{s},s\leq t\\})_{t\geq 0}$. Let ${\bf F}=({\cal F}_{t})_{t\geq 0}$ be the completed filtration of $({\cal F}_{t}^{0})_{t\geq 0}$ with the $P$-null sets of ${\cal F}$, hence $({\cal F}_{t})_{t\geq 0}$ satisfies the usual conditions, $i.e.$, it is right continuous and complete. Furthermore, let: \- ${\cal P}$ be the $\sigma$-algebra on $[0,+\infty)\times\Omega$ of ${\bf F}$-progressively measurable sets; \- ${\cal M}^{2,k}$ be the set of $\cal P$-measurable and $I\\!\\!R^{k}$-valued processes $w=(w_{t})_{t\geq 0}$ such that $E[\int_{0}^{+\infty}|w_{s}|^{2}ds]<\infty$ and ${\cal S}^{2}$ be the set of $\cal P$-measurable, continuous processes ${w}=({w}_{t})_{t\geq 0}$ such that $E[\sup_{t\geq 0}|{w}_{t}|^{2}]<\infty$; \- for any stopping time $\tau\in I\\!\\!R^{+}$, ${\cal T}_{\tau}$ denotes the set of all stopping times $\theta$ such that $\tau\leq\theta;$ \- for any stopping time $\tau$, ${\cal F}_{\tau}$ is the $\sigma$-algebra on $\Omega$ which contains the sets $A$ of $\cal{F}$ such that $A\cap\\{\tau\leq t\\}\in{\cal F}_{t}$ for every $t\geq 0$. $\Box$ A decision (strategy) of the problem of multiple switching, on the one hand, consists of the choice of a sequence of nondecreasing stopping times $(\tau_{n})_{n\geq 1}$ $(i.e.\tau_{n}\leq\tau_{n+1}$) where the manager decides to switch the activity from its current mode to another one. On the other hand, it consists of the choice of the mode $\xi_{n}$, a r.v. ${\cal F}_{\tau_{n}}$-measurable with values in ${\cal I}$, to which the production is switched at $\tau_{n}$. Therefore the admissible management strategies are the pairs $(\delta,\xi):=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 1})$ and we denote by $\cal D$ the set of these strategies. Let now $X:=(X_{t})_{t\geq 0}$ be an $\cal P$-measurable, $I\\!\\!R^{k}$-valued continuous stochastic process which stands for the market price of $k$ factors which determine the market price of the commodity. On the other hand, assuming that the production activity is in mode 1 at the initial time $t=0$, let $(u_{t})_{t\geq 0}$ denote the indicator of the production activity’s mode at time $t\in I\\!\\!R^{+}$ : $u_{t}=1\\!\\!1_{[0,\tau_{1}]}(t)+\sum_{n\geq 1}\xi_{n}1\\!\\!1_{(\tau_{n},\tau_{n+1}]}(t).$ (3.1) Then for any $t\geq 0$, the state of the whole economic system related to the project at time $t$ is given by the vector: $\begin{array}[]{ll}(t,X_{t},u_{t})\in I\\!\\!R^{+}\times I\\!\\!R^{k}\times{\cal I}.\end{array}$ (3.2) Finally, let $\psi_{i}(X_{t})$ be the instantaneous profit when the system is in state $(t,X_{t},i)$, and for $i,j\in{\cal I}\quad i\neq j$, let $g_{ij}(X_{t})$ denote the switching cost of the production at time $t$ from the current mode $i$ to another mode $j$. When the plant is run under the strategy $(\delta,\xi)=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 1})$ the expected total profit is given by: $\begin{array}[]{l}J(\delta,\xi)=E[\displaystyle\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s})ds-\sum_{n\geq 1}e^{-r\tau_{n}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X_{\tau_{n}})].\end{array}$ Then the problem we are interested in is to find an optimal strategy, $i.e$, a strategy $(\delta^{*},\xi^{*})$ such that $J(\delta^{*},\xi^{*})\geq J(\delta,\xi)$ for any $(\delta,\xi)\in\cal D$. Note that in order that the quantity $J(\delta,\xi)$ makes sense we assume throughout this paper that for any $i\in{\cal I}$ the processes $(e^{-rt}\psi_{i}(X_{t}))_{t\geq 0}$ belong to ${\cal M}^{2,1}$. On the other hand there is a bijective correspondence between the pairs $(\delta,\xi)$ and the pairs $(\delta,u)$. Then throughout this paper one refers indifferently to $(\delta,\xi)$ or $(\delta,u)$. ### 3.2 The Verification Theorem To tackle the problem described above in the finite horizon case, Djehiche et al. [11] have introduced a Verification Theorem which is expressed by means of Snell envelope of processes which we describe briefly now. The Snell envelope of a stochastic process $(\eta_{t})_{t\geq 0}$ of ${\cal S}^{2}$ (with a possible positive jump at $+\infty$ and $\lim\limits_{t\rightarrow\infty}\eta_{t}=M\in L^{2}(\Omega,{\cal F},P)$) is the lowest supermartingale $R(\eta):=(R(\eta)_{t})_{t\geq 0}$ of ${\cal S}^{2}$ such that for any $t\geq 0$, $R(\eta)_{t}\geq\eta_{t}$. It has the following expression: $\forall t\geq 0,R(\eta)_{t}=esssup_{\tau\in{\cal T}_{t}}E[\eta_{\tau}|{\bf F}_{t}]\quad\mbox{(then it satisfies }\lim\limits_{t\rightarrow+\infty}R(\eta)_{t}=M.)$ For more details on the Snell envelope notion on can see e.g. [7, 14, 16]. The Verification Theorem for the $m$-states optimal switching problem in infinite horizon is the following: ###### Theorem 1 . Assume that there exist $m$ processes $(Y^{i}:=(Y^{i}_{t})_{t\geq 0},i=1,...,m)$ of ${\cal S}^{2}$ such that: $\begin{array}[]{l}\forall t\geq 0,\,\,e^{-rt}Y^{i}_{t}=\mbox{ess sup}_{\tau\geq t}E[\int_{t}^{\tau}e^{-rs}\psi_{i}(X_{s})ds+e^{-r\tau}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{\tau})+Y^{j}_{\tau})|{\cal F}_{t}],\quad\lim\limits_{t\rightarrow+\infty}(e^{-rt}Y^{i}_{t})=0.\end{array}$ (3.3) Then: * $(i)$ $Y^{1}_{0}=\sup\limits_{(\delta,\xi)\in{\cal D}}J(\delta,u).$ * $(ii)$ Define the sequence of ${\bf F}$-stopping times $\delta^{*}=(\tau_{n}^{*})_{n\geq 1}$ as follows : $\begin{array}[]{lll}\tau^{*}_{1}&=&\inf\\{s\geq 0,\quad Y1_{s}=\max\limits_{j\in{{\cal I}^{-1}}}(-g_{1j}(X_{s})+Y^{j}_{s})\\},\\\ \tau^{*}_{n}&=&\inf\\{s\geq\tau^{*}_{n-1},\quad Y^{u_{\tau^{*}_{n-1}}}_{s}=\max\limits_{k\in{\cal I}\backslash\\{u_{\tau^{*}_{n-1}}\\}}(-g_{u_{\tau^{*}_{n-1}}k}(X_{s})+Y^{k}_{s})\\},\quad\mbox{for}\quad n\geq 2,\end{array}$ where: * $\bullet$ $u_{\tau^{*}_{1}}=\sum\limits_{j\in{\cal I}}j1\\!\\!1_{\\{\max\limits_{k\in{\cal I}^{-1}}(-g_{1k}(X_{\tau^{*}_{1}})+Y^{k}_{\tau^{*}_{1}})=-g_{1j}(X_{\tau^{*}_{1}})+Y^{j}_{\tau^{*}_{1}}\\}};$ * $\bullet$ for any $n\geq 1$ and $t\geq\tau^{*}_{n},$ $Y^{u_{\tau^{*}_{n}}}_{t}=\sum\limits_{j\in{\cal I}}1\\!\\!1_{[u_{\tau^{*}_{n}}=j]}Y^{j}_{t}$ * $\bullet$ for any $n\geq 2,\,\,u_{\tau^{*}_{n}}=l$ on the set $\left\\{\max\limits_{k\in{\cal I}\backslash\\{{u_{\tau^{*}_{n-1}}}\\}}(-g_{u_{\tau^{*}_{n-1}}k}(X_{\tau^{*}_{n}})+Y^{k}_{\tau^{*}_{n}})=-g_{u_{\tau^{*}_{n-1}l}}(X_{\tau^{*}_{n}})+Y^{l}_{\tau^{*}_{n}}\right\\}$ with $g_{u_{\tau^{*}_{n-1}k}}(X_{\tau^{*}_{n}})=\sum\limits_{j\in{\cal I}}1\\!\\!1_{[u_{\tau^{*}_{n-1}}=j]}g_{jk}(X_{\tau^{*}_{n}})$ and ${\cal I}\backslash\\{u_{\tau^{*}_{n-1}}\\}=\sum\limits_{j\in{\cal I}}1\\!\\!1_{[u_{\tau^{*}_{n-1}}=j]}{\cal I}^{-j}$. Then the strategy $(\delta^{*},u^{*})$ satisfies $E[\sum_{n\geq 0}e^{-r\tau^{*}_{n}}]<+\infty$ and it is optimal i.e. $J(\delta^{*},u^{*})\geq J(\delta,u)$ for any $(\delta,u)\in\cal D$. $\Box$ Proof. The arguments of this proof are standard, based on the properties the Snell envelope. We defer the proof in the Appendix.$\Box$ The issue of existence of the processes $Y^{1},...,Y^{m}$ which satisfy (3.3) is also addressed in [11]. For $n\geq 0$ let us define the processes $(Y^{n,1},...,Y^{n,m})$ recursively as follows: for $i\in{\cal I}$ we set, $e^{-rt}Y^{0,i}_{t}=E[\displaystyle\int_{t}^{+\infty}e^{-rs}\psi_{i}(X_{s})ds|{\cal F}_{t}],\,\,t\geq 0,$ (3.4) and for $n\geq 1$, $e^{-rt}Y^{n,i}_{t}=\mbox{ess sup}_{\tau\geq t}E[\displaystyle\int_{t}^{\tau}e^{-rs}\psi_{i}(X_{s})ds+e^{-r\tau}\max\limits_{k\in{\cal I}^{-i}}(-g_{ik}(X_{\tau})+Y^{n-1,k}_{\tau})|{\cal F}_{t}],\,\,t\geq 0.$ (3.5) Then the sequence of processes $((Y^{n,1},...,Y^{n,m}))_{n\geq 0}$ have the following properties: ###### Proposition 1 ([11], Pro.3 and Th.2) * $(i)$ for any $i\in{\cal I}$ and $n\geq 0$, the processes $Y^{n,1},...,Y^{n,m}$ are well-posed, continuous and belong to ${\cal S}^{2}$, and verify $\forall t\geq 0,\,\,e^{-rt}Y^{n,i}_{t}\leq e^{-rt}Y^{n+1,i}_{t}\leq E[\int_{t}^{+\infty}e^{-rs}\\{\max_{i=1,m}|\psi_{i}(X_{s})|\\}ds|{\cal F}_{t}];$ (3.6) * $(ii)$ there exist $m$ processes $Y^{1},...,Y^{m}$ of ${\cal S}^{2}$ such that for any $i\in{\cal I}$: * $(a)$ $\forall t\geq 0$, $Y^{i}_{t}=\lim_{n\rightarrow\infty}\nearrow Y^{n,i}_{t}$ * $(b)$ $\forall t\geq 0$, $e^{-rt}{Y}^{i}_{t}=\mbox{ess sup}_{\tau\geq t}E[\displaystyle\int_{t}^{\tau}e^{-rs}\psi_{i}(X_{s})ds+e^{-r\tau}\max\limits_{k\in{\cal I}^{-i}}(-g_{ik}(X_{\tau})+{Y}^{k}_{\tau})|{\cal F}_{t}]$ (3.7) i.e. ${Y}^{1},...,{Y}^{m}$ satisfy the Verification Theorem 1 ; * $(c)$ $\forall t\geq 0$, $e^{-rt}{Y}^{i}_{t}=esssup_{(\delta,\xi)\in{\cal D}^{i}_{t}}E[\displaystyle\int_{t}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s})ds-\sum_{n\geq 1}e^{-r\tau_{n}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X_{\tau_{n}})|{\cal F}_{t}]$ (3.8) where ${\cal D}^{i}_{t}=\\{(\delta,\xi)=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 1})\mbox{ such that }u_{0}=i\mbox{ and }\tau_{1}\geq t\\}$. This characterization means that if at time $t$ the production activity is in its regime $i$ then the optimal expected profit is $Y^{i}_{t}$. * $(d)$ the processes $Y^{1},...,Y^{m}$ verify the dynamical programming principle of the $m$-states optimal switching problem, $i.e.$, $\forall t\leq T$, $\\!\\!\\!\\!\\!\begin{array}[]{ll}e^{-rt}Y^{i}_{t}&=\mbox{ess sup}_{(\delta,u)\in{\cal D}_{t}^{i}}E[\displaystyle\int_{t}^{\tau_{n}}e^{-rs}\psi_{u_{s}}(X_{s})ds-\sum_{1\leq k\leq n}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{{\tau_{k}}}}(X_{{\tau}_{k}})+e^{-r\tau_{n}}Y^{u_{\tau_{n}}}_{\tau_{n}}|{\cal F}_{t}].\Box\end{array}$ (3.9) Note that except $(ii-d)$, the proofs of the other points are the same as in [11] in the framework of finite horizon. The proof of $(ii-d)$ can be easily deduced in using relation (3.7). Actually from (3.7) for any $i\in{\cal I}$, $t\geq 0$ and $(\delta,\xi)\in{\cal D}^{i}_{t}$ we have: $e^{-rt}Y^{i}_{t}\geq E[\displaystyle\int_{t}^{\tau_{n}}e^{-rs}\psi_{u_{s}}(X_{s})ds-\sum_{1\leq k\leq n}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{u_{\tau_{k}}}}(X_{{\tau}_{k}})+e^{-r\tau_{n}}Y^{u_{\tau_{n}}}_{\tau_{n}}|{\cal F}_{t}].$ (3.10) Next using the optimal strategy we obtain the equality instead of inequality in (3.10). Therefore the relation (3.9) holds true. $\Box$ ###### Remark 1 The characterization (3.8) implies that the processes $Y^{1},...,Y^{m}$ of ${\cal S}^{2}$ which satisfy the Verification Theorem are unique. ## 4 Existence of a solution for the system of variational inequalities ### 4.1 Connection with BSDEs with one reflecting barrier Let $x\in I\\!\\!R^{k}$ and let $X^{x}$ be the solution of the following standard SDE: $dX_{t}^{x}=b(X^{x}_{t})dt+\sigma(X^{x}_{t})dB_{t},\quad X^{x}_{0}=x$ (4.1) where the functions $b$ and $\sigma$ are the ones of $\bf H1$. These properties of $\sigma$ and $b$ imply in particular that $X^{x}$ solution of the standard SDE (4.1) exists and is unique in $I\\!\\!R^{k}$. The operator $\cal A$ defined in (2.5) is the infinitesimal generator associated with $X^{x}$. In the following result we collect some properties of $X^{x}$. ###### Proposition 2 (see e.g. [22]) The process $X^{x}$ satisfies the following estimates: * $(i)$ For any $q\geq 2$ there exists $C_{q}$ such that, $E[|X^{x}_{t}|^{q}]\leq C_{q}e^{C_{q}t}(1+|x|^{q})\quad\forall t\geq 0.$ (4.2) * $(ii)$ There exists a constant $C$ such that for any $x,x^{\prime}\in I\\!\\!R^{k}$ and $T\geq 0$, $E[\sup\limits_{0\leq s\leq T}|X^{x}_{s}-X^{x^{\prime}}_{s}|^{2}]\leq Ce^{CT}|x-x^{\prime}|^{2}.\Box$ (4.3) In the sequel we consider the following condition: $\bf H4$: Assume $\gamma\geq 2$ and $-r+C_{\gamma}<0,$ (4.4) where $\gamma$ is the growth exponent of the functions $\psi_{i}$ and $C_{\gamma}$ is the constant in (4.2). $\Box$ ###### Remark 2 : If $\gamma<2$, there exists a constant $\gamma_{1}\geq 2$ such that $\gamma_{1}$ verifies the growth exponent of the functions $\psi_{i}$. We are going now to introduce the notion of a BSDE with one reflecting barrier considered in [19]. This notion will allow us to make the connection between the variational inequalities system (2.4) and the $m$-states optimal switching problem described in the previous section. Let us introduce the pair of process $(Y^{x},Z^{x})\in{\cal S}^{2}\times{\cal M}^{2,d}$ solution of the following BSDE: $Y^{x}_{s}=Y_{T}^{x}+\int_{s}^{T}F(X_{l}^{x},Y_{l}^{x},Z_{l}^{x})dl-\int_{s}^{T}Z^{x}_{l}dB_{l},\quad\mbox{for all}\quad T\geq 0\quad\mbox{and}\quad t\leq T,$ (4.5) where $F:I\\!\\!R^{k}\times I\\!\\!R\times I\\!\\!R^{d}\rightarrow I\\!\\!R$ is continuous and satisfies: there exist a continuous increasing function $\phi:I\\!\\!R^{+}\rightarrow I\\!\\!R^{+}$ and constant $K$, $K^{\prime}$, $\mu<0$, $p>0$ such that, $\begin{array}[]{lll}|F(x,y,z)|\leq K^{\prime}(1+|x|^{p}+\phi(|y|)+|z|),\\\ \langle y-y^{\prime},F(x,y,z)-F(x,y^{\prime},z)\rangle\leq\mu|y-y^{\prime}|^{2},\\\ |F(x,y,z)-F(x,y,z^{\prime})|\leq K||z-z^{\prime}||.\end{array}$ (4.6) We assume moreover that for some $\lambda>2\mu+K2,$ $E[\int_{0}^{+\infty}e^{\lambda s}|F(X_{s}^{x},0,0)|^{2}ds]<+\infty,$ (4.7) which essentially implies that $\lambda+C_{2\gamma}<0$. Let us consider the following semilinear elliptic PDE in $I\\!\\!R^{k}$: ${\cal A}u(x)+F(x,u(x),\sigma(x)^{*}\nabla u(x))=0,\quad x\in I\\!\\!R^{k}.$ (4.8) Then we have the following result: ###### Theorem 2 ([21], Th. 5.2) Under the above assumptions, $u(x)=Y^{x}_{0}$ is a continuous function and it is a viscosity solution of (4.8) which satisfies, $|Y^{x}_{0}|\leq C\sqrt{E[\int_{0}^{+\infty}e^{\lambda s}|F(X_{s}^{x},0,0)|^{2}ds}],$ (4.9) for any $\lambda>2\mu+K2.$$\Box$ Let us now introduce the following functions: * $(i)$ $f:I\\!\\!R^{k}\rightarrow I\\!\\!R$ is continuous and of polynomial growth, $i.e.$, there exist some positive constants $C$ and $\gamma$ such that: $|f(x)|\leq C(1+|x|^{\gamma}),\,\,\forall x\in I\\!\\!R^{k}.$ (4.10) * $(ii)$ $h:I\\!\\!R^{k}\rightarrow I\\!\\!R$ is continuous and bounded. Then we have the following result related to BSDEs with one reflecting barrier: ###### Theorem 3 For any $x\in I\\!\\!R^{k}$, there exits a unique triple of processes $(Y^{x},Z^{x},K^{x})$ such that: $\left\\{\begin{array}[]{l}Y^{x},K^{x}\in{\cal S}^{2}\mbox{ and }Z^{x}\in{\cal M}^{2,d};\,K^{x}\mbox{ is non-decreasing and }K^{x}_{0}=0,\\\ e^{-rs}Y^{x}_{s}=\int_{s}^{+\infty}e^{-rl}f(X_{l}^{x})dl-\int_{s}^{+\infty}Z^{x}_{l}dB_{l}+K_{+\infty}^{x}-K^{x}_{s},\\\ e^{-rs}Y^{x}_{s}\geq e^{-rs}h(X^{x}_{s}),\,\forall s\geq 0\mbox{ and }\int_{0}^{+\infty}(e^{-rl}Y^{x}_{l}-e^{-rl}h(X^{x}_{l}))dK^{x}_{l}=0.\end{array}\right.$ (4.11) Moreover the following characterization of $Y^{x}$ as a Snell envelope holds true: $\forall s\geq 0,\,\,e^{-rs}Y^{x}_{s}=esssup_{\tau\in{\cal T}_{s}}E[\int_{s}^{\tau}e^{-rl}f(X_{l}^{x})dl+e^{-r\tau}h(X^{x}_{\tau})|{\cal F}_{s}].$ (4.12) On the other hand there exists a deterministic continuous with polynomial growth function $u:I\\!\\!R^{k}\rightarrow I\\!\\!R$ such that: $\forall x\in I\\!\\!R^{k}\quad Y^{x}_{0}=u(x).$ Moreover the function $u$ is the viscosity solution in the class of continuous function with polynomial growth of the following PDE with obstacle: $\begin{array}[]{l}\min\\{u(x)-h(x),ru(x)-{\cal A}u(x)-f(x)\\}=0.\end{array}$ (4.13) $Proof$: Existence and uniqueness of the triple $(Y^{x}_{t},Z^{x}_{t},K^{x}_{t})_{t\geq 0}$ of (4.11) follow from Theorem 3.2 in [19]. Now we consider the infinite horizon BSDE: $^{n}Y^{x}_{s}e^{-rs}=\int_{s}^{+\infty}e^{-rl}f(X_{l}^{x})dl-\int_{s}^{+\infty}Z^{n,x}_{l}dB_{l}+\int_{s}^{+\infty}ne^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-}dl.$ (4.14) From Theorem 1 in [5] there exists a unique solution $(^{n}Y^{x},Z^{n,x})\in{\cal S}^{2}\times{\cal M}^{2,d}$ satisfying the BSDE (4.14). Next let us define $K^{n,x}_{s}=\int_{0}^{s}ne^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-}dl,$ then $\begin{array}[]{ll}\int_{0}^{+\infty}e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l})\wedge^{n}Y^{x}_{l})dK_{l}^{n,x}&=n\int_{0}^{+\infty}e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l})\wedge^{n}Y^{x}_{l})e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-}dl\\\ &=0.\end{array}$ Since $K^{n,x}$ is non-decreasing and $K^{n,x}_{0}=0$, we rewrite Eq. (4.14) in RBSDE form $\left\\{\begin{array}[]{l}{}^{n}Y^{x}_{s}e^{-rs}=\int_{s}^{+\infty}e^{-rl}f(X_{l}^{x})dl-\int_{s}^{+\infty}Z^{n,x}_{l}dB_{l}+K_{\infty}^{n,x}-K^{n,x}_{s},\\\ {}^{n}Y^{x}_{s}e^{-rs}\geq e^{-rs}(h(X^{x}_{s})\wedge^{n}Y^{x}_{s}),\,\forall s\geq 0\mbox{ and }\int_{0}^{+\infty}e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l})\wedge^{n}Y^{x}_{l})dK^{x}_{l}=0.\end{array}\right.$ (4.15) Then from property (4.12) we have: $^{n}Y^{x}_{s}e^{-rs}=esssup_{\tau\in{\cal T}_{s}}E[\int_{s}^{\tau}e^{-rl}f(X_{l}^{x})dl+e^{-r\tau}(^{n}Y^{x}_{\tau}\wedge h(X^{x}_{\tau}))|{\cal F}_{s}].$ (4.16) Note that if we define $f_{n}(t,x,y,z)=e^{-rt}f(x,y,z)+ne^{-rt}(y-h(x))^{-}$ $f_{n}(t,x,y,z)\leq f_{n+1}(t,x,y,z).$ Then it follows from the comparison Theorem 2.2 in [19] ${}^{n}Y_{s}^{x}e^{-rs}\leq^{n+1}Y_{s}^{x}e^{-rs},$ $s\geq 0,$ a.s. and from (4.12) and (4.16) ${}^{n}Y_{s}^{x}e^{-rs}\leq Y_{s}^{x}e^{-rs}.$ This implies that there exits a càdlàg process $(\widetilde{Y}^{x}_{s})_{s\geq 0}$ such that $P-a.s$. for any $s\geq 0$, ${}^{n}Y_{s}^{x}e^{-rs}\uparrow e^{-rs}\widetilde{Y}_{s}^{x},\quad\quad a.s.$ Let us actually show that $\tilde{Y}^{x}$ is càdlàg . By (4.16), for any $n\geq 1$, the process $(^{n}Y^{x}_{t}+\int_{0}^{t}e^{-rs}f(X_{s}^{x})ds)_{t\geq 0}$ is an ${\bf F}$-supermartingale which converges increasingly and pointwisely to $(\widetilde{Y}^{x}_{t}+\int_{0}^{t}e^{-rs}f(X_{s}^{x})ds)_{t\geq 0}$. Therefore, the limit is also a càdlàg ${\bf F}$-supermartingale (see e.g. Dellacherie and Meyer (1980), pp. 86). Hence, the process $\tilde{Y}^{x}$ is càdlàg . Then it follows from Proposition 2 in [11], as $n\rightarrow+\infty$, $\widetilde{Y}^{x}_{s}e^{-rs}=esssup_{\tau\in{\cal T}_{s}}E[\int_{s}^{\tau}e^{-rl}f(X_{l}^{x})dl+e^{-r\tau}(\widetilde{Y}^{x}_{\tau}\wedge h(X^{x}_{\tau}))|{\cal F}_{s}].$ (4.17) From(4.14) we have: $\begin{array}[]{ll}E[\int_{s}^{+\infty}e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-}dl]&=\frac{1}{n}E[^{n}Y^{x}_{s}e^{-rs}+\int_{s}^{+\infty}e^{-rl}f(X_{l}^{x})dl]\\\ &\leq\frac{1}{n}E[|Y^{x}_{s}e^{-rs}|+\int_{s}^{+\infty}|e^{-rl}f(X_{l}^{x})|dl]\\\ &\leq\frac{1}{n}(E[|Y^{x}_{s}e^{-rs}|]+C\int_{s}^{+\infty}e^{-rl}e^{C_{\gamma}l}|x|^{\gamma}dl)\end{array}$ for a constant $C$ independent of $n$ and $\bf H4$. Then $E[\int_{s}^{+\infty}e^{-rl}(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-}dl]\leq\frac{C_{x}}{n}.$ Hence as $n\rightarrow+\infty$ we obtain, $E[\int_{s}^{+\infty}e^{-rl}(\widetilde{Y}^{x}_{l}-h(X^{x}_{l}))^{-}dl]=0$, and since $(\widetilde{Y}^{x}_{s})_{s\geq 0}$ (resp. $h(x)$) is a càdlàg process (resp. continuous), we have $\widetilde{Y}^{x}_{t}\geq h(X^{x}_{t}).$ (4.18) From (4.12), (4.17) and (4.18) we get: $\widetilde{Y}^{x}_{t}=Y^{x}_{t}\quad\forall t\geq 0.$ Now rewrite Eq. (4.14) in differential form $\begin{array}[]{l}d(^{n}Y^{x}_{s}e^{-rs})=-[e^{-rs}f(X_{s}^{x})+ne^{-rs}(^{n}Y^{x}_{s}-h(X^{x}_{s}))^{-}]ds+Z^{n,x}_{s}dB_{s}.\\\ \end{array}$ So for arbitrary $T>0$ and $0\leq s\leq T$, Eq. (4.14) is equivalent to $\begin{array}[]{l}{}^{n}Y^{x}_{s}=^{n}Y^{x}_{T}+\int_{s}^{T}[(f(X_{l}^{x})+n(^{n}Y^{x}_{l}-h(X^{x}_{l}))^{-})-r^{n}Y^{x}_{l}]dl-\int_{s}^{T}\widetilde{Z}^{n,x}_{l}dB_{l},\\\ \end{array}$ (4.19) with $\widetilde{Z}^{n,x}_{s}=Z^{n,x}_{s}e^{rs}$. Let us set $F_{n}(x,y,z)=f(x)+n(y-h(x))^{-})-ry$. In order that it satisfies the assumptions of Theorem 2, we just need to verify that $F_{n}$ satisfy condition (4.6) and (4.7). It is obvious that $F_{n}$ satisfy (4.6) where $\mu>-r$, and we show that $F_{n}$ satisfy (4.7). From the polynomial growth of $f$ and since $h$ bounded and estimate (4.2), we deduce $\begin{array}[]{lll}E[\int_{0}^{+\infty}e^{\lambda s}|F_{n}(X_{s}^{x},0,0)|^{2}ds]&=E[\int_{0}^{+\infty}e^{\lambda s}|f(X_{s}^{x})+n(-h(X_{s}^{x}))^{-}|^{2}ds]\\\ &\leq 2E[\int_{0}^{+\infty}e^{\lambda s}((1+|X_{s}^{x}|^{\gamma})2+n^{2}C2)ds]\\\ &\leq C\int_{0}^{+\infty}e^{\lambda s}e^{C_{2\gamma}s}(|x|^{2\gamma}+n2)ds,\end{array}$ for $\lambda+C_{2\gamma}<0$. This proves assumption (4.7). Then $u_{n}(x)=^{n}Y^{x}_{0},$ and is a viscosity solution of the elliptic PDE ${\cal A}u_{n}(x)+F_{n}(x,u_{n}(x),\sigma(x)^{*}\nabla u_{n}(x))=0.$ We now define $u(x)=Y^{x}_{0},\quad\forall x\in I\\!\\!R^{k},$ which is a deterministic quantity. Let us admit for a moment the following Lemma: ###### Lemma 1 The function $u$ is continuous in $R^{k}$.$\Box$ From the previous results we have, for each $x\in I\\!\\!R^{k},$ $u_{n}(x)\uparrow u(x)\quad\mbox{as}\quad n\rightarrow+\infty.$ Since $u_{n}$ and $u$ are continuous, it follow from Dini’s theorem that the above convergence is uniform on compacts. We now show that $u$ is a subsolution of (4.13). Let $x$ be a point at which $u(x)>h(x),$ and let $(q,X)\in J^{2,+}u(x).$ From Lemma 6.1 in [6], there exists sequences: $\begin{array}[]{l}n_{j}\rightarrow+\infty,\quad x_{j}\rightarrow x,\quad(q_{j},X_{j})\in J^{2,+}u_{n_{j}}(x_{j}),\end{array}$ such that $(q_{j},X_{j})\rightarrow(q,X).$ But for any $j$, $\begin{array}[]{ll}-\frac{1}{2}Tr[\sigma^{*}X_{j}\sigma]-\langle b,q_{j}\rangle-F_{n}(x_{j},u_{n_{j}}(x_{j}),\sigma(x_{j})^{*}\nabla u_{n_{j}}(x_{j}))\leq 0,\\\ -\frac{1}{2}Tr[\sigma^{*}X_{j}\sigma]-\langle b,q_{j}\rangle-f(x_{j})-n_{j}(u_{n_{j}}(x_{j})-h(x_{j}))^{-})+ru_{n_{j}}(x_{j})\leq 0.\end{array}$ From the assumption that $u(x)>h(x)$ and the uniform convergence of $u_{n},$ it follows that for $j$ large enough $u_{n_{j}}(x_{j})>h(x_{j})$. Hence, taking the limit as $j\rightarrow+\infty$ in the above inequality yields: $-\frac{1}{2}Tr[\sigma^{*}X\sigma]-\langle b,q\rangle-f(x)+ru(x)\leq 0,$ and we have proved that $u$ is a subsolution of (4.13). We now show that $u$ is a supersolution of (4.13). Let $x$ be arbitrary in $I\\!\\!R^{k}$, and $(q,X)\in J^{2,-}u(x).$ We already know that $u(x)\geq h(x).$ By the same argument as above, there exist sequences: $\begin{array}[]{l}n_{j}\rightarrow+\infty,\quad x_{j}\rightarrow x,\quad(q_{j},X_{j})\in J^{2,-}u_{n_{j}}(x_{j}),\end{array}$ such that $(q_{j},X_{j})\rightarrow(q,X).$ But for any $j$, $\begin{array}[]{ll}-\frac{1}{2}Tr[\sigma^{*}X_{j}\sigma]-\langle b,q_{j}\rangle-F_{n}(x_{j},u_{n_{j}}(x_{j}),\sigma(x_{j},i)^{*}\nabla u_{n_{j}}(x_{j})))\geq 0,\\\ -\frac{1}{2}Tr[\sigma^{*}X_{j}\sigma]-\langle b,q_{j}\rangle-f(x_{j})-n_{j}(u_{n_{j}}(x_{j})-h(x_{j}))^{-})+ru_{n_{j}}(x_{j})\geq 0.\end{array}$ Hence, $-\frac{1}{2}Tr[\sigma^{*}X_{j}\sigma]-\langle b,q_{j}\rangle-f(x_{j})+ru_{n_{j}}(x_{j})\geq 0,$ and taking the limit as $j\rightarrow+\infty$, we conclude that: $-\frac{1}{2}Tr[\sigma^{*}X\sigma]-\langle b,q\rangle-f(x)+ru(x)\geq 0.$ We conclude by showing that $u$ is of polynomial growth. From (4.12) we have, $\begin{array}[]{ll}|Y^{x}_{0}|&\leq sup_{\tau\geq 0}E[\int_{0}^{\tau}e^{-rs}|f(X_{s}^{x})|ds+|h(X^{x}_{\tau})|1\\!\\!1_{[\tau<+\infty]}]\\\ &\leq sup_{\tau\geq 0}E[\int_{0}^{\tau}e^{-rs}|f(X_{s}^{x})|ds+e^{-r\tau}|h(X^{x}_{\tau})|]\\\ &\leq E[\int_{0}^{+\infty}e^{-rs}|f(X_{s}^{x})|ds]+C_{1}.\end{array}$ (4.20) From polynomial growth of $f$ and $u(x)=Y^{x}_{0}$, we deduce that $u$ is of polynomial growth. Now we proceed to the proof of Lemme1. $Proof$ of Lemma 2. It suffices to show that whenever $x_{n}\rightarrow x$, $|Y_{0}^{x_{n}}-Y_{0}^{x}|\rightarrow 0$. From (4.12) we have, $Y^{x}_{0}=\sup_{\tau\in{\cal T}_{0}}E[\int_{0}^{\tau}e^{-rl}f(X_{l}^{x})dl+e^{-r\tau}h(X^{x}_{\tau})],$ $Y^{x_{n}}_{0}=\sup_{\tau\in{\cal T}_{0}}E[\int_{0}^{\tau}e^{-rl}f(X_{l}^{x_{n}})dl+e^{-r\tau}h(X^{x_{n}}_{\tau})]$ then, $\begin{array}[]{ll}|Y^{x_{n}}_{0}-Y^{x}_{0}|&\leq\sup\limits_{\tau\in{\cal T}_{0}}E[\int_{0}^{\tau}e^{-rl}|f(X_{l}^{x_{n}})-f(X_{l}^{x})|dl+e^{-r\tau}|h(X^{x_{n}}_{\tau})-h(X^{x}_{\tau})|]\\\ &\leq E[\int_{0}^{+\infty}e^{-rl}|f(X_{l}^{x_{n}})-f(X_{l}^{x})|dl]+E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|].\end{array}$ (4.21) In the right-hand side of (4.21) the first term converges to 0 as $x_{n}\rightarrow x$. Next let us show that, $E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]\rightarrow 0\quad\mbox{as}\quad x_{n}\rightarrow x.$ For any $T\geq 0$ we have $E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]\leq E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]+E[\sup\limits_{t\geq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|].$ Since $h$ is bounded there exists $C$ such that, $E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]\leq E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]+Ce^{-rT}.$ For any $\rho>0$ we have: $\begin{array}[]{ll}E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]&=E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|\leq\rho]}]\\\ &+E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|>\rho]}].\end{array}$ But since $h$ is continuous then it is uniformly continuous on compact subsets, then there exists $\pi:R^{k}\rightarrow R$ increasing with $\pi(0)=0$, such that: $|h(X^{x_{n}}_{t})-h(X^{x}_{t})|\leq\pi(|X^{x_{n}}_{t}-X^{x}_{t}|),$ we have $\begin{array}[]{ll}E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|\leq\rho]}]&\leq E[\sup\limits_{0\leq t\leq T}\pi(|X^{x_{n}}_{t}-X^{x}_{t}|)1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|\leq\rho]}]\\\ &\leq E[\pi(\sup\limits_{0\leq t\leq T}|X^{x_{n}}_{t}-X^{x}_{t}|)1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|\leq\rho]}].\end{array}$ Using the continuity proprety (4.3), $\pi(0)=0$ and the Lebesgue dominated convergence theorem to obtain that $E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|\leq\rho]}]\rightarrow 0\quad\mbox{as}\quad x_{n}\rightarrow x.$ (4.22) The second term satisfies: $\begin{array}[]{ll}E[\sup\limits_{0\leq t\leq T}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|>\rho]}]\\\ {}\qquad\leq E[\sup\limits_{0\leq t\leq T}e^{-2rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|^{2}]\\}^{\frac{1}{2}}\\{E[1\\!\\!1_{[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|>>\rho]}]\\}^{\frac{1}{2}}\\\ {}\qquad\leq E[\\{\sup\limits_{0\leq t\leq T}e^{-2rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|^{2}]\\}^{\frac{1}{2}}\\{\ \rho^{-1}E[\sup\limits_{t\leq T}|X_{t}^{x_{n}}|+\sup\limits_{t\leq T}|X_{t}^{x}|]\\}^{\frac{1}{2}}.\end{array}$ Since $h$ is bounded, it follows that, when $x_{n}\rightarrow x$, the right- hand side of the last inequality is smaller than $\rho^{-\frac{1}{2}}C_{x}$. However, from previous results we have, $\limsup\limits_{x_{n}\rightarrow x}E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]\leq\rho^{-\frac{1}{2}}C_{x}+Ce^{-rT}.$ As $\rho$ and $T$ are arbitrary then making $\rho\rightarrow+\infty$ and $T\rightarrow+\infty$ to obtain that, $\lim\limits_{x_{n}\rightarrow x}E[\sup\limits_{t\geq 0}e^{-rt}|h(X^{x_{n}}_{t})-h(X^{x}_{t})|]=0.$ (4.23) From (4.21) and (4.23), we deduce $|Y_{0}^{x_{n}}-Y_{0}^{x}|\rightarrow 0\quad\mbox{as}\quad x_{n}\rightarrow x.\Box$ ### 4.2 Existence of a solution for the system of variational inequalities Let $(Y^{1,x}_{s},...,Y^{m,x}_{s})_{s\geq 0}$ be the processes which satisfy the Verification Theorem 1 in the case when the process $X\equiv X^{x}$. Therefore using the characterization (4.12), there exist processes $K^{i,x}$ and $Z^{i,x}$, such that the triples ($Y^{i,x},Z^{i,x},K^{i,x})$ are unique solutions (thanks to Remark 2) of the following reflected BSDEs: for any $i=1,...,m$ we have, $\left\\{\begin{array}[]{l}Y^{i,x},K^{i,x}\in{\cal S}^{2}\mbox{ and }Z^{i,x}\in{\cal M}^{2,d};\,K^{i,x}\mbox{ is non-decreasing and }K^{i,x}_{0}=0,\\\ e^{-rs}Y^{i,x}_{s}=\int_{s}^{+\infty}e^{-rl}\psi_{i}(X_{l}^{x})ds-\int_{s}^{+\infty}Z^{i,x}_{l}dB_{l}+K_{+\infty}^{i,x}-K^{i,x}_{s},\,\,\,s\in I\\!\\!R^{+},\,\,\lim\limits_{s\rightarrow+\infty}(e^{-rs}Y^{i,x}_{s})=0,\\\ e^{-rs}Y^{i,x}_{s}\geq-e^{-rs}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{s}^{x})+Y^{j,x}_{s}),\,\,s\in I\\!\\!R^{+},\\\ \int_{0}^{+\infty}e^{-rl}(Y^{i,x}_{l}-\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{l}^{x})+Y^{j,x}_{l}))dK^{i,x}_{l}=0.\end{array}\right.$ (4.24) Moreover we have the following result. ###### Proposition 3 There are deterministic functions $v^{1},...,v^{m}$ $:I\\!\\!R^{k}\rightarrow I\\!\\!R$ such that: $\forall x\in I\\!\\!R^{k},Y_{0}^{i,x}=v^{i}(x),\,\,i=1,...,m.$ Moreover the functions $v^{i}$, $i=1,...,m,$ are of polynomial growth. $Proof$: For $n\geq 0$ let $(Y^{n,1,x}_{s},...,Y^{n,m,x}_{s})_{s\geq 0}$ be the processes constructed in (3.4)-(3.5). Therefore using an induction argument and Theorem 2 there exist deterministic continuous with polynomial growth functions $v^{n,i}$ ($i=1,...,m$) such that for any $x\in I\\!\\!R^{k}$, $Y^{n,i,x}_{0}=v^{n,i}(x)$. Using now inequality (3.6) we get: $Y^{n,i,x}_{t}\leq Y^{n+1,i,x}_{t}\leq CE[\int_{0}^{+\infty}\\{\max_{i=1,m}|e^{-rs}\psi_{i}(X^{x}_{s})|\\}ds]$ since $Y^{n,i,x}_{t}$ is deterministic. Therefore combining the polynomial growth of $\psi_{i}$ and estimate (4.2) for $X^{x}$ we obtain: $v^{n,i}(x)\leq v^{n+1,i}(x)\leq C(1+|x|^{\gamma})$ for a constant $C$ independent of $n$. In order to complete the proof it is enough now to set $v^{i}(x):=\lim_{n\rightarrow\infty}v^{n,i}(x),x\in I\\!\\!R^{k}$ since $Y^{n,i,x}\nearrow Y^{i,x}$ as $n\rightarrow\infty$. $\Box$ We are now going to focus on the continuity of the functions $v^{1},...,v^{m}$. But first let us deal with some properties of the optimal strategy which exist thanks to Theorem 1. ###### Proposition 4 Let $(\delta,u)=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 1})$ be an optimal strategy, then there exists a constant $C$ which does not depend on $t$ and $x$ such that: $\forall n\geq 1,\,\,E[e^{-r\tau_{n}}]\leq\frac{C(1+|x|^{\gamma})}{n}.$ (4.25) $Proof$: Recall the characterization of (3.8) that reads as: $\begin{array}[]{l}Y^{i,x}_{0}=sup_{(\delta,u)\in{\cal D}}E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s}^{x})ds-\sum_{k\geq 1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{\tau_{k}})].\end{array}$ Now if $(\delta,u)=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 1})$ is the optimal strategy then we have: $\begin{array}[]{l}Y^{i,x}_{0}=E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s}^{x})ds-\sum_{k\geq 1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{\tau_{k}})].\end{array}$ Taking into account that $g_{ij}\geq\frac{1}{\alpha}>0$ for any $i\neq j$ we obtain: $\begin{array}[]{ll}\frac{1}{\alpha}E[\sum_{k=1,n}e^{-r\tau_{k}}]+Y^{i,x}_{0}&\leq E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s}^{x})ds-\sum_{k\geq n+1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{\tau_{k}})].\end{array}$ But for any $k\leq n$, $e^{-r\tau_{n}}\leq e^{-r\tau_{k}}$ then: $\begin{array}[]{ll}\frac{n}{\alpha}E[e^{-r\tau_{n}}]+Y^{i,x}_{0}&\leq E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s}^{x})ds-\sum_{k\geq n+1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{\tau_{k}})]\\\ {}&\leq E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X_{s}^{x})ds].\end{array}$ and then $\begin{array}[]{ll}\frac{n}{\alpha}E[e^{-r\tau_{n}}]&\leq E[\int_{0}^{+\infty}e^{-rs}\mid\psi_{u_{s}}(X_{s}^{x})\mid ds]-Y^{i,x}_{0}\\\ {}&\leq E[\int_{0}^{+\infty}e^{-rs}\mid\psi_{u_{s}}(X_{s}^{x})\mid ds]-Y^{0,i,x}_{0}.\end{array}$ Finally taking into account the facts that $\psi_{i}$ and $Y^{0,i,x}$ are of polynomial growth, estimate (4.2) for $X^{x}$ and $\bf H4$ to obtain the desired result. Note that the polynomial growth of $Y^{0,i,x}$ stems from Proposition 3. $\Box$ ###### Remark 3 The estimate (4.25) is also valid for the optimal strategy if at the initial time the state of the plant is an arbitrary $i\in{\cal I}$. $\Box$ We are now ready to give the main result of this article. ###### Theorem 4 The functions $(v^{1},...,v^{m}):I\\!\\!R^{k}\rightarrow I\\!\\!R$ are continuous and solution in viscosity sense of the system of variational inequalities with inter-connected obstacles (2.4). $Proof$: First let us focus on continuity and let us show that $v1$ is continuous. The same proof will be valid for the continuity of the other functions $v^{i}$ ($i=2,...,m$). First the characterization (3.8) implies that: $Y^{1,x}_{0}=\sup_{(\delta,\xi)\in{\cal D}}E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X^{x}_{s})ds-\sum_{n\geq 1}e^{-r\tau_{n}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X^{x}_{\tau_{n}})]$ On the other hand an optimal strategy $(\delta^{*},\xi^{*})$ exists and satisfies the estimates (4.25) with the same constant $C$. Next let $\epsilon>0$ and $x^{\prime}\in B(x,\epsilon)$ and let us consider the following set of strategies: $\tilde{D}:=\\{(\delta,\xi)=((\tau_{n})_{n\geq 1},(\xi_{n})_{n\geq 0})\in{\cal D}\mbox{ such that }\forall n\geq 1,E[e^{-r\tau_{n}}]\leq\frac{C(1+(\epsilon+|x|^{\gamma}))}{n}\\}.$ Therefore the strategy $(\delta^{*},\xi^{*})$ belongs to $\tilde{D}$ and then we have: $\begin{array}[]{ll}Y^{1,x}_{0}&=\sup_{(\delta,\xi)\in{\tilde{D}}}E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X^{x}_{s})ds-\sum_{n\geq 1}e^{-ru_{\tau_{n}}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X^{x}_{\tau_{n}})]\\\ {}&=sup_{(\delta,u)\in{\tilde{D}}}E[\int_{0}^{\tau_{n}}e^{-rs}\psi_{u_{s}}(X^{x}_{s})ds\\\ {}&\qquad\qquad\qquad-\sum_{1\leq k\leq n}e^{-ru_{\tau_{k}}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{{\tau}_{k}})+e^{-r\tau_{n}}Y^{u_{\tau_{n}},x}_{\tau_{n}}]\end{array}$ and $\begin{array}[]{ll}Y^{1,x^{\prime}}_{0}&=\sup_{(\delta,\xi)\in{\tilde{D}}}E[\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X^{x^{\prime}}_{s})ds-\sum_{n\geq 1}e^{-ru_{\tau_{n}}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X^{x^{\prime}}_{\tau_{n}})]\\\ {}&=sup_{(\delta,u)\in{\tilde{D}}}E[\int_{0}^{\tau_{n}}e^{-rs}\psi_{u_{s}}(X^{x^{\prime}}_{s})ds\\\ {}&\qquad\qquad\qquad-\sum_{1\leq k\leq n}e^{-ru_{\tau_{k}}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x^{\prime}}_{{\tau}_{k}})+e^{-r\tau_{n}}Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}}]\end{array}$ The second equalities it due to the dynamical programming principle. It follows that: $\begin{array}[]{lll}|Y^{1,x^{\prime}}_{0}-Y^{1,x}_{0}|&\leq sup_{(\delta,u)\in{\tilde{D}}}E[\int_{0}^{\tau_{n}}e^{-rs}|\psi_{u_{s}}(X^{x^{\prime}}_{s})-\psi_{u_{s}}(X^{x}_{s})|ds\\\ {}&\qquad+\sum_{1\leq k\leq n}e^{-ru_{\tau_{k}}}|g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x^{\prime}}_{\tau_{k}})-g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X^{x}_{\tau_{k}})|\\\ {}&\qquad+e^{-r\tau_{n}}|Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}}-Y^{u_{\tau_{n}},x}_{\tau_{n}}|]\\\ {}&\leq E[\int_{0}^{+\infty}\max_{j=1,m}e^{-rs}|\psi_{j}(X^{x^{\prime}}_{s})-\psi_{j}(X^{x}_{s})|ds\\\ {}&\qquad+n\max_{i\neq j\in{\cal I}}\\{\sup_{s\geq 0}e^{-rs}|g_{ij}(X^{x^{\prime}}_{s})-g_{ij}(X^{x}_{s})|\\}]\\\ {}&\qquad+sup_{(\delta,u)\in{\tilde{D}}}(E[e^{-2r\tau_{n}}])^{\frac{1}{2}}(2E[(Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}})2+(Y^{u_{\tau_{n}},x}_{\tau_{n}})2])^{\frac{1}{2}}.\end{array}$ (4.26) In the right-hand side of (4.26) the first and the second term converges to $0$ as $x^{\prime}\rightarrow x$. Now let us focus on the last one. Since $(\delta,u)\in\tilde{D}$ then: $\begin{array}[]{ll}sup_{(\delta,u)\in{\tilde{D}}}(E[e^{-2r\tau_{n}}])^{\frac{1}{2}}(2E[(Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}})2+(Y^{u_{\tau_{n}},x}_{\tau_{n}})2])^{\frac{1}{2}}&\leq sup_{(\delta,u)\in{\tilde{D}}}(E[e^{-r\tau_{n}}])^{\frac{1}{2}}(2E[(Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}})2+(Y^{u_{\tau_{n}},x}_{\tau_{n}})2])^{\frac{1}{2}}\\\ &\leq n^{-\frac{1}{2}}\sup_{(\delta,u)\in{\tilde{D}}}(2E[(Y^{u_{\tau_{n}},x^{\prime}}_{\tau_{n}})2+(Y^{u_{\tau_{n}},x}_{\tau_{n}})2])^{\frac{1}{2}}\\\ {}&\leq Cn^{-\frac{1}{2}}(1+|x|^{\gamma}+|x^{\prime}|^{\gamma})\end{array}$ where $C$ an appropriate constant which comes from the polynomial growth of $\psi_{i}$, $i\in{\cal I}$, estimate (4.2) for the process $X^{x}$ and inequality (3.6). Going back now to (4.26), taking the limit as $x^{\prime}\rightarrow x$ to obtain: $\lim_{x^{\prime}\rightarrow x}|Y^{1,x^{\prime}}_{0}-Y^{1,x}_{0}|\leq Cn^{-\frac{1}{2}}(1+2|x|^{\gamma}).$ As $n$ is arbitrary then putting $n\rightarrow+\infty$ to obtain: $Y^{1,x^{\prime}}_{0}\rightarrow Y^{1,x}_{0}.$ Therefore $v^{1}$ is continuous. In the same way we can show that $v^{2}$,…,$v^{m}$ are continuous. As they are of polynomial growth then taking into account Theorem 2 to obtain that $(v^{1},\dots,v^{m})$ is a viscosity solution for the system of variational inequalities with inter-connected obstacles (2.4). $\Box$ ## 5 Uniqueness of the solution of the system We are going now to address the question of uniqueness of the viscosity solution of the system (2.4). We have the following: ###### Theorem 5 The solution in viscosity sense of the system of variational inequalities with inter-connected obstacles (2.4) is unique in the space of continuous functions on $R^{k}$ which satisfy a polynomial growth condition, i.e., in the space $\begin{array}[]{l}{\cal C}:=\\{\varphi:I\\!\\!R^{k}\rightarrow I\\!\\!R,\mbox{ continuous and for any }\\\ \qquad\qquad\qquad x,\,|\varphi(x)|\leq C(1+|x|^{\gamma})\mbox{ for some constants }C\quad\mbox{and}\quad\gamma\\}.\end{array}$ Proof. We will show by contradiction that if $u_{1},...,u_{m}$ and $w_{1},...,w_{m}$ are a subsolution and a supersolution respectively for (2.4) then for any $i=1,...,m$, $u_{i}\leq w_{i}$. Therefore if we have two solutions of (2.4) then they are obviously equal. Actually for some $R>0$ suppose there exists $(x_{0},i_{0})\in B_{R}\times{\cal I}$ $(B_{R}:=\\{x\in I\\!\\!R^{k};|x|\leq R\\})$ such that: $\max\limits_{(x,i)}(u_{i}(x)-w_{i}(x))=u_{i_{0}}(x_{0})-w_{i_{0}}(x_{0})=\eta>0.$ (5.1) Then, for a small $\epsilon>0$, and $\theta,\lambda\in(0,1)$ small enough, let us define: $\Phi^{i}_{\epsilon}(x,y)=u_{i}(x)-(1-\lambda)w_{i}(y)-\frac{1}{2\epsilon}|x-y|^{2\gamma}-\theta(|x-x_{0}|^{2\gamma+2}+|y-x_{0}|^{2\gamma+2}).$ (5.2) By the polynomial growth assumption on $u_{i}$ and $w_{i}$, there exists a $(x_{\epsilon},y_{\epsilon},i_{\epsilon})\in B_{R}\times B_{R}\times{\cal I}$, such that: $\Phi^{i_{\epsilon}}_{\epsilon}(x_{\epsilon},y_{\epsilon})=\max\limits_{(x,y,i)}\Phi^{i}_{\epsilon}(x,y).$ On the other hand, from $2\Phi^{i_{\epsilon}}_{\epsilon}(x_{\epsilon},y_{\epsilon})\geq\Phi^{i_{\epsilon}}_{\epsilon}(x_{\epsilon},x_{\epsilon})+\Phi^{i_{\epsilon}}_{\epsilon}(y_{\epsilon},y_{\epsilon})$, we have $\begin{array}[]{ll}\frac{1}{2\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma}&\leq(u_{i_{\epsilon}}(x_{\epsilon})-u_{i_{\epsilon}}(y_{\epsilon}))+(1-\lambda)(w_{i_{\epsilon}}(x_{\epsilon})-w_{i_{\epsilon}}(y_{\epsilon}))\\\ &\leq\sum\limits_{i\in{\cal I}}|u_{i}(x_{\epsilon})-u_{i}(y_{\epsilon})|+(1-\lambda)\sum\limits_{i\in{\cal I}}|w_{i}(x_{\epsilon})-w_{i}(y_{\epsilon})|\end{array}$ (5.3) and consequently $\frac{1}{2\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma}$ is bounded, and as $\epsilon\rightarrow 0$, $|x_{\epsilon}-y_{\epsilon}|\rightarrow 0$. Since $u_{i}$ and $w_{i}$ are uniformly continuous on $B_{R}$, then $\frac{1}{2\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma}\rightarrow 0$ as $\epsilon\rightarrow 0.$ Since $u_{i_{0}}(x_{0})-(1-\lambda)w_{i_{0}}(x_{0})\leq\Phi^{i_{\epsilon}}_{\epsilon}(x_{\epsilon},y_{\epsilon})\leq u_{i_{\epsilon}}(x_{\epsilon})-(1-\lambda)w_{i_{\epsilon}}(y_{\epsilon}),$ it follow as $\lambda\rightarrow 0$ and the continuity of $u_{i}$ and $w_{i}$ that, up to a subsequence, $(x_{\epsilon},y_{\epsilon},i_{\epsilon})\rightarrow(x_{0},x_{0},i_{0}).$ (5.4) We now claim that: $u_{i_{\epsilon}}(x_{\epsilon})-\max\limits_{j\in{\cal I}^{-i_{\epsilon}}}\\{-g_{i_{\epsilon}j}(x_{\epsilon})+u_{j}(x_{\epsilon})\\}>0.$ (5.5) Indeed if $u_{i_{\epsilon}}(x_{\epsilon})-\max\limits_{j\in{\cal I}^{-i_{\epsilon}}}\\{-g_{i_{\epsilon}j}(x_{\epsilon})+u_{j}(x_{\epsilon})\\}\leq 0$ then there exists $k\in{\cal I}^{-i_{\epsilon}}$ such that: $u_{i_{\epsilon}}(x_{\epsilon})\leq- g_{i_{\epsilon}k}(x_{\epsilon})+u_{k}(x_{\epsilon}).$ From the supersolution property of $w_{i_{\epsilon}}(y_{\epsilon})$, we have $w_{i_{\epsilon}}(y_{\epsilon})\geq\max\limits_{j\in{\cal I}^{-i_{\epsilon}}}(-g_{i_{\epsilon}j}(y_{\epsilon})+w_{j}(y_{\epsilon}))$ then $w_{i_{\epsilon}}(y_{\epsilon})\geq- g_{i_{\epsilon}k}(y_{\epsilon})+w_{k}(y_{\epsilon}).$ It follows that: $u_{i_{\epsilon}}(x_{\epsilon})-(1-\lambda)w_{i_{\epsilon}}(y_{\epsilon})-(u_{k}(x_{\epsilon})-(1-\lambda)w_{k}(y_{\epsilon}))\leq(1-\lambda)g_{i_{\epsilon}k}(y_{\epsilon})-g_{i_{\epsilon}k}(x_{\epsilon}).$ Now since $g_{ij}\geq\alpha>0$, for every $i\neq j$, and taking into account of (5.2) to obtain: $\begin{array}[]{ll}\Phi^{i_{\epsilon}}_{\epsilon}(x_{\epsilon},y_{\epsilon})-\Phi^{k}_{\epsilon}(x_{\epsilon},y_{\epsilon})&<-\alpha\lambda+g_{i_{\epsilon}k}(y_{\epsilon})-g_{i_{\epsilon}k}(x_{\epsilon})\\\ \end{array}$ But this contradicts the definition of $i_{\epsilon}$, since $g_{i_{\epsilon}k}$ is uniformly continuous on $B_{R}$ and the claim (5.5) holds. Next let us denote $\varphi_{\epsilon}(x,y)=\frac{1}{2\epsilon}|x-y|^{2\gamma}+\theta(|x-x_{0}|^{2\gamma+2}+|y-x_{0}|^{2\gamma+2}).$ (5.6) Then we have: $\left\\{\begin{array}[]{lll}D_{x}\varphi_{\epsilon}(t,x,y)=\frac{\gamma}{\epsilon}(x-y)|x-y|^{2\gamma-2}+\theta(2\gamma+2)(x-x_{0})|x-x_{0}|^{2\gamma},\\\ D_{y}\varphi_{\epsilon}(t,x,y)=-\frac{\gamma}{\epsilon}(x-y)|x-y|^{2\gamma-2}+\theta(2\gamma+2)(y-y_{0})|y-y_{0}|^{2\gamma},\\\ \\\ B(t,x,y)=D_{x,y}^{2}\varphi_{\epsilon}(t,x,y)=\frac{1}{\epsilon}\begin{pmatrix}a_{1}(x,y)&-a_{1}(x,y)\\\ -a_{1}(x,y)&a_{1}(x,y)\end{pmatrix}+\begin{pmatrix}a_{2}(x)&0\\\ 0&a_{2}(y)\end{pmatrix}\\\ \\\ \mbox{ with }a_{1}(x,y)=\gamma|x-y|^{2\gamma-2}I+\gamma(2\gamma-2)(x-y)(x-y)^{*}|x-y|^{2\gamma-4}\mbox{ and }\\\ a_{2}(x)=\theta(2\gamma+2)|x-x_{0}|^{2\gamma}I+2\theta\gamma(2\gamma+2)(x-x_{0})(x-x_{0})^{*}|x-x_{0}|^{2\gamma-2}.\end{array}\right.$ (5.7) Taking into account (5.5) then applying the result by Crandall et al. (Theorem 3.2, [6]) to the function $u_{i}(x)-(1-\lambda)w_{i}(y)-\varphi_{\epsilon}(x,y)$ at the point $(x_{\epsilon},y_{\epsilon})$, for any $\epsilon_{1}>0$, we can find $X,Y\in S_{k}$, such that: $\left\\{\begin{array}[]{lllll}(\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}+\theta(2\gamma+2)(x_{\epsilon}-x_{0})|x_{\epsilon}-x_{0}|^{2\gamma},X)\in J^{2,+}(u_{i_{\epsilon}}(x_{\epsilon})),\\\ (\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}-\theta(2\gamma+2)(y_{\epsilon}-y_{0})|y_{\epsilon}-y_{0}|^{2\gamma},Y)\in J^{2,-}((1-\lambda)w_{i_{\epsilon}}(y_{\epsilon})),\\\ -(\frac{1}{\epsilon_{1}}+||B(x_{\epsilon},y_{\epsilon})||)I\leq\begin{pmatrix}X&0\\\ 0&-Y\end{pmatrix}\leq B(x_{\epsilon},y_{\epsilon})+\epsilon_{1}B(x_{\epsilon},y_{\epsilon})2.\end{array}\right.$ (5.8) Taking now into account (5.5), and the definition of viscosity solution, we get: $\begin{array}[]{l}ru_{i_{\epsilon}}(x_{\epsilon})-\frac{1}{2}Tr[\sigma^{*}(x_{\epsilon})X\sigma(x_{\epsilon})]-\langle\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}\\\ \qquad\qquad\qquad\qquad\qquad+\theta(2\gamma+2)(x_{\epsilon}-x_{0})|x_{\epsilon}-x_{0}|^{2\gamma},b(x_{\epsilon})\rangle-\psi_{i_{\epsilon}}(x_{\epsilon})\leq 0\mbox{ and }\\\ r(1-\lambda)w_{i_{\epsilon}}(y_{\epsilon})-\frac{1}{2}Tr[\sigma^{*}(y_{\epsilon})Y\sigma(y_{\epsilon})]-\langle\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}\\\ \qquad\qquad\qquad\qquad\qquad-\theta(2\gamma+2)(y_{\epsilon}-x_{0})|y_{\epsilon}-x_{0}|^{2\gamma},b(y_{\epsilon})\rangle-(1-\lambda)\psi_{i_{\epsilon}}(y_{\epsilon})\geq 0\end{array}$ which implies that: $\begin{array}[]{llll}&ru_{i_{\epsilon}}(x_{\epsilon})-r(1-\lambda)w_{i_{\epsilon}}(y_{\epsilon})\leq\frac{1}{2}Tr[\sigma^{*}(x_{\epsilon})X\sigma(x_{\epsilon})-\sigma^{*}(y_{\epsilon})Y\sigma(y_{\epsilon})]\\\ &\qquad+\langle\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2},b(x_{\epsilon})-b(y_{\epsilon})\rangle\\\ &\qquad+\langle\theta(2\gamma+2)(x_{\epsilon}-x_{0})|x_{\epsilon}-x_{0}|^{2\gamma},b(x_{\epsilon})\rangle+\langle\theta(2\gamma+2)(y_{\epsilon}-x_{0})|y_{\epsilon}-x_{0}|^{2\gamma},b(y_{\epsilon})\rangle\\\ &\qquad+\psi_{i_{\epsilon}}(x_{\epsilon})-(1-\lambda)\psi_{i_{\epsilon}}(y_{\epsilon}).\end{array}$ (5.9) But from (5.7) there exist two constants $C$ and $C_{1}$ such that: $||a_{1}(x_{\epsilon},y_{\epsilon})||\leq C|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}\mbox{ and }(||a_{2}(x_{\epsilon})||\vee||a_{2}(y_{\epsilon})||)\leq C_{1}\theta.$ As $B=B(x_{\epsilon},y_{\epsilon})=\frac{1}{\epsilon}\begin{pmatrix}a_{1}(x_{\epsilon},y_{\epsilon})&-a_{1}(x_{\epsilon},y_{\epsilon})\\\ -a_{1}(x_{\epsilon},y_{\epsilon})&a_{1}(x_{\epsilon},y_{\epsilon})\end{pmatrix}+\begin{pmatrix}a_{2}(x_{\epsilon})&0\\\ 0&a_{2}(y_{\epsilon})\end{pmatrix}$ then $B\leq\frac{1}{\epsilon}\begin{pmatrix}I&-I\\\ -I&I\end{pmatrix}+C_{1}\theta I.$ It follows that: $B+\epsilon_{1}B2\leq C(\frac{1}{\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}+\frac{\epsilon_{1}}{\epsilon 2}|x_{\epsilon}-y_{\epsilon}|^{4\gamma-4})\begin{pmatrix}I&-I\\\ -I&I\end{pmatrix}+C_{1}\theta I$ (5.10) where $C$ and $C_{1}$ which hereafter may change from line to line. Choosing now $\epsilon_{1}=\epsilon$, yields the relation $B+\epsilon_{1}B2\leq\frac{C}{\epsilon}(|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2}+|x_{\epsilon}-y_{\epsilon}|^{4\gamma-4})\begin{pmatrix}I&-I\\\ -I&I\end{pmatrix}+C_{1}\theta I.$ (5.11) Now, from $\bf H1$, (5.8) and (5.11) we get: $\frac{1}{2}Tr[\sigma^{*}(x_{\epsilon})X\sigma(x_{\epsilon})-\sigma^{*}(y_{\epsilon})Y\sigma(y_{\epsilon})]\leq\frac{C}{\epsilon}(|x_{\epsilon}-y_{\epsilon}|^{2\gamma}+|x_{\epsilon}-y_{\epsilon}|^{4\gamma-2})+C_{1}\theta(1+|x_{\epsilon}|^{2}+|y_{\epsilon}|^{2}).$ Next $\langle\frac{\gamma}{\epsilon}(x_{\epsilon}-y_{\epsilon})|x_{\epsilon}-y_{\epsilon}|^{2\gamma-2},b(x_{\epsilon})-b(y_{\epsilon})\rangle\leq\frac{C2}{\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma}$ and finally, $\langle\theta(2\gamma+2)(x_{\epsilon}-x_{0})|x_{\epsilon}-x_{0}|^{2\gamma},b(x_{\epsilon})\rangle\leq\theta C(1+|x_{\epsilon}|)|x_{\epsilon}-x_{0}|^{2\gamma+1}$ $\langle\theta(2\gamma+2)(y_{\epsilon}-x_{0})|y_{\epsilon}-x_{0}|^{2\gamma},b(y_{\epsilon})\rangle\leq\theta C(1+|y_{\epsilon}|)|y_{\epsilon}-x_{0}|^{2\gamma+1}.$ So that by plugging into (LABEL:viscder) we obtain: $\begin{array}[]{l}ru_{i_{\epsilon}}(x_{\epsilon})-r(1-\lambda)w_{i_{\epsilon}}(y_{\epsilon})\leq\frac{C}{\epsilon}(|x_{\epsilon}-y_{\epsilon}|^{2\gamma}+|x_{\epsilon}-y_{\epsilon}|^{4\gamma-2})+C_{1}\theta(1+|x_{\epsilon}|^{2}+|y_{\epsilon}|^{2})+\frac{C2}{\epsilon}|x_{\epsilon}-y_{\epsilon}|^{2\gamma}+\\\ \qquad\qquad\theta C(1+|x_{\epsilon}|)|x_{\epsilon}-x_{0}|^{2\gamma+1}+\theta C(1+|y_{\epsilon}|)|y_{\epsilon}-x_{0}|^{2\gamma+1}+\psi_{i_{\epsilon}}(x_{\epsilon})-(1-\lambda)\psi_{i_{\epsilon}}(y_{\epsilon}).\end{array}$ By sending $\epsilon\rightarrow 0$, $\lambda\rightarrow 0$, $\theta\rightarrow 0$ and taking into account of the continuity of $\psi_{i_{\epsilon}}$, we obtain $u_{i_{0}}(x_{0})-w_{i_{0}}(x_{0})<0$ which is a contradiction. The proof of Theorem 5 is now complete. $\Box$ As a by-product we have the following Corollary: ###### Corollary 1 Let $(v^{1},...,v^{m})$ be a viscosity solution of (2.4) which satisfies a polynomial growth condition then for $i=1,...,m$ and $(t,x)\in I\\!\\!R^{k}$, $v^{i}(x)=\sup_{(\delta,\xi)\in{\cal D}^{i}_{0}}E[\displaystyle\int_{0}^{+\infty}e^{-rs}\psi_{u_{s}}(X^{x}_{s})ds-\sum_{n\geq 1}e^{-r\tau_{n}}g_{u_{\tau_{n-1}}u_{\tau_{n}}}(X^{x}_{\tau_{n}})].$ ## 6 Numerical results We consider now some numerical examples of the optimal switching problem (2.4). Example1: In this example we consider an optimal switching problem with two modes, where $r=100$, $b=x$, $\sigma=\sqrt{2}x$, $g_{12}(x)={\frac{1}{2}}|x|+0.1$, $g_{21}(t,x)=|x|+0.48$, $\psi_{1}(x)={\frac{1}{2}}x^{2}-0.3x+1$, $\psi_{2}(t,x)=x^{2}+1$. Figure 1: Curves of $v^{2}$ and $v^{1}$. Example2: We now consider the case of 3 modes where $r=100$, $b=x$, $\sigma=\sqrt{2}x$, $g_{12}(t,x)=0.5|x|+1$, $g_{13}(t,x)=x^{2}+0.5$, $g_{21}(t,x)=|x|+4$, $g_{23}(t,x)=|x|+5$, $g_{31}(t,x)=0.001|x|+0.1$, $g_{32}(t,x)=x^{2}+|x|+0.5$, $\psi_{1}(t,x)=x+1$, $\psi_{2}(t,x)=-x-2$ and finally $\psi_{3}(t,x)=-x-2$. Figure 2: Curves of $v^{1}$, $v^{3}$ and $v^{2}$. Acknowledgement: The author thanks gratefully Prof. S. Hamadène for the fructuous discussions during the preparation of this paper.$\Box$ ## Appendix: proof of Theorem 1 The proof consists in showing that for any $t\leq T,$ $Y^{i}_{t}$, as defined by (3.3), is nothing but the expected total profit or the value function of the optimal problem, given that the system is in mode $i$ at time $t$. More precisely, $e^{-rt}Y^{i}_{t}=\mbox{ess sup}_{(\delta,u)\in{\cal D}_{t}}E[\int_{t}^{+\infty}e^{-rs}\psi_{i}(X_{s})ds-\sum_{k\geq 1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X_{{\tau_{k}}})|{\cal F}_{t}],$ where ${\cal D}_{t}$ is the set of strategies such that $\tau_{1}\geq t$, P-a.s. if at time $t$ the system is in the mode i. Let us admit for a moment the following Lemma. ###### Lemma 2 For every $t\geq\tau^{*}_{1}$. $e^{-rt}Y^{u_{\tau^{*}_{1}}}_{t}=\mbox{ess sup}_{\tau\geq t}E[\int_{t}^{\tau}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-r\tau}\max\limits_{j\in{\cal I}^{-u_{\tau^{*}_{1}}}}(-g_{ij}(X_{\tau})+Y^{j}_{\tau})|{\cal F}_{t}].\Box$ (6.1) From properties of the Snell envelope and at time $t=0$ the system is in mode $1$, we have: $\begin{array}[]{ll}Y^{1}_{0}&=E[\int_{0}^{\tau^{*}_{1}}e^{-rs}\psi_{1}(X_{s})ds+e^{-r\tau^{*}_{1}}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{\tau^{*}_{1}})+Y^{j}_{\tau^{*}_{1}})]\\\ &=E[\int_{0}^{\tau^{*}_{1}}e^{-rs}\psi_{1}(X_{s})ds+e^{-r\tau^{*}_{1}}(-g_{iu_{\tau^{*}_{1}}}(X_{\tau^{*}_{1}})+Y^{u_{\tau^{*}_{1}}}_{\tau^{*}_{1}})].\end{array}$ Now from Lemma 2 and the definition of $\tau^{*}_{2}$ we have: $\begin{array}[]{ll}e^{-r\tau^{*}_{1}}Y^{u_{\tau^{*}_{1}}}_{\tau^{*}_{1}}&=E[\int_{\tau^{*}_{1}}^{\tau^{*}_{2}}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-r\tau^{*}_{2}}\max\limits_{j\in{\cal I}^{-u_{\tau^{*}_{1}}}}(-g_{u_{\tau^{*}_{1}}j}(X_{\tau^{*}_{2}})+Y^{j}_{\tau^{*}_{2}})|{\cal F}_{\tau^{*}_{1}}]\\\ &=E[\int_{\tau^{*}_{1}}^{\tau^{*}_{2}}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-r\tau^{*}_{2}}(-g_{u_{\tau^{*}_{1}}u_{\tau^{*}_{2}}}(X_{\tau^{*}_{2}})+Y^{u_{\tau^{*}_{2}}}_{\tau^{*}_{2}})|{\cal F}_{\tau^{*}_{1}}].\end{array}$ It implies that $\begin{array}[]{lll}Y^{1}_{0}&=E[\int_{0}^{\tau^{*}_{1}}e^{-rs}\psi_{1}(X_{s})ds-e^{-r\tau^{*}_{1}}g_{iu_{\tau^{*}_{1}}}(X_{\tau^{*}_{1}})\\\ &+E[\int_{\tau^{*}_{1}}^{\tau^{*}_{2}}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-r\tau^{*}_{2}}(-g_{u_{\tau^{*}_{1}}u_{\tau^{*}_{2}}}(X_{\tau^{*}_{2}})+Y^{u_{\tau^{*}_{2}}}_{\tau^{*}_{2}})|{\cal F}_{\tau^{*}_{1}}]]\\\ &=E[\int_{0}^{\tau^{*}_{1}}e^{-rs}\psi_{1}(X_{s})ds+\int_{\tau^{*}_{1}}^{\tau^{*}_{2}}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds-e^{-r\tau^{*}_{1}}g_{iu_{\tau^{*}_{1}}}(X_{\tau^{*}_{1}})-e^{-r\tau^{*}_{2}}g_{u_{\tau^{*}_{1}}u_{\tau^{*}_{2}}}(X_{\tau^{*}_{2}})\\\ &+e^{-r\tau^{*}_{2}}Y^{u_{\tau^{*}_{2}}}_{\tau^{*}_{2}}].\end{array}$ Therefore $Y^{1}_{0}=E[\int_{0}^{\tau^{*}_{2}}e^{-rs}\psi(X_{s},u_{s})ds-e^{-r\tau^{*}_{1}}g_{iu_{\tau^{*}_{1}}}(X_{\tau^{*}_{1}})-e^{-r\tau^{*}_{2}}g_{u_{\tau^{*}_{1}}u_{\tau^{*}_{2}}}(X_{\tau^{*}_{2}})+e^{-r\tau^{*}_{2}}Y^{u_{\tau^{*}_{2}}}_{\tau^{*}_{2}}],$ since between 0 and $\tau^{*}_{1}$ (resp. $\tau^{*}_{1}$ and $\tau^{*}_{2}$) the production is in regime $1$ (resp. regime $u_{\tau^{*}_{1}}$) and then $u_{t}=1$ (resp. $u_{t}=u_{\tau^{*}_{1}}$) which implies that $\displaystyle\int_{0}^{\tau^{*}_{2}}e^{-rs}\psi(X_{s},u_{s})ds=\displaystyle\int_{0}^{\tau^{*}_{1}}e^{-rs}\psi_{1}(X_{s})ds+\displaystyle\int_{\tau^{*}_{1}}^{\tau^{*}_{2}}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds.$ Now repeating this reasoning as many times as necessary we obtain that for any $n\geq 0,$ $\begin{array}[]{l}Y^{1}_{0}=E[\displaystyle\int_{0}^{\tau^{*}_{n}}e^{-rs}\psi(X_{s},u_{s})ds-\sum_{1\leq k\leq n}e^{-r\tau^{*}_{k}}g_{u_{\tau^{*}_{k-1}}u_{\tau^{*}_{k}}}(X_{{\tau^{*}_{k}}})+e^{-r\tau^{*}_{n}}Y^{u_{\tau^{*}_{n}}}_{\tau^{*}_{n}}].\end{array}$ Then, the strategy $(\delta^{*},u^{*})$ verify $E[\sum_{n\geq 0}e^{-r\tau^{*}_{n}}]<+\infty$, otherwise $Y^{1}_{0}$ would be equal to $-\infty$ contradicting the assumption that the processes $Y^{i}$ belong to ${\cal S}^{2}$. Therefore, taking the limit as $n\rightarrow+\infty$ we obtain $Y^{1}_{0}=J(\delta^{*},u^{*})$. To complete the proof it remains to show that the strategy $(\delta^{*},u^{*})$ it is optimal i.e. $J(\delta^{*},u^{*})\geq J(\delta,u)$ for any $(\delta,u)\in\cal D$. The definition of the Snell envelope yields $\begin{array}[]{ll}Y^{1}_{0}&\geq E[\int_{0}^{\tau_{1}}e^{-rs}\psi_{1}(X_{s})ds+e^{-r\tau_{1}}\max\limits_{j\in{\cal I}^{-1}}(-g_{1j}(X_{\tau_{1}})+Y^{j}_{\tau_{1}})]\\\ &\geq E[\int_{0}^{\tau_{1}}e^{-rs}\psi_{1}(X_{s})ds+e^{-r\tau_{1}}(-g_{1u_{\tau^{*}_{1}}}(X_{\tau_{1}})+Y^{u_{\tau_{1}}}_{\tau_{1}})].\end{array}$ But, once more using a similar characterization as (6.1), we get $\begin{array}[]{ll}e^{-r\tau_{1}}Y^{u_{\tau_{1}}}_{\tau_{1}}&\geq E[\int_{\tau_{1}}^{\tau_{2}}e^{-rs}\psi_{u_{\tau_{1}}}(X_{s})ds+e^{-r\tau_{2}}\max\limits_{j\in{\cal I}^{-u_{\tau_{1}}}}(-g_{u_{\tau_{1}}j}(X_{\tau_{2}})+Y^{j}_{\tau_{2}})|{\cal F}_{\tau_{1}}]\\\ &\geq E[\int_{\tau_{1}}^{\tau_{2}}e^{-rs}\psi_{u_{\tau_{1}}}(X_{s})ds+e^{-r\tau_{2}}(-g_{u_{\tau_{1}}u_{\tau_{2}}}(X_{\tau_{2}})+Y^{u_{\tau_{2}}}_{\tau_{2}})|{\cal F}_{\tau_{1}}].\end{array}$ Therefore, $\begin{array}[]{lll}Y^{1}_{0}&\geq E[\int_{0}^{\tau_{1}}e^{-rs}\psi_{1}(X_{s})ds-e^{-r\tau_{1}}g_{1u_{\tau_{1}}}(X_{\tau_{1}})]\\\ &+E[\int_{\tau_{1}}^{\tau_{2}}e^{-rs}\psi_{u_{\tau_{1}}}(X_{s})ds+e^{-r\tau_{2}}(-g_{u_{\tau_{1}}u_{\tau_{2}}}(X_{\tau_{2}})+Y^{u_{\tau_{2}}}_{\tau_{2}})]\\\ &=E[\int_{0}^{\tau_{2}}e^{-rs}\psi(X_{s},u_{s})ds-e^{-r\tau_{1}}g_{1u_{\tau_{1}}}(X_{\tau_{1}})-e^{-r\tau_{2}}g_{u_{\tau_{1}}u_{\tau_{2}}}(X_{\tau_{2}})+e^{-r\tau_{2}}Y^{u_{\tau_{2}}}_{\tau_{2}}].\end{array}$ Repeat this argument $n$ times to obtain $\begin{array}[]{l}Y^{1}_{0}\geq E[\displaystyle\int_{0}^{\tau_{n}}e^{-rs}\psi(X_{s},u_{s})ds-\sum_{1\leq k\leq n}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X_{{\tau_{k}}})+e^{-r\tau_{n}}Y^{u_{\tau_{n}}}_{\tau_{n}}].\end{array}$ Finally, taking the limit as $n\rightarrow+\infty$ yields $\begin{array}[]{l}Y1_{0}\geq E[\displaystyle\int_{0}^{+\infty}e^{-rs}\psi(X_{s},u_{s})ds-\sum_{k\geq 1}e^{-r\tau_{k}}g_{u_{\tau_{k-1}}u_{\tau_{k}}}(X_{{\tau_{k}}})].\end{array}$ Hence, the strategy $(\delta^{*},u^{*})$ is optimal. We proceed to the proof of Lemma 2. $Proof$ of Lemma 2. From (3.3) we have for any $i\in{\cal I}$ and $t\geq 0$ $\begin{array}[]{l}e^{-rt}Y^{i}_{t}=\mbox{ess sup}_{\tau\geq t}E[\int_{t}^{\tau}e^{-rs}\psi_{i}(X_{s})ds+e^{-r\tau}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{\tau})+Y^{j}_{\tau})|{\cal F}_{t}].\end{array}$ (6.2) This also means that the process $(e^{-rt}Y^{i}_{t}+\int_{0}^{t}e^{-rs}\psi_{i}(X_{s})ds)_{t\geq 0}$ is a supermartingale which dominates $(\int_{0}^{t}e^{-rs}\psi_{i}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{t})+Y^{j}_{t}))_{t\geq 0}.$ This implies that the process $(1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(e^{-rt}Y^{i}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds))_{t\geq\tau^{*}_{1}}$ is a supermartingale which dominates $(1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{t})+Y^{j}_{t}))_{t\geq\tau^{*}_{1}}.$ Since ${\cal I}$ is finite, the process $(\sum_{i\in{\cal I}}1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(e^{-rt}Y^{i}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds))_{t\geq\tau^{*}_{1}}$ is also a supermartingale which dominates $(\sum_{i\in{\cal I}}1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{t})+Y^{j}_{t}))_{t\geq\tau^{*}_{1}}.$ Thus, the process $(e^{-rt}Y^{u_{\tau^{*}_{1}}}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds)_{t\geq\tau^{*}_{1}}$ is a supermartingale which is greater than $(\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-u_{\tau^{*}_{1}}}}(-g_{u_{\tau^{*}_{1}}j}(X_{t})+Y^{j}_{t}))_{t\geq\tau^{*}_{1}}.$ To complete the proof it remains to show that it is the smallest one which has this property and use the characterization of the Snell envelope see e.g. [7, 14, 16]. Indeed, let $(Z_{t})_{t\geq\tau^{*}_{1}}$ be a supermartingale of class $[D]$ such that, for any $t\geq\tau^{*}_{1}$, $Z_{t}\geq\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-u_{\tau^{*}_{1}}}}(-g_{u_{\tau^{*}_{1}}j}(X_{t})+Y^{j}_{t}).$ It follows that for every $t\geq\tau^{*}_{1}$, $1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}Z_{t}\geq 1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{t})+Y^{j}_{t})).$ But, the process $(1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}Z_{t})_{t\geq\tau^{*}_{1}}$ is a supermartingale and for every $t\geq\tau^{*}_{1}$, $1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}e^{-rt}Y^{i}_{t}=\mbox{ess sup}_{\tau\geq t}E[1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(\int_{t}^{\tau}e^{-rs}\psi_{i}(X_{s})ds+e^{-r\tau}\max\limits_{j\in{\cal I}^{-i}}(-g_{ij}(X_{\tau})+Y^{j}_{\tau}))|{\cal F}_{t}].$ It follows that, for every $t\geq\tau^{*}_{1}$, $1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}Z_{t}\geq 1\\!\\!1_{[u_{\tau^{*}_{1}}=i]}(e^{-rt}Y^{i}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{i}(X_{s})ds).$ Summing over $i$, we get, for every $t\geq\tau^{*}_{1}$, $Z_{t}\geq e^{-rt}Y^{u_{\tau^{*}_{1}}}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds.$ Hence, the process $(e^{-rt}Y^{u_{\tau^{*}_{1}}}_{t}+\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds)_{t\geq\tau^{*}_{1}}$ is the Snell envelope of $(\int_{\tau^{*}_{1}}^{t}e^{-rs}\psi_{u_{\tau^{*}_{1}}}(X_{s})ds+e^{-rt}\max\limits_{j\in{\cal I}^{-u_{\tau^{*}_{1}}}}(-g_{u_{\tau^{*}_{1}}j}(X_{t})+Y^{j}_{t}))_{t\geq\tau^{*}_{1}},$ whence Lemma 2.$\Box$ ## References * [1] Bayraktar, E. and Egami, M. (2007): On the One-Dimensional Optimal Switching Problem. Preprint. * [2] Brekke, K. A. and Øksendal, B. (1994): Optimal switching in an economic activity under uncertainty. SIAM J. Control Optim. (32), pp. 1021-1036. * [3] Brennan, M. J. and Schwartz, E. S. (1985): Evaluating natural resource investments. J.Business 58, pp. 135-137. * [4] Carmona, R. and Ludkovski, M. (2005): Optimal Switching with Applications to Energy Tolling Agreements. Preprint. * [5] Chen, Z. (1998): Existence and uniqueness for BSDE’s with stopping time, Chinese Science Bulletin, 43, p.96-99. * [6] Crandall, M., Ishii, H. and P.L. Lions (1992) : User s guide to viscosity solutions of second order partial differential equations, Bull. Amer. Math. Soc., 27, 1-67. * [7] Cvitanic, J. and Karatzas, I (1996): Backward SDEs with reflection and Dynkin games. Annals of Probability 24 (4), pp. 2024-2056. * [8] Dellacherie, C. and Meyer, P.A. (1980). Probabilités et Potentiel V-VIII, Hermann, Paris. * [9] Dixit, A. and Pindyck, R. S. (1994): Investment under uncertainty. Princeton Univ. Press. * [10] Djehiche, B. and Hamadène, S (2009): On a finite horizon Starting and Stopping Problem with Default risk. to appear in the International J. of Theoretical and Applied Finance (IJTAF). * [11] Djehiche, B. Hamadène, S. and Popier, A. (2007): A finite horizon optimal multiple switching problem. Preprint, Université du Maine, F. * [12] Duckworth, K. and Zervos, M. (2001): A model for investment decisions with switching costs. Annals of Applied probability 11 (1), pp. 239-260. * [13] El Asri, B. and Hamadène, S. (2009): The Finite Horizon Optimal Multi-Modes Switching Problem: the Viscosity Solution Approach, Applied Mathematics and Optimization, DOI 10.1007/s00245-009-9071-3. * [14] El Karoui, N. (1980): Les aspects probabilistes du contrôle stochastique. Ecole d’été de probabilités de Saint-Flour, Lect. Notes in Math. No 876, Springer Verlag. * [15] El-Karoui, N. Kapoudjian, C. Pardoux, E. Peng, S. and Quenez, M. C. (1997): Reflected solutions of backward SDEs and related obstacle problems for PDEs. Annals of Probability 25 (2), pp. 702-737. * [16] Hamadène, S. (2002): Reflected BSDEs with discontinuous barriers. Stochastics and Stochastic Reports 74 (3-4), pp. 571-596. * [17] Hamadène, S. and Jeanblanc, M (2007): On the Starting and Stopping Problem: Application in reversible investments, Math. of Operation Research, vol.32, No.1, pp.182-192. * [18] Hamadène, S. and Hdhiri, I. (2006): On the starting and stopping problem in the model with jumps. Preprint , Université du Maine, Le Mans, F. * [19] Hamadène, S. Lepeltier, J-P and Wu, Z. (1999): nfinite Horizon Reflected BSDE’s and Applications in Mixed Control and Game Problems. Probability and Mathematical Statistics International Journal vol.19, pp.211-234 * [20] Ly Vath, V. Pham, H and Zhou, X. (2007): Optimal switching over multiple regimes. Preprint.. * [21] Pardoux, E. (1999): Weak convergence and homogenization of semilinear PDEs. Nonlin. Anal, Dif. Equa. and Control, pp. 503-549. * [22] Revuz, D and Yor, M. (1991): Continuous Martingales and Brownian Motion. Springer Verlag, Berlin. * [23] Tang, S. and Yong, J. (1993): Finite horizon stochastic optimal switching and impulse controls with a viscosity solution approach. Stoch. and Stoch. Reports, 45, 145-176. * [24] Zervos, M. (2003): A Problem of Sequential Enty and Exit Decisions Combined with Discretionary Stopping. SIAM J. Control Optim. 42 (2), pp. 397-421.
arxiv-papers
2009-04-04T12:53:19
2024-09-04T02:49:01.697365
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Brahim El Asri", "submitter": "Brahim El Asri", "url": "https://arxiv.org/abs/0904.0707" }
0904.0817
# On CON(${\mathfrak{d}}_{\lambda}>$ covλ(meagre)) Saharon Shelah Einstein Institute of Mathematics Edmond J. Safra Campus, Givat Ram The Hebrew University of Jerusalem Jerusalem, 91904, Israel and Department of Mathematics Hill Center - Busch Campus Rutgers, The State University of New Jersey 110 Frelinghuysen Road Piscataway, NJ 08854-8019 USA shelah@math.huji.ac.il http://shelah.logic.at ###### Abstract. We prove the consistency of: for suitable strongly inaccessible cardinal $\lambda$ the dominating number, i.e., the cofinality of ${}^{\lambda}\lambda$, is strictly bigger than covλ(meagre), i.e. the minimal number of nowhere dense subsets of ${}^{\lambda}2$ needed to cover it. This answers a question of Matet. The author thanks Alice Leonhardt for the beautiful typing. I thank Shimoni Garti for some corrections. This research was supported by the United States- Israel Binational Science Foundation. Publication 945. ## 0\. Introduction Cardinal invariants on the continuum have a long tradition of research. For a topologist, it can be viewed as investigating the space $\beta(\omega)$, the Stone Čzech compactification of $\omega$. This point of view is taken, for example, in the celebrated paper of Van Douwen [vD84]. For set theorists, it is interesting to check the relationship between the relevant cardinal invariants. In this context, it is natural to generalize the problems to higher cardinals, above $\aleph_{0}$. One finds out, very soon, that for the class of (strongly) inaccessible cardinals, the generalizations are more reasonable and have more affinity to the $\aleph_{0}$ case. We shall define three cardinal invariants (but the paper deals, actually, just with two of them): ###### Definition 0.1. The bounding and dominating numbers. Let $\lambda$ be an inaccessible cardinal. Let $f,g\in{}^{\lambda}\lambda$ 1. $(a)$ $f\leq^{*}g$ if $|\\{\alpha<\lambda:f(\alpha)>g(\alpha)\\}|<\lambda$ 2. $(b)$ $A\subseteq{}^{\lambda}\lambda$ is unbounded if there is no $h\in{}^{\lambda}\lambda$ so that $f\in A\Rightarrow f\leq^{*}h$ 3. $(c)$ $A\subseteq{}^{\lambda}\lambda$ is dominating when for every $f\in{}^{\lambda}\lambda$ there exists $g\in A$ so that $f\leq^{*}g$ 4. $(d)$ the bounding number for $\lambda$, denoted by ${\mathfrak{b}}_{\lambda}$, is min$\\{|A|:A$ is unbounded in ${}^{\lambda}\lambda\\}$ 5. $(e)$ the dominating number for $\lambda$, denoted by ${\mathfrak{d}}_{\lambda}$, is min$\\{|A|:A$ is dominating in ${}^{\lambda}\lambda\\}$. Notice that the usual definitions of ${\mathfrak{b}}$ and ${\mathfrak{d}}$ are ${\mathfrak{b}}_{\aleph_{0}}$ and ${\mathfrak{d}}_{\aleph_{0}}$ according to Definition 0.1. The definition of covλ(meagre) involves some topology. ###### Definition 0.2. The meagre covering number. Let $\lambda$ be a regular cardinal 1. $(a)$ ${}^{\lambda}2$ is the space of functions from $\lambda$ into 2 2. $(b)$ $({}^{\lambda}2)^{[\nu]}=\\{\eta\in{}^{\lambda}2:\nu\triangleleft\eta\\}$, for $\nu\in\bigcup\limits_{\alpha<\lambda}{}^{\alpha}2$ 3. $(c)$ ${\mathcal{U}}\subseteq{}^{\lambda}2$ is open in the topology $({}^{\lambda}2)_{<\lambda}$, iff for every $\eta\in{\mathcal{U}}$ there exists $i<\lambda$ so that $({}^{\lambda}2)^{[\eta{\restriction}i]}\subseteq{\mathcal{U}}$ 4. $(d)$ covλ(meagre) is the minimal cardinality of a family of meagre subsets of $({}^{\lambda}2)_{<\lambda}$, which covers this space. The paper deals with the relationship between ${\mathfrak{d}}_{\lambda}$ and covλ(meagre). Matet asked (a personal communication) whether ${\mathfrak{d}}_{\lambda}\leq\text{ cov}_{\lambda}$(meagre) is provable in ZFC. We give here a negative answer. For $\lambda$ a supercompact cardinal and $\lambda<\kappa=\text{ cf}(\kappa)<\mu=\mu^{\lambda}$, we force large ${\mathfrak{d}}_{\lambda}$ i.e., ${\mathfrak{d}}_{\lambda}=\mu$ and small covering number (i.e., covλ(meagre) $=\kappa$). A similar result should hold also for a wider class of cardinals and we intend to return to this subject. We try to use standard notation. We use $\theta,\kappa,\lambda,\mu,\chi$ for cardinals $\alpha,\beta,\gamma,\delta,\varepsilon,\zeta$ for ordinals. We use also $i$ and $j$ as ordinals. We adopt the Cohen convention that $p\leq q$ means that $q$ gives more information, in forcing notions. The symbol $\triangleleft$ is preserved for “being an initial segment”. Also recall ${}^{B}A=\\{f:f$ a function from $B$ to $A\\}$ and let ${}^{\alpha>}A=\cup\\{{}^{\beta}A:\beta<\alpha\\}$, some prefer ${}^{<\alpha}A$, but ${}^{\alpha>}A$ is used systematically in the author’s papers. At last, $J^{\text{\rm bd}}_{\lambda}$ denotes the ideal of the bounded subsets of $\lambda$. The picture of cardinal invariants related to uncountable $\lambda$ is related but usually quite different than the one for $\aleph_{0}$, they are more similar if $\kappa$ is “large” enough, mainly strongly inaccessible. Let us sketch some known results. These results are related to the unequality number and the covering number for category. Recall: ###### Definition 0.3. The unequality number. Let $\kappa$ be an infinite cardinal. The unequality number of $\kappa,{\mathfrak{e}}_{\kappa}$, is the minimal cardinal $\lambda$ such that there is a set ${\mathcal{F}}\subseteq{}^{\lambda}\lambda$ of cardinality $\lambda$ such that there is no $g\in{}^{\lambda}\lambda$ satisfying $(\forall f\in{\mathcal{F}})(\exists^{\kappa}\alpha<\lambda)(f(\alpha)=g(\alpha))$. For $\kappa=\aleph_{0},{\mathfrak{e}}_{\kappa}=\text{ cov}_{\aleph_{0}}(\text{meagre})$; see Bartosynski (in [Bar87]) and Miller (in [Mil82]). Now 1. $(a)$ the statement ${\mathfrak{e}}_{\kappa}=\text{ cov}_{\kappa}(\text{meagre})$ is valid for $\kappa>\aleph_{0}$, in the case that $\kappa$ is strongly inaccessible, by [Lan92]. But if $\kappa$ is a successor cardinal, it may fail 2. $(b)$ if ${\mathfrak{d}}_{\kappa}$ is only finitely many cardinals away from $\kappa$, then ${\mathfrak{e}}_{\kappa}={\mathfrak{d}}_{\kappa}$. This can be found in Matet-Shelah [MtSh:804] 3. $(c)$ if $\kappa<\kappa^{<\kappa}$, then cov${}_{\kappa}({\mathcal{M}})=\kappa^{+}$. This is due to Landver (in [Lan92]) 4. $(d)$ it is consistent to get (a) and (b) together, so that cov${}_{\kappa}(\text{meagre})<{\mathfrak{e}}_{\kappa}$. This follows from Cummings-Shelah (in [CuSh:541]). ## 1\. The forcing ###### Theorem 1.1. Assume 1. $(a)$ $\lambda$ is supercompact 2. $(b)$ $\lambda<\kappa=\text{\rm cf}(\kappa)=\kappa^{<\kappa}<\mu=\text{\rm cf}(\mu)=\mu^{\lambda}$ 3. $(c)$ $\kappa>\lambda^{+}$ and111The assumption $\kappa>\lambda^{+}$ is technical, to allow $\kappa=\lambda^{+}$ we should just use $\delta(*)\kappa$ instead of $\kappa$. $\delta(*)=(\lambda^{+})^{\lambda^{+}}$ ordinal exponentiation and ${\mathcal{U}}_{*}=\\{\delta(*)(\alpha+1):\alpha<\kappa\\}$ not used till $(*)_{8}$ in the proof of 1.3. Then for some forcing notion ${\mathbb{P}}$ not collapsing cardinals $\geq\lambda,\lambda$ is still supercompact in $\mathbb{V}^{{\mathbb{P}}}$ and covλ(meagre) $=\kappa,{\mathfrak{d}}_{\lambda}=\mu$. ###### Proof.. By 1.3 below. ∎ Recall ###### Definition 1.2. 1) We say that a forcing notion $\mathbb{P}$ is $\alpha$-strategically complete when for each $p\in\mathbb{P}$ in the following game $\Game_{\alpha}(p,\mathbb{P})$ between the players COM and INC, the player COM has a winning strategy. A play lasts $\alpha$ moves; in the $\beta$-th move, first the player COM chooses $p_{\beta}\in\mathbb{P}$ such that $p\leq_{\mathbb{P}}p_{\beta}$ and $\gamma<\beta\Rightarrow q_{\gamma}\leq_{\mathbb{P}}p_{\beta}$ and second the player INC chooses $q_{\beta}\in\mathbb{P}$ such that $p_{\beta}\leq_{\mathbb{P}}q_{\beta}$. The player COM wins a play if he has a legal move for every $\beta<\alpha$. 2) We say that a forcing notion $\mathbb{P}$ is $(<\lambda)$-strategically complete when it is $\alpha$-strategically complete for every $\alpha<\lambda$. ###### Lemma 1.3. 1) If $\lambda$ is supercompact then after some preliminary forcing of cardinality $\lambda,\lambda$ is still supercompact and $\boxdot_{\lambda}$ below holds. 2) If $\lambda$ is strongly inaccessible and $\boxdot_{\lambda}$ below holds and $\lambda^{+}<\kappa=\,\text{\rm cf}(\kappa)<\mu=\mu^{\lambda}$, then for some $\lambda^{+}$-c.c., $(<\lambda)$-strategically complete forcing notion $\mathbb{P}$ we have $\Vdash_{\mathbb{P}}``{\mathfrak{d}}_{\lambda}=\mu$, cov${}_{\lambda}(\text{\rm meagre})=\kappa"$ where 1. $\boxdot_{\lambda}$ for any regular cardinal $\chi>\lambda$ and forcing notion ${\mathbb{P}}\in{\mathcal{H}}(\chi)$ which is $(<\lambda)$-strategically complete (see Definition 1.2(2)) the following set ${{\mathcal{S}}}={{\mathcal{S}}}_{{\mathbb{P}}}$ is a stationary subset of $[{{\mathcal{H}}}(\chi)]^{<\lambda}$: ${{\mathcal{S}}}$ is the set of $N$’s such that for some $\lambda_{N},\chi_{N},\mathbb{j}=\mathbb{j}_{N},N^{\prime}=N^{\prime}_{N},M=M_{N},\mathbb{G}=\mathbb{G}_{N}$ we have: 1. $(a)$ $N\prec({{\mathcal{H}}}(\chi)^{\mathbb{V}},\in)$ and ${\mathbb{P}}\in N$ 2. $(b)$ the Mostowski collapse $N^{\prime}$ of $N$ is $\subseteq{{\mathcal{H}}}(\chi_{N})$, and let $\mathbb{j}_{N}:N\rightarrow N^{\prime}$ be the unique isomorphism 3. $(c)$ $N\cap\lambda=\lambda_{N}$ and ${}^{(\lambda_{N})>}N\subseteq N$ and $\lambda_{N}$ is strongly inaccessible 4. $(d)$ $N^{\prime}\subseteq M:=({{\mathcal{H}}}(\chi_{N}),\in)$ so both $N^{\prime}$ and $M$ are transitive 5. $(e)$ $\mathbb{G}\subseteq\mathbb{j}_{N}({\mathbb{P}})$ is generic over $N^{\prime}$ for the forcing notion $\mathbb{j}({\mathbb{P}})$ 6. $(f)$ $M=N^{\prime}[\mathbb{G}]$. ###### Remark 1.4. 1) Recall that: 1. $(a)$ $\bar{{\mathbb{Q}}}=\langle{\mathbb{P}}_{\alpha},\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\beta}:\alpha\leq\delta,\beta<\delta\rangle$ be a $(<\lambda)$-support iteration of $(<\lambda)$-strategically complete forcing notions, then ${\mathbb{P}}_{\delta}$ is also $\lambda$-strategically complete. 2. $(b)$ If ${\mathbb{P}}$ is $(<\lambda)$-strategically complete forcing notion then $({}^{\lambda>}\text{Ord})^{\mathbb{V}}=({}^{\lambda>}\text{Ord})^{\mathbb{V}^{{\mathbb{P}}}}$, and consequently $\lambda$ is strongly inaccessible in $\mathbb{V}^{{\mathbb{P}}}$. 2) In part (1) the “$\lambda^{+}<\kappa$” rather than “$\lambda<\kappa$” is not essential, see in the proof. 3) Is the use of $\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\restriction}{\mathcal{U}}_{*}$ rather than $\textstyle\bar{g}$ $\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$ in the proof necessary? See on this [Sh:F979]. ###### Definition 1.5. We may say $(N,\lambda_{N},\chi_{N},\mathbb{j}_{N},N^{\prime}_{N},M_{N},\mathbb{G}_{N})$ is a witness for $(N,{\mathbb{P}})$ when clauses (a)-(f) from 1.3 hold. ###### Proof.. Proof of Claim 1.3 1) This is essentially by Laver [Lav78] using Laver’s diamond. 2) We use a $(<\lambda)$-support iteration $\bar{{\mathbb{Q}}}=\langle\mathbb{P}_{\alpha},\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\beta}:\alpha\leq\mu+\kappa,\beta<\mu+\kappa\rangle$ such that 1. $(A)$ if $\alpha<\mu$ then $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ is the $({\mathbb{P}}_{\alpha}$-name of the) dominating forcing, ${\mathbb{Q}}^{\text{dom}}_{\lambda}$, i.e. $({\mathbb{Q}}^{\text{dom}}_{\lambda})^{\mathbb{V}[{\mathbb{P}}_{\alpha}]}$ where in the universe $\mathbb{V}^{{\mathbb{P}}_{\alpha}}$ the forcing ${\mathbb{Q}}={\mathbb{Q}}^{\text{dom}}_{\lambda}$ is 1. $(\alpha)$ $p\in{\mathbb{Q}}$ iff 1. $(a)$ $p=(\eta,f)=(\eta^{p},f^{p})$ 2. $(b)$ $\eta\in{}^{\varepsilon}\lambda$ for some $\varepsilon<\lambda$, ($\eta$ is called the trunk of $p$) 3. $(c)$ $f\in{}^{\lambda}\lambda$ 4. $(d)$ $\eta\triangleleft f$ 2. $(\beta)$ $p\leq_{\mathbb{Q}}q$ iff 1. $(a)$ $\eta^{p}\trianglelefteq\eta^{q}$ 2. $(b)$ $f^{p}\leq f^{q}$, i.e. $(\forall\varepsilon<\lambda)f^{p}(\varepsilon)\leq f^{q}(\varepsilon)$ 3. $(c)$ if $\ell g(\eta^{p})\leq\varepsilon<\ell g(\eta^{q})$ then $\eta^{q}(\varepsilon)\in[f^{p}(\varepsilon),\lambda)$; this follows 2. $(B)$ fix $\bar{\theta}=\langle\theta_{\alpha}:\alpha<\lambda\rangle$ with $\theta_{\alpha}=(2^{|\alpha|+\aleph_{0}})^{+}$, or any sequence of cardinals $\in\text{ Reg }\cap\lambda$, increasing fast enough 3. $(C)$ if $\alpha\in[\mu,\mu+\kappa]$ then $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ is the $\bar{\theta}$-dominating forcing, i.e., $({\mathbb{Q}}_{\bar{\theta}})^{\mathbb{V}[{\mathbb{P}}_{\alpha}]}$ where in the universe $\mathbb{V}^{{\mathbb{P}}_{\alpha}}$ the forcing notion ${\mathbb{Q}}={\mathbb{Q}}_{\bar{\theta}}$ is defined as follows: 1. $(\alpha)$ $p\in{\mathbb{Q}}$ iff 1. $(a)$ $p=(\eta,f)=(\eta^{p},f^{p})$ 2. $(b)$ $\eta\in\prod_{\zeta<\ell g(\eta)}\theta_{\zeta}$ and $\ell g(\eta)$ is an ordinal $<\lambda$ 3. $(c)$ $f\in\prod_{\zeta<\lambda}\theta_{\zeta}$ 4. $(d)$ $\eta\triangleleft f$ 2. $(\beta)$ order: as in $(A)(\beta)$. Let $\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ be the generic object for $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ for $\alpha<\mu$ and $\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{i}$ be the generic object for $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\mu+i}$ for $i<\kappa$. Now: 1. $(*)_{1}$ for $\alpha\leq\mu+\kappa$ the forcing notion ${\mathbb{P}}_{\alpha}$ is $(<\lambda)$-strategically complete and, when $\alpha<\mu+\kappa,\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ is $(<\lambda)$-strategically complete222for this, $\theta_{\alpha}>\alpha$ is enough, in fact 1. $(\alpha)$ for $\alpha\in[\mu,\mu+\kappa)$ it is not $(<\lambda)$-complete but it is $(<\lambda)$-strategically complete, and even $\lambda$-strategically complete; simply, in a play, COM can keep having the trunk being of length $\geq$ length of the play so far 2. $(\alpha)^{+}$ moreover, COM can guarantee that in limit stage $\beta$ of the game, $\langle p_{\alpha}:\alpha<\beta\rangle$ has a lub 3. $(\beta)$ for $\alpha\in[0,\mu),\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ is $(<\lambda)$-complete even for directed systems (hence ${\mathbb{P}}_{\beta}$ for $\beta\leq\mu$ is) 4. $(\beta)^{+}$ moreover, for such systems there is a lub. [Why? We prove this by induction on $\alpha$ for ${\mathbb{P}}_{\alpha}$, using 1.4.] 1. $(*)_{2}$ for each $\alpha\leq\mu+\kappa,{\mathbb{P}}_{\alpha}$ and for $\alpha<\mu+\kappa$, the forcing notions $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}$ satisfy a strong form of the $\lambda^{+}$-c.c., (see [Sh:80] for definition, preservation and history; or pedantically [Sh:546, §1]) hence 1. $(*)_{3}$ $(a)\quad$ forcing with ${\mathbb{P}}_{\mu+\kappa}$ collapses no cardinal, changes no cofinality, and adds no sequence to ${}^{\lambda>}\mathbb{V}$; 2. $(b)\quad({}^{\lambda}\lambda)^{\mathbb{V}[{\mathbb{P}}_{\mu+\kappa}]}=\cup\\{({}^{\lambda}\lambda)^{\mathbb{V}[{\mathbb{P}}_{\mu+i}]}:i<\kappa\\}$ 3. $(c)\quad({}^{\lambda}\lambda)^{\mathbb{V}[{\mathbb{P}}_{\mu}]}=\cup\\{({}^{\lambda}\lambda)^{\mathbb{V}[{\mathbb{P}}_{\alpha}]}:\alpha<\mu\\}$. [Why? By $(*)_{2}+(*)_{1}$ clause (a) holds, for clauses (b),(c) use also the support in the iteration being $<\lambda$ recalling that $\mu,\kappa$ are regular $>\lambda$.] 1. $(*)_{4}$ in $\mathbb{V}^{{\mathbb{P}}_{\mu}},{\mathfrak{b}}_{\lambda}={\mathfrak{d}}_{\lambda}=\mu$ as witnessed by $\mathchoice{\oalign{$\displaystyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}=\langle\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}:\alpha<\mu\rangle$, in fact $\Vdash_{{\mathbb{P}}_{\alpha+1}}``\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}\in{}^{\lambda}\lambda$ dominates $({}^{\lambda}\lambda)^{\mathbb{V}[{\mathbb{P}}_{\alpha}]}$ modulo $J^{\text{bd}}_{\lambda}"$. [Why? Easy using $(*)_{3}(c)$.] 1. $(*)_{5}$ $\Vdash_{{\mathbb{P}}_{\mu+i+1}}``\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{i}\in\prod_{\varepsilon<\lambda}\theta_{\varepsilon}$ dominates $(\prod_{\varepsilon<\lambda}\theta_{\varepsilon})^{\mathbb{V}[{\mathbb{P}}_{\mu+i}]}"$, the order being modulo $J^{\text{bd}}_{\lambda}$. [Why? As in $\mathbb{V}^{{\mathbb{P}}_{\mu+i}}$ for each $g\in\prod_{\varepsilon<\lambda}\theta_{\varepsilon}$ the set $\\{(\eta,f)\in{\mathbb{Q}}_{\bar{\theta}}$ : for every $\varepsilon\in[\ell g(\eta),\lambda)$ we have $g(\varepsilon)\leq f(\varepsilon)\\}$ is a dense open subset of $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\mu+i}$.] 1. $(*)_{6}$ $\Vdash_{{\mathbb{P}}_{\mu+\kappa}}``\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}=\langle\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{i}:i<\kappa\rangle$ is $<_{J^{\text{bd}}_{\lambda}}$-increasing and cofinal in $(\prod_{\varepsilon<\lambda}\theta_{\varepsilon},<_{J^{\text{bd}}_{\lambda}})"$. [Why? By $(*)_{5}$ noting that $(\prod_{\varepsilon<\lambda}\theta_{\varepsilon})^{\mathbb{V}[{\mathbb{P}}_{\mu+\kappa}]}=\cup\\{(\prod_{\varepsilon<\lambda}\theta_{\varepsilon})^{\mathbb{V}[{\mathbb{P}}_{\mu+i}]}:i<\kappa\\}$ which holds by $(*)_{3}(b)$.] Now 1. $(*)_{7}$ $\Vdash_{{\mathbb{P}}_{\mu+\kappa}}$ “covλ(meagre) $\leq\kappa$”. [Why? As we can look at $\prod\limits_{\varepsilon<\lambda}\theta_{\varepsilon}$ instead333E.g. let $F:{}^{\lambda}2\rightarrow\prod\limits_{\varepsilon<\lambda}\theta_{\varepsilon}$ be $F(\eta)=\rho$ iff $\eta\in{}^{\lambda}2$ and for every $\varepsilon<\lambda,\rho(\varepsilon)=0$ iff $(\forall i<\theta_{\varepsilon})(\eta\sum\limits_{\zeta<\varepsilon}\theta_{\zeta}+i)=0)$ and $\rho(\varepsilon)=1+i$ iff $\eta(\sum\limits_{\zeta<\varepsilon}\theta_{\zeta}+i)=1\wedge(\forall j<i)(\eta(\sum\limits_{\zeta<\varepsilon}\theta_{\zeta}+j)=0)$. Now if $\prod\limits_{\varepsilon}\theta_{\varepsilon}=\cup\\{{\mathcal{U}}_{i}:i<\kappa\\}$, each ${\mathcal{U}}_{i}$ closed nowhere dense then $\langle F^{-1}({\mathcal{U}}_{i}):i<\kappa\rangle$ witnesses covλ(meagre) $\leq\kappa$. of ${}^{\lambda}2$ and for each $\varepsilon<\lambda,i<\kappa$ the set $B_{\varepsilon,i}=\\{\eta\in\prod_{\varepsilon<\lambda}\theta_{\varepsilon}$: for every $\zeta\in[\varepsilon,\lambda)$ we have $\eta(\zeta)\leq\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{i}(\zeta)<\theta_{\zeta}\\}$ is closed nowhere dense, and by $(*)_{6}$ $\mathbb{V}^{{\mathbb{P}}_{\mu+\kappa}}\models``\prod_{\zeta<\lambda}\theta_{\zeta}=\cup\\{B_{\varepsilon,i}:\varepsilon<\lambda,i<\kappa\\}"$.] Now we come to the main and last point 1. $(*)_{8}$ letting ${\mathcal{U}}_{*}=\\{\lambda^{+}(\gamma+1):\gamma<\kappa\\}$, it is forced, i.e. $\Vdash_{\mathbb{P}_{\mu+\kappa}}$, that $\mathbb{V}^{\prime}:=\mathbb{V}[\mathchoice{\oalign{$\displaystyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{f}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}},\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\restriction}{\mathcal{U}}_{*}]$ satisfies: 1. $(a)$ $\mathbb{V}^{\prime}$ has the same cardinals as $\mathbb{V}$ 2. $(b)$ the cofinality of a cardinal is the same in $\mathbb{V}^{\prime}$ and $\mathbb{V}$ 3. $(c)$ $({}^{\lambda>}\text{Ord})^{\mathbb{V}^{\prime}}=({}^{\lambda>}\text{Ord})^{\mathbb{V}}$ 4. $(d)$ if $\theta\geq\mu$ then $(2^{\theta})^{\mathbb{V}^{\prime}}=(2^{\theta})^{\mathbb{V}}$ 5. $(e)$ $(2^{\lambda})^{\mathbb{V}^{\prime}}=\mu$ 6. $(f)$ $\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\restriction}{\mathcal{U}}_{*}$ is $<_{J^{\text{bd}}_{\lambda}}$-increasing cofinal in $(\prod\limits_{i<\lambda}\theta_{i})^{\mathbb{V}^{\prime}}$. [Why? Straight forward.] 1. $(*)_{9}$ it is forced, i.e. $\Vdash_{{\mathbb{P}}_{\mu+\kappa}}$ that no $\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\in({}^{\lambda}\lambda)^{\mathbb{V}^{\prime}}$ dominate $\\{\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}:\alpha<\mu\\}$. We shall note that it suffices to prove $(*)_{9}$ for proving 1.3, and that $(*)_{9}$ holds, thus finishing. Why it suffices? As $\langle\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}:\alpha<\mu\rangle$ is $<_{J^{\text{bd}}_{\lambda}}$-increasing and cf$(\mu)=\mu>\lambda$, this implies ${\mathfrak{d}}_{\lambda}\geq\mu$, and this is the last piece missing. The rest of the proof is dedicated to proving that $(*)_{9}$ holds. Let $\mathbb{G}_{\mu}\subseteq{\mathbb{P}}_{\mu}$ be generic over $\mathbb{V}$ and so $\langle f_{\alpha}:\alpha<\mu\rangle=\langle\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}[\mathbb{G}_{\mu}]:\alpha<\mu\rangle$ is well defined. Now ${\mathbb{P}}_{\mu+\kappa}/\mathbb{G}_{\mu}$ is just the limit of the $(<\lambda)$-support iteration of $\langle{\mathbb{P}}_{\mu+i}/\mathbb{G}_{\mu},\mathchoice{\oalign{$\displaystyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\mu+j}:i\leq\kappa,j<\kappa\rangle$. Let $p\in{\mathbb{P}}_{\mu+\kappa}/\mathbb{G}_{\mu}$. For $i\leq\kappa$ let ${\mathbb{P}}_{0,i}={\mathbb{P}}_{\mu+i}/\mathbb{G},{\mathbb{Q}}_{0,i}$ be the ${\mathbb{P}}_{0,i}$-name of $\mathchoice{\oalign{$\displaystyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle{\mathbb{Q}}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\mu+i}$, i.e., of ${\mathbb{Q}}_{\bar{\theta}}$ in the universe $\mathbb{V}[\mathbb{G}_{\mu}]^{{\mathbb{P}}_{0,i}}$. We shall apply $\boxdot_{\lambda}$. Let $\gamma(*)=\kappa$ (but we shall use $\gamma(*)$ since the proof applies to any $\gamma(*)$ of cofinality $>\lambda$). The condition $\boxdot_{\lambda}$ is preserved by forcing by ${\mathbb{P}}_{\mu}$ recalling $(*)_{1}(\beta)$ so $\mathbb{V}[\mathbb{G}_{\mu}]=\mathbb{V}^{{\mathbb{P}}_{\mu}}$ satisfies $\boxdot_{\lambda}$. So it suffices to prove: 1. $(*)^{\prime}_{9}$ if $\mathbb{V}$ satisfies $\boxdot_{\lambda}$ and $\mathbb{q}=\langle{\mathbb{P}}_{0,i},\mathchoice{\oalign{$\displaystyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\mathbb{Q}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0,j}:i\leq\gamma(*),j<\gamma(*)\rangle$ is a $(<\lambda)$-support iteration, such that for every $j<\gamma(*)$ the forcing notion ${\mathbb{Q}}_{0,j}$ is $({\mathbb{Q}}_{\bar{\theta}})^{\mathbb{V}[{\mathbb{P}}_{0,j}]}$ and $\gamma(*)$ is a regular cardinal $>\delta(*),\lambda^{+}$ or just $\lambda^{+}\cdot\gamma(*)=\gamma(*)\wedge\text{ cf}(\gamma(*))\geq\lambda^{+}$ then it is forced, i.e. $\Vdash_{{\mathbb{P}}_{0,\gamma(*)}}$, that no $f\in({}^{\lambda}\lambda)^{\mathbb{V}[\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0}{\restriction}{\mathcal{U}}_{*}]}$ dominate $({}^{\lambda}\lambda)^{\mathbb{V}}$ letting $\bar{g}_{0}=\langle\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0,i}:i<\gamma(*)\rangle$ where $\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0,i}\in\prod\limits_{\varepsilon<\lambda}\theta_{\varepsilon}$ is the name of the generic for ${\mathbb{Q}}_{0,i}$ so $\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0,i}=\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\mu+i}$. [Why does $(*)^{\prime}_{9}$ suffice? We apply it with $\mathbb{V},\gamma(*)$ in $(*)^{\prime}_{9}$ standing for $\mathbb{V}^{{\mathbb{P}}_{\mu}}=\mathbb{V}[\mathbb{G}_{\mu}],\kappa$ here. So in $\mathbb{V}[\mathbb{G}_{\mu}]^{{\mathbb{P}}_{0,\gamma(*)}}=\mathbb{V}^{{\mathbb{P}}_{\mu+\kappa}}$, letting $f_{\alpha}=\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\alpha}[\mathbb{G}_{\mu}]$ for $\alpha<\mu$ we have: 1. $(a)$ $f_{\alpha}\in{}^{\lambda}\lambda$, for every $\alpha<\mu$ 2. $(b)$ $\bar{f}=\langle f_{\alpha}:\alpha<\mu\rangle$ is $<_{J^{\text{bd}}_{\lambda}}$-increasing cofinal in $\mathbb{V}$ 3. $(c)$ $\\{f_{\alpha}:\alpha<\mu\\}$ has no common $\leq_{J^{\text{bd}}_{\lambda}}$-upper bound in $\mathbb{V}[\bar{f},\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0}{\restriction}{\mathcal{U}}_{*}]$. This implies that $\Vdash_{{\mathbb{P}}_{\mu+\kappa}}``\mathbb{V}[\bar{f},\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\restriction}{\mathcal{U}}_{*}]$ satisfies ${{\mathfrak{d}}}_{\lambda}\geq\mu"$ as required.] For $i\leq\gamma(*)$ let ${\mathbb{P}}_{1,i}$ be the completion of ${\mathbb{P}}_{0,i}$ and let ${\mathbb{P}}^{\prime}_{i}={\mathbb{P}}_{2,i}$ be the complete subforcing of ${\mathbb{P}}_{1,\delta(*)(i+1)}$ generated by $g^{\prime}_{j}=\langle g^{\prime}_{j}:j<i\rangle=\langle\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0,\delta(*)(j+1)}:j<i\rangle$. We shall use the nice properties of ${\mathbb{P}}^{\prime}_{i},\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{i}$. Note that 1. $\boxplus_{1}$ $(a)\quad\langle\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{\gamma}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}^{\prime}_{\gamma(*)}$, i.e., if $\mathbb{G}$ is a subset of ${\mathbb{P}}^{\prime}_{\gamma(*)}$ generic over $\mathbb{V}$ and $g^{\prime}_{\gamma}=\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{\gamma}[\mathbb{G}]$ then $\mathbb{V}[\mathbb{G}]=\mathbb{V}[\langle g^{\prime}_{\gamma}:\gamma<\gamma(*)\rangle]$ 2. $(b)\quad$ if $g^{\prime\prime}_{\gamma}\in\prod\limits_{\zeta<\lambda}\theta_{\zeta}$ for $\gamma<\gamma(*)$ and the set $\\{(\gamma,\zeta):\gamma<\gamma(*)$ and $\zeta<\lambda$ and $g^{\prime\prime}_{\gamma}(\zeta)\neq g^{\prime}_{\gamma}(\zeta)\\}$ has cardinality $<\lambda$ then $\langle g^{\prime\prime}_{\gamma}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}^{\prime}_{\gamma(*)}$ 3. $(c)\quad{\mathbb{P}}^{\prime}_{\gamma+1}/{\mathbb{P}}^{\prime}_{\gamma}$ is equivalent to ${\mathbb{Q}}_{\bar{\theta}}^{\mathbb{V}[{\mathbb{P}}^{\prime}_{\gamma}]}$ 4. $(d)\quad$ if $\langle\zeta(\gamma):\gamma<\gamma(*)\rangle$ is an increasing sequence of ordinals $<\gamma(*)$, then $\langle g^{\prime}_{\zeta(\gamma)}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}^{\prime}_{\gamma(*)}$ 5. $(e)\quad$ if $\bar{\zeta}=\langle\zeta(\gamma):\gamma<\gamma(*)\rangle$ is an increasing sequence of ordinals $<\gamma(*)$, then the sequence $\langle g_{\mathbb{h}(\gamma,\bar{\zeta})}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}_{0,\gamma(*)}$ where we define $\mathbb{h}(\gamma,\bar{\zeta})<\gamma(*)$ for $\gamma<\gamma(*)$ by induction on $\gamma$ as: $\cup\\{\mathbb{h}(\beta,\bar{\zeta})+1:\beta<\gamma\\}$ if $\beta\notin{\mathcal{U}}_{*}$ and $\delta(*)(\zeta(\gamma)+1)$ if $\beta\in{\mathcal{U}}$. [Why? The serious point is clause (d) and (e) which is done similarly. For this it suffices to show that: if $\langle g_{\gamma}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}_{0,\gamma(*)}$ and $\langle\zeta(\gamma):\gamma<\gamma(*)\rangle$ is as there then not only $\langle g_{\zeta(\gamma)}:\gamma<\gamma(*)\rangle$ is generic for ${\mathbb{P}}^{\prime}_{\gamma(*)}$ but also $\langle g_{\delta(*)(\zeta(\gamma)+1)}:\gamma<\gamma(*)\rangle$ is. This holds and it straightforward translates to saying that the sequence $\langle\delta(*)(\gamma+1):\gamma<\gamma(*)\rangle$ and $\langle\delta(*)(\zeta(\gamma)+1):\gamma<\gamma(*)\rangle$ realizes the same ${\mathbb{L}}_{\lambda^{+},\lambda}$-type in the structure $(\gamma(*),<)$, which holds by Kino [Kin66]. See more in [Sh:F976]. We shall use $\boxplus_{1}$ freely.] To prove $(*)^{\prime}_{9}$ assume toward contradiction that this fails, so ${\mathbb{P}}^{\prime}_{\gamma(*)}$ satisfies the $\lambda^{+}$-c.c. and for some ${\mathbb{P}}^{\prime}_{\gamma(*)}$-name $\textstyle f$ $\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$ and $\lambda$-Borel function $\mathbb{B}$ and $\rho\in{}^{\lambda}\gamma(*)$, moreover $\rho\in{}^{\lambda}({\mathcal{U}}_{*})$ we have (noting: the “moreover” holds as $f\in({}^{\lambda}\lambda)^{\mathbb{V}[\mathchoice{\oalign{$\displaystyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\bar{g}$\crcr\vbox to0.60275pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{0}{\restriction}{\mathcal{U}}_{*}]})$ 1. $\circledast_{0}$ $p^{*}\Vdash_{{\mathbb{P}}^{\prime}_{\gamma(*)}}``\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\in{}^{\lambda}\lambda$ and dominates $({}^{\lambda}\lambda)^{\mathbb{V}}"$ and $\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}=\mathbb{B}(\langle g_{\rho(i)}:i<\lambda\rangle)$. Now we choose $\bar{N}=\langle N_{\varepsilon}:\varepsilon<\lambda\rangle$ such that 1. $\circledast_{1}$ $(a)\quad N_{\varepsilon}$ is as in $\boxdot_{\lambda}$ for the forcing notion ${\mathbb{P}}^{\prime}_{\gamma(*)}$ 2. $(b)\quad\bar{N}\restriction\varepsilon\in N_{\varepsilon}$ hence $\bigcup\limits_{\zeta<\varepsilon}N_{\zeta}\subseteq N_{\varepsilon}$ and $\lambda_{\varepsilon}:=N_{\varepsilon}\cap\lambda>\lambda^{-}_{\varepsilon}:=$ $\Sigma\\{\lambda_{\zeta}:\zeta<\varepsilon\\}$ 3. $(c)\quad\bar{\theta},\mathbb{q},p^{*},\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}},\mathbb{B},\rho$ belong to $N_{\varepsilon}$ 4. $(d)\quad$ let $\delta(\varepsilon)=\text{ otp}(\delta(*)\cap N_{\varepsilon})$ 5. $(e)\quad\kappa_{\varepsilon}=\kappa^{<\kappa_{\varepsilon}}_{\varepsilon}$ where $\kappa_{\varepsilon}=\text{ otp}(\kappa_{\varepsilon}\cap N_{\varepsilon})$. We can find $f^{*}\in{}^{\lambda}\lambda$, i.e. $\in({}^{\lambda}\lambda)^{\mathbb{V}}$, such that 1. $\circledast_{2}$ for arbitrarily large $\varepsilon<\lambda$ for some $\zeta\in[\lambda^{-}_{\varepsilon},\lambda_{\varepsilon})$ we have $f^{*}(\zeta)>\lambda_{\varepsilon}$. For $\varepsilon<\lambda$ let $(\lambda_{\varepsilon},\chi_{\varepsilon},\mathbb{j}_{\varepsilon},M_{\varepsilon},N^{\prime}_{\varepsilon},\mathbb{G}_{\varepsilon})$ be a witness for $(N_{\varepsilon},{\mathbb{P}}^{\prime}_{\gamma(*)})$ recalling Definition 1.5 so $\lambda_{\varepsilon}\in(\varepsilon,\lambda)$ is strongly inaccessible and $\varepsilon<\zeta<\lambda\Rightarrow\lambda_{\varepsilon}<\lambda_{\zeta}$, recalling $\circledast_{1}$ and $\delta(\varepsilon)=\mathbb{j}_{\varepsilon}(\delta(*))$, etc. Let 1. $\circledast_{3}$ $u_{\varepsilon}=N_{\varepsilon}\cap\gamma(*),\bar{\gamma}^{\varepsilon}=\langle\gamma_{i}(\varepsilon):i<i(\varepsilon)\rangle$ list $u_{\varepsilon}$ in increasing order and for $i<\text{ otp}(u_{\varepsilon})$, equivalently $i<\mathbb{j}_{\varepsilon}(\gamma(*))$ let $\eta^{\varepsilon}_{i}=(\mathbb{j}_{\varepsilon}(\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{i}))^{N^{\prime}_{\varepsilon}}[\mathbb{G}_{\varepsilon}]\in\prod\limits_{\zeta<\lambda_{\varepsilon}}\theta_{\zeta}$ and let $\bar{\eta}^{\varepsilon}=\langle\eta^{\varepsilon}_{i}:i<\text{ otp}(u_{\varepsilon})\rangle$. Note 1. $\circledast_{4}$ $(a)\quad\bar{\eta}^{\varepsilon}$ is generic for $(N^{\prime}_{\varepsilon},\mathbb{j}_{\varepsilon}({\mathbb{P}}^{\prime}_{\gamma(*)}))$, moreover 2. $(b)\quad$ for each $\varepsilon<\lambda$, if we change $\eta^{\varepsilon}_{i}(\zeta)$ (legally, i.e. $<\theta_{\zeta}$) for $<\lambda_{\varepsilon}$ pairs $(i,\zeta)\in\text{ otp}(u_{\varepsilon})\times\lambda_{\varepsilon}$ and get $\bar{\eta}^{\prime}$, then also $\bar{\eta}^{\prime}$ is generic for $(N^{\prime}_{\varepsilon},\mathbb{j}_{\varepsilon}({\mathbb{P}}^{\prime}_{\gamma(*)}))$ and $N^{\prime}_{\varepsilon}[\bar{\eta}^{\prime}]=M_{\varepsilon}$ 3. $(c)\quad$ like $\boxplus_{1}$ with $\mathbb{V},{\mathbb{P}}^{\prime}_{\gamma(*)},\lambda$ there standing for $N_{\varepsilon},\mathbb{j}_{\varepsilon}({\mathbb{P}}^{\prime}_{\gamma(*)}),\lambda_{\varepsilon}$ here. Hence 1. $\circledast^{\prime}_{4}$ for $\varepsilon<\lambda$, if $\bar{\eta}^{\prime}=\langle\nu_{i}:i<i(\varepsilon)\rangle$ where $i(\varepsilon)=\text{ otp}(u_{\varepsilon})$ is as in $\circledast_{4}(b)$, and $q\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ satisfies $i<i(\varepsilon)\Rightarrow q\Vdash_{{\mathbb{P}}^{\prime}_{\gamma(*)}}``\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{\gamma_{i}(\varepsilon)}{\restriction}\lambda_{\varepsilon}=\nu_{i}"$ then $q$ is $(N_{\varepsilon},{\mathbb{P}}^{\prime}_{\gamma(*)})$-generic naturally and $q\Vdash_{{\mathbb{P}}^{\prime}_{\gamma(*)}}``\mathbb{j}_{\varepsilon}$ can be extended naturally to an isomorphism from $N_{\varepsilon}[\mathchoice{\oalign{$\displaystyle G$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle G$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle G$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle G$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{{\mathbb{P}}^{\prime}_{\gamma(*)}}]=N_{\varepsilon}[\langle\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\gamma}:\gamma\in u_{\varepsilon}\rangle]$ onto $N^{\prime}_{\varepsilon}[\bar{\eta}^{\prime}]"$. [Why? Should be clear, see $\boxplus_{1}+\circledast_{4}(c)$.] By the assumption toward contradiction, $\circledast_{0}$, and ${\mathbb{P}}^{\prime}_{\gamma(*)}$ being $(<\lambda)$-strategically closed recalling $(*)_{1}(\beta)^{+}$, there are $\zeta(*),p^{**}$ and $p^{+}$ such that (recall $p^{*}\in{\mathbb{P}}^{\prime}_{\gamma(*)}=\lessdot{\mathbb{P}}_{0,\gamma(*)}$): 1. $\circledast_{5}$ $(a)\quad p^{*}\leq p^{**}\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ and $p^{**}\leq p^{+}\in{\mathbb{P}}_{0,\gamma(*)}$ 2. $(b)\quad\zeta(*)<\lambda$ 3. $(c)\quad p^{**}\Vdash_{{\mathbb{P}}^{\prime}_{\gamma(*)}}``f^{*}(\zeta)<\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}(\zeta)$ whenever $\zeta(*)\leq\zeta<\lambda"$ 4. $(d)\quad$ if $\gamma\in\text{ Dom}(p^{+})$ then $\eta^{p^{+}(\gamma)}$ is an object (not just a ${\mathbb{P}}^{\prime}_{\gamma}$-name) of length $\geq\zeta(*)$ (recall that $\eta^{p^{+}(\gamma)}$ is the trunk of the condition, see clause $(\alpha)(b)$ above). Note that possibly Dom$(p^{+})\nsubseteq\cup\\{u_{\varepsilon}:\varepsilon<\lambda\\}$. Choose $\varepsilon(*)<\lambda$ such that $\lambda_{\varepsilon(*)}>\zeta(*)+|\text{Dom}(p^{+})|$ and $\gamma\in\text{ Dom}(p^{+})\Rightarrow\varepsilon(*)>\ell g(\eta^{p^{+}(\gamma)})$ recalling clause (d) of $\circledast_{5}$ and $|\text{Dom}(p^{+})|<\lambda$ as $p^{+}\in{\mathbb{P}}_{0,\gamma(*)}$ and ${\mathbb{P}}_{0,\gamma(*)}$ is the limit of a $(<\lambda)$-support iteration. By $\circledast_{2}$ we can add $(\exists\zeta)[\lambda^{-}_{\varepsilon(*)}\leq\zeta<\lambda_{\varepsilon(*)}<f^{*}(\zeta)]$. Our intention is to find $q\in{\mathbb{P}}_{0,\gamma(*)}$ above $p^{+}$ which is above some $q^{\prime}\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ which is $(N_{\varepsilon(*)},{\mathbb{P}}^{\prime}_{\gamma(*)})$-generic and forces it to include a generic subset of $({\mathbb{P}}^{\prime}_{\gamma(*)})^{N_{\varepsilon(*)}}$ which is induced by some $\bar{\eta}^{\prime}$ as in $\circledast_{4}(b)$. Toward this in $\circledast_{6}$ below the intention is that $p^{+}_{i(*)}$ will serve as $q$. Let $i(*)=i(\varepsilon(*))$ and $\gamma_{i}=\gamma_{2,i}=\gamma_{\delta(*)(i+1)}(\varepsilon(*))$ for $i<i(*)$ so $\langle\gamma_{i}:i<i(*)\rangle$ list $u_{\varepsilon(*)}\cap{\mathcal{U}}_{*}$ in increasing order and let $\gamma_{i(*)}=\gamma(*)$ so $\\{\mathbb{j}_{\varepsilon(*)}(\gamma):\gamma\in u_{\varepsilon(*)}\\}=\mathbb{j}_{\varepsilon(*)}(\gamma(*))$ and $N_{\varepsilon(*)}\models``i(*)$ is a regular cardinal $>\lambda_{\varepsilon}$” hence $i(*)$ is really a regular cardinal so call it $\sigma$. Now we define a game $\Game$ as follows444The idea is to scatter the $\eta^{\varepsilon(*)}_{\gamma_{i}}$’s. Why not use the original places? as then we have a problem in $\circledast_{10}$.: 1. $\boxplus_{2}$ $(A)\quad$ each play lasts $i(*)+1$ moves and in the $i$-th move, 1. $(a)\quad$ if $i=j+1$ the antagonist player chooses $\xi(j)<\sigma$ such that $j_{1}<j\Rightarrow\zeta(j_{1})<\xi(j)$ 2. $(b)\quad$ then, if $i=j+1$ the protagonist chooses $\zeta(j)\in(\xi(j),\sigma)\cap{\mathcal{U}}_{*}$, but there are more restrictions implicit in $\boxplus_{3}$ 3. $(c)\quad$ in any case the protagnoist chooses $p^{+}_{i},\bar{\nu}^{i}$ such that $\boxplus_{3}$ below holds; 2. $(B)\quad$ in the end of the play the protagonist wins the play iff he always has a legal move and in the end $\\{\zeta(i):i<i(*)\\}\in N^{\prime}_{\varepsilon(*)}$; where 3. $\boxplus_{3}$ $(a)\quad p^{+}_{i}\in{\mathbb{P}}_{0,\gamma_{i}}$ 4. $(b)\quad$ if $j<i$ then ${\mathbb{P}}_{0,\gamma_{i}}\models``p^{+}_{j}\leq p^{+}_{i}"$ 5. $(c)\quad$ if $\gamma\in\cup\\{\text{Dom}(p^{+}_{j}):j<i\\}$ then $p^{+}_{i}\restriction\gamma\Vdash_{{\mathbb{P}}_{0,\gamma_{i}}}``\mathchoice{\oalign{$\displaystyle\eta$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{p^{+}_{i}(\gamma)}$ has length $\geq i(*)$ and $\geq\lambda_{\varepsilon(*)}"$ moreover $\mathchoice{\oalign{$\displaystyle\eta$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{p^{+}_{i}(\gamma_{j})}$ is an object, $\eta^{p^{+}_{i}(\gamma_{j})}$ for $j<i$ 6. $(d)\quad{\mathbb{P}}_{0,\gamma_{i}}\models``p^{+}\restriction\gamma_{i}\leq p^{+}_{i}"$ 7. $(e)\quad\bar{\nu}^{i}=\langle\nu_{\gamma_{j}}:j<i\rangle$ and $\nu_{\gamma_{j}}\in\prod\limits_{\iota<\lambda_{\varepsilon(*)}}\theta_{\iota}$ 8. $(f)\quad$ for $j<i$ we have $\nu_{\gamma_{j}}\trianglelefteq\eta^{p^{+}_{i}(\gamma_{j})}$ so $p^{+}_{i}\restriction\gamma_{j}\Vdash``\nu_{\gamma_{j}}\triangleleft\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{\gamma_{j}}"$ recalling $\boxplus_{1}$ 9. $(g)\quad$ for $j<i$ we have (recall $\bar{\eta}^{\varepsilon}$ from $\circledast_{3}$) 1. $(\alpha)\quad\nu_{\gamma_{j}}=\eta^{\varepsilon(*)}_{\gamma_{\zeta(j)}}$ recalling $\eta^{\varepsilon(*)}_{\gamma_{j}}$ is from $\circledast_{3}$ or 2. $(\beta)\quad\gamma_{j}\in\text{ Dom}(p^{+})$ and $\\{\iota<\lambda_{\varepsilon(*)}:\eta^{\varepsilon(*)}_{\zeta(j)}(\iota)\neq\nu_{\gamma_{j}}(\iota)\\}$ is a bounded subset of $\lambda_{\varepsilon(*)}$. We shall prove 1. $\circledast_{6}$ in the game $\Game$ 1. $(a)$ the antagonist has no winning strategy 2. $(b)$ in any move the protagonist has a legal move, moreover for any $\zeta(i)\in(\xi(i),\sigma)$ large enough the protagonist can choose it. Why $\circledast_{6}$ suffice: By clause (a) of $\circledast_{6}$ we can choose a play $\langle(\xi(i),\zeta(i),p^{+}_{i},\bar{\nu}^{i}):i\leq i(*)\rangle$ in which the protagonist wins. Recalling ${\mathbb{P}}^{\prime}_{\gamma(*)}\lessdot{\mathbb{P}}_{1,\gamma(*)}$ and ${\mathbb{P}}_{0,\gamma(*)}$ is a dense subforcing of ${\mathbb{P}}_{1,\gamma(*)}$, clearly 1. $\circledast_{7}$ there is $p$ such that 1. $(a)$ $p\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ 2. $(b)$ if ${\mathbb{P}}^{\prime}_{\gamma(*)}\models``p\leq p^{\prime}"$ then $p^{\prime},p^{+}$ are compatible in ${\mathbb{P}}_{0,\gamma(*)}$ 3. $(c)$ $p$ is above $p^{**}$ and it forces $\mathchoice{\oalign{$\displaystyle g$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle g$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle g$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{\prime}_{i}{\restriction}\lambda_{\varepsilon(*)}=\nu_{\gamma_{i}}$ for $i<\gamma(*)$. Then on the one hand 1. $\circledast^{\prime}_{7}$ $p\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ being above $p^{**}$ forces $f^{\gamma}\restriction[\zeta(*),\lambda)<\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\restriction[\zeta(*),\lambda)$ hence $f^{*}\restriction[\zeta(*),\lambda_{\varepsilon(*)})<\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\restriction[\zeta(*),\lambda_{\varepsilon(*)})$ recalling that $\zeta(*)<\lambda_{\varepsilon(*)}$. On the other hand, 1. $\circledast^{\prime\prime}_{7}$ $p$ is $(N_{\varepsilon(*)},{\mathbb{P}}^{\prime}_{\gamma(*)})$-generic. [Why? As it forces $\mathchoice{\oalign{$\displaystyle\eta$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle\eta$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}_{\gamma_{1,i}}\restriction\lambda_{\varepsilon(*)}=\nu_{\gamma_{i}}$ for $i<i(*)$ and $\langle\nu_{\gamma_{i}}:i<i(*)\rangle$ is (see $\circledast_{4}$) “almost equal” to $\langle\eta^{\varepsilon(*)}_{\zeta(i)}:i<i(*)\rangle$ which is a subsequence of the sequence from $\circledast_{3}$ and recalling clause (g) of $\boxplus_{3}$. That is $\\{(i,\iota):\iota<\lambda_{\varepsilon(*)},i<i(*)=\sigma$ and $\nu_{\gamma_{i}}(\iota)\neq\eta^{\varepsilon(*)}_{\zeta(i)}(\iota)\\}\subseteq\cup\\{\\{(i,\iota):\iota<\lambda_{\varepsilon(*)}$ and $\nu_{\gamma_{i}}(\iota)\neq\eta^{\varepsilon(*)}_{\zeta(i)}(\iota)\\}:\gamma\in u_{\varepsilon(*)}\cap\text{ Dom}(p^{+})\\}$ so is the union of $\leq|\text{Dom}(p^{+})|<\lambda_{\varepsilon(*)}$ sets each of cardinality $<\lambda_{\varepsilon(*)}$ hence is of cardinality $<\lambda_{\varepsilon(*)}$. Hence by $\circledast_{4}(c)+\boxplus_{1}(d)$ the sequence $\bar{\nu}^{i(*)}$ is generic for $(N_{\varepsilon(*)},{\mathbb{P}}^{\prime}_{\gamma(*)})$.] As $\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\in N_{\varepsilon(*)}$ it follows from $\circledast^{\prime\prime}_{7}$ that 1. $\circledast^{\prime\prime\prime}_{7}$ $p\Vdash``\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}\restriction\lambda_{\varepsilon(*)}$ is a function from $\lambda_{\varepsilon(*)}$ to $\lambda_{\varepsilon(*)}"$. Together $\circledast^{\prime}_{7}+\circledast^{\prime\prime\prime}_{7}$ gives a contradiction by the choice of $f^{*}$ in $\circledast_{2}$ and of $\varepsilon(*)$ above, hence it is enough to use $\circledast_{6}$. Why $\circledast_{6}$ is true: Let us prove $\circledast_{6}$; first for clause (a) choose any strategy st for the antagonist and fix a partial strategy st′ for the protagonist choosing $(p^{+}_{i},\bar{\nu}^{i})$ from the previous choices and $\zeta(i)$ if relevant and possible. So the only freedom left is for the protagonist to choose the $\zeta(i)$. So we have in $\mathbb{V}$ a function $F:{}^{\sigma>}(i(*))\rightarrow\sigma$ such that: 1. $(*)_{F}$ playing the game such that the antagonist uses st and the protagonist uses st′, arriving to the $i$-th move, $\bar{\zeta}=\langle\zeta(j):j<i\rangle$ is well defined and for the protagonist any choice $\zeta_{i}\in(F(\bar{\zeta}),\sigma)$ is legal. Now we have to find an increasing sequence $\bar{\zeta}=\langle\zeta(i):i<i(*)\rangle$ such that $F(\bar{\zeta}{\restriction}i)<\zeta(i)\in{\mathcal{U}}_{*}$ and $\bar{\zeta}\in N^{\prime}_{\varepsilon(*)}$. As $F\in{\mathcal{H}}(\chi_{\varepsilon})$ and ${\mathcal{H}}(\chi_{\varepsilon})=N^{\prime}_{\varepsilon}[\mathbb{G}_{\varepsilon}]$ where $\mathbb{G}_{\varepsilon}$ is a subset of $\mathbb{j}_{\varepsilon}({\mathbb{P}}^{\prime}_{\gamma(*)})\in N^{\prime}_{\varepsilon}$ and $\mathbb{j}_{\varepsilon}({\mathbb{P}}_{0,\gamma(*)})$ satisfies the $\lambda^{+}_{\varepsilon}$-c.c. and $\sigma=\text{ cf}(\sigma)>\lambda_{\varepsilon}$ this is possible. We are left with proving $\circledast_{6}(b)$. Case 1: $i=0$. Let $p^{+}_{0}=p^{+}\restriction\gamma_{0}$. Case 2: $i$ limit. By clauses (a) and (b), there is $p^{+}_{i}\in{\mathbb{P}}_{0,\gamma_{i}}$ which is an upper bound (even l.u.b.) of $\\{p^{+}_{j}:j<i\\}$ and it is easily as required. Also $\bar{\nu}^{i}$ is well defined and as required. Case 3: $i=j+1$ and $\gamma_{j}\notin\text{ Dom}(p^{+})$. Clearly $\gamma_{i}=\gamma_{j}+\delta(*)$ and $\gamma_{j}\in u_{\varepsilon(*)}$. As in case 4 below but easier by the properties of the iteration. Case 4: $i=j+1$ and $\gamma_{j}\in\text{ Dom}(p^{+})$ Again $\gamma_{i}=\gamma_{j}+\delta(*)$ and $\gamma_{j}\in u_{\varepsilon(*)}$. First we find $p^{\prime}_{j}$ such that: 1. $\circledast_{8}$ $(a)\quad p^{+}_{j}\leq p^{\prime}_{j}\in{\mathbb{P}}_{0,\gamma_{j}}$ 2. $(b)\quad$ if $\gamma\in\text{ Dom}(p^{+}_{j})$ then $p^{\prime}_{j}\restriction\gamma\Vdash``\ell g(\eta^{p^{\prime}_{j}(\gamma)})>i"$ 3. $(c)\quad p^{\prime}_{j}$ forces 555recall that $\eta^{p^{*}(\gamma)}$ is an object, not a name and $p^{+}_{j}$ is $(N_{\varepsilon(*)},{\mathbb{P}}^{\prime}_{\gamma_{j}})$-generic a value to the pair $(\eta^{p^{+}(\gamma_{i})},\mathchoice{\oalign{$\displaystyle f$\crcr\vbox to0.86108pt{\hbox{$\displaystyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\textstyle f$\crcr\vbox to0.86108pt{\hbox{$\textstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}{\oalign{$\scriptscriptstyle f$\crcr\vbox to0.86108pt{\hbox{$\scriptscriptstyle{\tilde{\mkern-3.0mu}\mkern 3.0mu}{}$}\vss}}}^{p^{+}(\gamma_{j})}\restriction\lambda_{\varepsilon(*)})$; we call this pair $q_{j}$. This should be clear. Second 1. $\circledast_{9}$ $p^{+}_{j}$ hence $p^{\prime}_{j}$ is $(N_{\varepsilon(*)},{\mathbb{P}}^{\prime}_{\gamma_{j}})$-generic and $\langle\nu_{\gamma_{j(1)}}:j(1)<j\rangle$ induces the generic. [Why? As in the proof of $\circledast^{\prime\prime}_{7}$ above when we assume that we have carried the induction, by $\boxplus_{2}$, clause (g) and $\circledast_{4}$.] Now 1. $\circledast_{10}$ $(a)\quad f^{q_{j}}\in(\prod_{\zeta<\lambda_{\varepsilon(*)}}\theta_{\zeta})^{N^{\prime}_{\varepsilon(*)}[\bar{\nu}^{j}]}$ 2. $(b)\quad$ for some $\zeta\in(\xi(i),\sigma)$ we have 1. $\bullet\quad f^{q_{j}}\leq\eta^{\varepsilon(*)}_{\zeta}$ 2. $\bullet\quad f^{q_{j}}\in N^{\prime}_{\varepsilon(*)}[\bar{\eta}^{\varepsilon(*)}{\restriction}\zeta]$ 3. $\bullet\quad\langle\zeta(j_{1}):j_{1}\langle j\rangle\in N^{\prime}_{\varepsilon(*)}[\bar{\eta}^{\varepsilon(*)}{\restriction}\zeta]$. 3. $(c)\quad\eta^{q_{j}}\triangleleft f^{q_{j}}$. [Why? Clause (a) follows from clause (b) and clause (b) should be clear by $\circledast_{9}$ as we can choose $\zeta(i)$ large enough recalling $\circledast_{6}$. Also clause (c) follows from (b).] Now we choose $\zeta(j)$ as in clause (b) of $\circledast_{10}$ and $\nu_{j}\in\prod\limits_{\varepsilon<\lambda_{\varepsilon(*)}}\theta_{\varepsilon}$ such that $\eta^{p^{+}(j)}\triangleleft\nu_{j},f^{q_{j}}\leq\nu_{j}$ and $\\{\iota<\lambda_{\varepsilon(*)}:\nu_{j}(\iota)\neq\eta^{\varepsilon(*)}_{\zeta(j)}\\}$ is a bounded subset of $\lambda_{\varepsilon(*)}$. Next choose $p^{+}_{i}\in{\mathbb{P}}^{\prime}_{\gamma(*)}$ such that $p^{+}_{i}{\restriction}\gamma_{j}=p^{\prime}_{j},\eta^{p^{+}_{i}(\gamma_{i})}=\nu_{j}$ and $f^{p^{+}_{i}(\gamma_{i})}{\restriction}[\lambda_{\varepsilon},\lambda)=f^{p^{+}(\gamma)}{\restriction}[\lambda_{\varepsilon},\lambda)$. So we have carried the induction hence proved $\circledast_{6}$ so we are done. ∎ ## References * [Bar87] Tomek Bartoszyński, _Combinatorial aspects of measure and category_ , Fundamenta Mathematicae 127 (1987), 225–239. * [Kin66] Akiko Kino, _On definability of ordinals in logic with infinitely long expressions_ , Journal of Symbolic Logic 31 (1966), 365–375. * [Lan92] A. Landver, _Baire numbers, uncountable cohen sets and perfect-set forcing_ , Journal of Symbolic Logic 57 (1992), 1086–1107. * [Lav78] Richard Laver, _Making the supercompactness of $\kappa$ indestructible under $\kappa$-directed closed forcing_, Israel J. of Math. 29 (1978), 385–388. * [Mil82] Arnold W. Miller, _A characterization of the least cardinal for which the baire category theorem fails_ , Proceedings of the American Mathematical Society 86 (1982), 498–502. * [vD84] Eric K. van Douwen, _The integers and topology_ , Handbook of Set-Theoretic Topology (K. Kunen and J. E. Vaughan, eds.), Elsevier Science Publishers, 1984, pp. 111–167. * [Sh:80] Saharon Shelah, _A weak generalization of MA to higher cardinals_ , Israel Journal of Mathematics 30 (1978), 297–306. * [CuSh:541] James Cummings and Saharon Shelah, _Cardinal invariants above the continuum_ , Annals of Pure and Applied Logic 75 (1995), 251–268, math.LO/9509228. * [Sh:546] Saharon Shelah, _Was Sierpiński right? IV_ , Journal of Symbolic Logic 65 (2000), 1031–1054, math.LO/9712282. * [MtSh:804] Pierre Matet and Saharon Shelah, _Positive partition relations for $P_{\kappa}(\lambda)$_, Preprint, math.LO/0407440. * [Sh:F976] Saharon Shelah, _Nice logics_. * [Sh:F979] by same author, _Iterating reasonable $\lambda$-complete definable forcing_.
arxiv-papers
2009-04-05T20:36:54
2024-09-04T02:49:01.710537
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/4.0/", "authors": "Saharon Shelah", "submitter": "shlhetal", "url": "https://arxiv.org/abs/0904.0817" }
0904.0833
# On the Rate of Convergence for the Pseudospectral Optimal Control of Feedback Linearizable Systems ††thanks: The research was supported in part by AFOSR and AFRL Wei Kang Department of Applied Mathematics Naval Postgraduate School Monterey, CA 93943 wkang@nps.edu ###### Abstract Over the last decade, pseudospectral (PS) computational methods for nonlinear constrained optimal control have been applied to many industrial-strength problems, notably the recent zero-propellant-maneuvering of the International Space Station performed by NASA. In this paper, we prove a theorem on the rate of convergence for the optimal cost computed using PS methods. It is a first proved convergence rate in the literature of PS optimal control. In addition to the high-order convergence rate, two theorems are proved for the existence and convergence of the approximate solutions. This paper contains several essential differences from existing papers on PS optimal control as well as some other direct computational methods. The proofs do not use necessary conditions of optimal control. Furthermore, we do not make coercivity type of assumptions. As a result, the theory does not require the local uniqueness of optimal solutions. In addition, a restrictive assumption on the cluster points of discrete solutions made in existing convergence theorems are removed. ## 1 Introduction Despite the fact that optimal control is one of the oldest problems in the history of control theory, practical tools of solving nonlinear optimal control problems are limited. Preferably, a feedback control law is derived from a solution to the famously difficult Hamilton-Jacobi-Bellman (HJB) equation. However, analytic solutions of this partial differential equation can rarely be found for systems with nonlinear dynamics. Numerical approximation of such solutions suffers from the well-known curse of dimensionality and it is still an open problem for systems with moderately high dimension. A practical alternative is to compute one optimal trajectory at a time so that the difficulty of solving HJB equations is circumvented. Then this open-loop optimal control can be combined with an inner-loop tracking controller; or it can be utilized as a core instrument in a real-time feedback control architecture such as a moving horizon feedback. A critical challenge in this approach is to develop reliable and efficient computational methods that generate the required optimal trajectories. In this paper, we focus on some fundamental issues of pseudospectral computational optimal control methods. As a result of significant progress in large-scale computational algorithms and nonlinear programming, the so-called direct computational methods have become popular for solving nonlinear optimal control problems [1, 2, 17], particularly in aerospace applications [16, 18]. In simple terms, in a direct method, the continuous-time problem of optimal control is discretized, and the resulting discretized optimization problem is solved by nonlinear programming algorithms. Over the last decade, pseudospectral (PS) methods have emerged as a popular direct methods for optimal control. They have been applied to many industrial-strength problems, notably the recent attitude maneuvers of the International Space Station performed by NASA. By following an attitude trajectory developed using PS optimal control, the International Space Station (ISS) was maneuvered 180 degrees on March 3, 2007, by using the gyroscopes equipped on the ISS without propellant consumption. This single maneuver have saved NASA about one million dollars’ worth of fuel [12]. The Legendre PS optimal control method has already been developed into software named DIDO, a MATLAB based package commercially available [19]. In addition, the next generation of the OTIS software package [15] will have the Legendre PS method as a problem solving option. PS methods have been widely applied in scientific computation for models governed by partial differential equations. The method is well known for being very efficient in approximating solutions of differential equations. However, despite its success and several decades of development, the intersection between PS methods and nonlinear optimal control becomes an active research area only after the mid-1990’s ([5, 6]). As yet, many fundamental theoretical issues are still widely open. For the last decade, active research has been carried out in the effort of developing a theoretical foundation for PS optimal control methods. Among the research focuses, there are three fundamental issues, namely the state and costate approximation, the existence and convergence of approximate solutions, and the convergence rate. The general importance of these issues is not limited to PS methods. They are essential to other computational methods suchlike those based on Euler [10] and Runge-Kutta [9] discretization. Similar to other direct computational optimal control methods, PS method are based upon the Karush-Kuhn-Tucker (KKT) conditions rather than the Pontryagin’s Minimum Principle (MPM). In [6] and [8], a covector mapping was derived between the costate from KKT condition and the costate from PMP. The covector mapping facilitates a verification and validation of the computed solution. For the problem of convergence, some theorems were published in [7]; and then the results were generalized in [13] to problems with non-smooth control. Among the three fundamental issues mentioned above, the most belated activity of research is on the rate of convergence. In fact, there have been no results published on the convergence rate for PS optimal control methods. Although some results on the issue of convergence were proved in [7] and [13], a main drawback of these results is the strong assumption in which the derivatives of the discrete approximate solutions are required to converge uniformly. In this paper, we prove a rate of convergence for the approximate optimal cost computed using PS methods. Then, we prove theorems on existence and convergence without the restrictive assumption made in [7] and [13]. In addition to the high-order convergence rate addressed in Section 3, which is the first proved convergence rate in the literature of PS optimal control, this paper contains several essential differences from existing papers on PS optimal control as well as some other direct computational methods. First of all, the proof is not based on necessary conditions of optimal control. Furthermore, we do not make coercivity type of assumptions. As a result, the theory does not require the local uniqueness of optimal solutions. Therefore, it is applicable to problems with multiple optimal solutions. Secondly, the proof is not build on the bases of consistent approximation theory [17]. Thus, we can remove the assumption in [7] and [13] on the existence of cluster points for the derivatives of discrete solutions. The key that makes these differences possible is that we introduce a set of sophisticated regularization conditions in the discretization so that the computational algorithm has a greater control of the boundedness of the approximate solutions and their derivatives. Different from the existing results in the literature of direct methods for optimal control, the desired boundedness is achieved not by making assumptions on the original system, but by implementing specially designed search region for the discrete problem of nonlinear programming. This new boundary of search region automatically excludes possible bad solutions that are numerically unstable. The paper is organized as follows. In Section 2, the formulations of the optimal control problem and its PS discretization are introduced. In 3, we prove two theorems on the rate of convergence. In Section 4, two theorems on the existence and convergence are proved. ## 2 Problem Formulation For the rate of convergence, we focus on the following Bolza problem of control systems in the feedback linearizable normal form. A more complicated problem with constraints is studied in Section 4 for the existence and convergence of approximate solutions. Problem B: Determine the state-control function pair $(x(t),u(t))$, $x\in\Re^{r}$ and $u\in\Re$, that minimizes the cost function $\displaystyle J(x(\cdot),u(\cdot))$ $\displaystyle=$ $\displaystyle\int_{-1}^{1}F(x(t),u(t))\ dt+E(x(-1),x(1))$ (2.1) subject to the following differential equations and initial condition $\displaystyle\left\\{\begin{array}[]{lll}\dot{x}_{1}=x_{2}\\\ \;\;\;\vdots\\\ \dot{x}_{r-1}=x_{r}\\\ \dot{x}_{r}=f(x)+g(x)u\end{array}\right.$ (2.6) $\displaystyle x(-1)=x_{0}$ (2.7) where $x\in\Re^{r}$, $u\in\Re$, and $F:\Re^{r}\times\Re\to\Re$, $E:\Re^{r}\times\Re^{r}\to\Re$, $f:\Re^{r}\to\Re$, and $g:\Re^{r}\to\Re$ are all Lipschitz continuous functions with respect to their arguments. In addition, we assume $g(x)\neq 0$ for all $x$. Throughout the paper we make extensive use of Sobolev spaces, $W^{m,p}$, that consists of functions, $\xi:[-1,1]\to\mathbb{R}$ whose $j$-th order weak derivative, $\xi^{(j)}$, lies in $L^{p}$ for all $0\leq j\leq m$ with the norm, $\parallel\xi\parallel_{W^{m,p}}\quad=\sum_{j=0}^{m}\parallel\xi^{(j)}\parallel_{L^{p}}$ In this paper, we only consider the problems that have at least one optimal solution in which $x_{r}^{\ast}(t)$ has bounded $m$-th order weak derivative, i.e. $x_{r}^{\ast}(t)$ is in $W^{m,\infty}$. For some results, we assume $m\geq 3$. For others, $m$ is smaller. Unless the term ‘strong derivative’ is emphasized, all derivatives in the paper are in the weak sense. The PS optimal control method addressed in this paper is an efficient direct method. In typical direct methods, the original optimal control problem, not the associated necessary conditions, is discretized to formulate a nonlinear programming problem. The accuracy of the discretization is largely determined by the accuracy of the underlying approximation method. Given any function $f(t):[a,b]\rightarrow\Re$, a conventional method of approximation is to interpolate at uniformly spaced nodes: $t_{0}=a$, $t_{1}=(b-a)/N$, $\cdots$, $t_{N}=b$. However, it is known that uniform spacing is not efficient. More sophisticated node selection methods are able to achieve significantly improved accuracy with fewer nodes. It is important to emphasize that, for optimal control problems, the rate of convergence is not merely an issue of efficiency; more importantly it is about feasibility. An increased number of nodes in discretization results in a higher dimension in the nonlinear programming problem. A computational method becomes practically infeasible when the dimension and complexity of the nonlinear programming exceed the available computational power. In a PS approximation based on Legendre-Gauss- Lobatto (LGL) quadrature nodes, a function $f(t)$ is approximated by $N$-th order Lagrange polynomials using the interpolation at these nodes. The LGL nodes, $t_{0}=-1<t_{1}<\cdots<t_{N}=1$, are defined by $\begin{array}[]{llll}t_{0}=-1,\;\;t_{N}=1,\mbox{ and }\\\ \mbox{for }k=1,2,\ldots,N-1,t_{k}\mbox{ are the roots of }\dot{L}_{N}(t)\end{array}$ where $\dot{L}_{N}(t)$ is the derivative of the $N$-th order Legendre polynomial $L_{N}(t)$. The discretization works in the interval of $[-1,1]$. An example of LGL nodes with $N=16$ is shown in Figure 1. Figure 1: LGL nodes $N=16$ It was proved in approximation theory that the polynomial interpolation at the LGL nodes converges to $f(t)$ under $L^{2}$ norm at the rate of $1/N^{m}$, where $m$ is the smoothness of $f(t)$ (see for instance [4] Section 5.4). If $f(t)$ is $C^{\infty}$, then the polynomial interpolation at the LGL nodes converges at a spectral rate, i.e. it is faster than any given polynomial rate. This is a very impressive convergence rate. PS methods have been widely applied in scientific computation for models governed by partial differential equations, such as complex fluid dynamics. However, PS optimal control has several fundamental differences from the computation of PDEs. Solving optimal control problems asks for the approximation of several objects collectively, including the differential equation that defines the control system, the integration in the cost function, and the state and control trajectories. In addition to the various types of approximations, a nonlinear programming must be applied to the overall discretized optimization problem to find an approximate optimal control. All these factors may deteriorate the final approximate solution. The existing theory of PS approximation of differential equations is not applicable. New theory needs to be developed for the existence, convergence, and the rate of convergence for optimal control problems. In the following, we introduce the notations used in this paper. Then, the discretized nonlinear programming problem is formulated. In a PS optimal control method, the state and control functions, $x(t)$ and $u(t)$, are approximated by $N$-th order Lagrange polynomials based on the interpolation at the LGL quadrature nodes. In the discretization, the state variables are approximated by the vectors $\bar{x}^{Nk}\in\Re^{r}$, i.e. $\bar{x}^{Nk}=\left[\begin{array}[]{cccccccccccccc}\bar{x}_{1}^{Nk}\\\ \bar{x}_{2}^{Nk}\\\ \vdots\\\ \bar{x}_{r}^{Nk}\end{array}\right]$ is an approximation of $x(t_{k})$. Similarly, $\bar{u}^{Nk}$ is the approximation of $u(t_{k})$. Thus, a discrete approximation of the function $x_{i}(t)$ is the vector $\bar{x}_{i}^{N}=\left[\begin{array}[]{cccccccccccccc}\bar{x}_{i}^{N1}&\bar{x}_{i}^{N2}&\cdots&\bar{x}_{i}^{NN}\end{array}\right]$ A continuous approximation is defined by its polynomial interpolation, denoted by $x_{i}^{N}(t)$, i.e. $\displaystyle x_{i}(t)$ $\displaystyle\approx$ $\displaystyle x_{i}^{N}(t)=\sum_{k=0}^{N}\bar{x}_{i}^{Nk}\phi_{k}(t),$ (2.8) where $\phi_{k}(t)$ is the Lagrange interpolating polynomial [4]. Instead of polynomial interpolation, the control input is approximated by the following non-polynomial interpolation $\displaystyle u^{N}(t)=\displaystyle\frac{\dot{x}_{r}^{N}(t)-f(x^{N}(t))}{g(x^{N}(t))}$ (2.9) In the notations, the discrete variables are denoted by letters with an upper bar, such as $\bar{x}^{Nk}_{i}$ and $\bar{u}^{Nk}$. If $k$ in the superscript and/or $i$ in the subscript are missing, it represents the corresponding vector or matrix in which the indices run from minimum to maximum. For example, $\displaystyle\bar{x}^{N}_{i}$ $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}\bar{x}_{i}^{N0}&\bar{x}_{i}^{N1}&\cdots&\bar{x}_{i}^{NN}\end{array}\right]$ $\displaystyle\bar{x}^{Nk}$ $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}\bar{x}_{1}^{Nk}\\\ \bar{x}_{2}^{Nk}\\\ \vdots\\\ \bar{x}_{r}^{Nk}\end{array}\right]$ $\displaystyle\bar{x}^{N}$ $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}\bar{x}_{1}^{N0}&\bar{x}_{1}^{N1}&\cdots&\bar{x}_{1}^{NN}\\\ \bar{x}_{2}^{N0}&\bar{x}_{2}^{N1}&\cdots&\bar{x}_{2}^{NN}\\\ \vdots&\vdots&\vdots&\vdots\\\ \bar{x}_{r}^{N0}&\bar{x}_{r}^{N1}&\cdots&\bar{x}_{r}^{NN}\end{array}\right]$ Similarly, $\bar{u}^{N}=\left[\begin{array}[]{cccccccccccccc}\bar{u}^{N0}&\bar{u}^{N1}&\cdots&\bar{u}^{NN}\end{array}\right]$ Given a discrete approximation of a continuous function, the interpolation is denoted by the same notation without the upper bar. For example, $x_{i}^{N}(t)$ in (2.8), $u^{N}(t)$ in (2.9). The superscript $N$ represents the number of LGL nodes used in the approximation. Throughout this paper, the interpolation of $(\bar{x}^{N},\bar{u}^{N})$ is defined by (2.8)-(2.9), in which $u^{N}(t)$ is not necessarily a polynomial. It is proved in Lemma 5 that (2.9) is indeed an interpolation. Existing results in the analysis of spectral methods show that PS method is an approach that is easy and accurate in the approximation of smooth functions, integrations, and differentiations, all critical to optimal control problems. For differentiation, the derivative of $x^{N}_{i}(t)$ at the LGL node $t_{k}$ is easily computed by the following matrix multiplication [4] $\displaystyle\left[\begin{array}[]{cccccccccccccc}\dot{x}_{i}^{N}(t_{0})&\dot{x}_{i}^{N}(t_{1})&\cdots&\dot{x}_{i}^{N}(t_{N})\end{array}\right]^{T}=D(\bar{x}^{N}_{i})^{T}$ (2.14) where the $(N+1)\times(N+1)$ differentiation matrix $D$ is defined by $\displaystyle D_{ik}$ $\displaystyle=$ $\displaystyle\left\\{\begin{array}[]{ll}\frac{L_{N}(t_{i})}{L_{N}(t_{k})}\frac{1}{t_{i}-t_{k}},&\mbox{if}\ \ i\neq k;\\\ \\\ -\frac{N(N+1)}{4},&\mbox{if}\ \ i=k=0;\\\ \\\ \frac{N(N+1)}{4},&\mbox{if}\ \ i=k=N;\\\ \\\ 0,&\mbox{otherwise}\end{array}\right.$ The cost functional $J[x(\cdot),u(\cdot)]$ is approximated by the Gauss- Lobatto integration rule, $\displaystyle J[x(\cdot),u(\cdot)]\ \approx\ \bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ $\displaystyle=$ $\displaystyle\sum_{k=0}^{N}F(\bar{x}^{Nk},\bar{u}^{Nk})w_{k}+E(\bar{x}^{N0},\bar{x}^{NN})$ where $w_{k}$ are the LGL weights defined by $\displaystyle w_{k}$ $\displaystyle=$ $\displaystyle\frac{2}{N(N+1)}\frac{1}{[L_{N}(t_{k})]^{2}},$ The approximation is so accurate that it has zero error if the integrand function is a polynomial of degree less than or equal to $2N-1$, a degree that is almost a double of the number of nodes [4]. Now, we are ready to define Problem ${\rm B}^{\rm N}$, a PS discretization of Problem B. For any integer $m_{1}>0$, let $\\{a_{0}^{N}(m_{1}),a_{1}^{N}(m_{1}),\cdots,a_{N-r-m_{1}+1}^{N}(m_{1})\\}$ denote the coefficients in the Legendre polynomial expansion for the interpolation polynomial of the vector $\bar{x}_{r}^{N}(D^{T})^{m_{1}}$. Note that the interpolation of $\bar{x}_{r}^{N}(D^{T})^{m_{1}}$ equals the polynomial of $\frac{d^{m_{1}}x_{r}^{N}(t)}{dt^{m_{1}}}$. Thus, there are only $N-r-m_{1}+2$ nonzero spectral coefficients because it is proved in Section 3 that the order of $\frac{d^{m_{1}}x^{N}_{r}(t)}{dt^{m_{1}}}$ is at most degree of $N-r-m_{1}+1$. These coefficients depend linearly on $\bar{x}_{r}^{N}$ [3], $\begin{array}[]{llllllllll}{\tiny\left[\begin{array}[]{cccccccccccccc}a^{N}_{0}(m_{1})\\\ \vdots\\\ a^{N}_{N-r-m_{1}+1}(m_{1})\end{array}\right]=}\\\ {\tiny\left[\begin{array}[]{cccccccccccccc}\frac{1}{2}&&\\\ &\ddots&\\\ &&N-r- m_{1}+1+\frac{1}{2}\end{array}\right]\left[\begin{array}[]{cccccccccccccc}L_{0}(t_{0})&\cdots&L_{0}(t_{N})\\\ &\vdots&\\\ L_{N-r-m_{1}+1}(t_{0})&\cdots&L_{N-r- m_{1}+1}(t_{N})\end{array}\right]\left[\begin{array}[]{cccccccccccccc}w_{0}&&\\\ &\ddots&\\\ &&w_{N}\\\ \end{array}\right]D^{m_{1}}\left[\begin{array}[]{cccccccccccccc}\bar{x}^{N0}_{r}\\\ \vdots\\\ \bar{x}^{NN}_{r}\\\ \end{array}\right]}\end{array}$ (2.16) The PS discretization of Problem ${\rm B}^{\rm N}$is defined as follows. Problem ${\bf B}^{\bf N}$: Find $\bar{x}^{Nk}\in\Re^{r}$ and $\bar{u}^{Nk}\in\Re$, $k\ =\ 0,1,\ldots,N$, that minimize $\displaystyle\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ $\displaystyle=$ $\displaystyle\sum_{k=0}^{N}F(\bar{x}^{Nk},\bar{u}^{Nk})w_{k}+E(\bar{x}^{N0},\bar{x}^{NN})$ (2.17) subject to $\displaystyle\left\\{\begin{array}[]{rcl}D(\bar{x}_{1}^{N})^{T}&=&(\bar{x}_{2}^{N})^{T}\\\ D(\bar{x}_{2}^{N})^{T}&=&(\bar{x}_{3}^{N})^{T}\\\ &\vdots&\\\ D(\bar{x}_{r-1}^{N})^{T}&=&(\bar{x}_{r}^{N})^{T}\\\ D(\bar{x}_{r}^{N})^{T}&=&\left[\begin{array}[]{cccccccccccccc}f(\bar{x}^{N0})+g(\bar{x}^{N0})\bar{u}^{N0}\\\ \vdots\\\ f(\bar{x}^{NN})+g(\bar{x}^{NN})\bar{u}^{NN}\end{array}\right]\\\ \end{array}\right.$ (2.26) $\displaystyle\bar{x}^{N0}=x_{0}$ (2.27) $\displaystyle\underline{{\boldsymbol{b}}}\leq\left[\begin{array}[]{cccccccccccccc}\bar{x}^{Nk}\\\ \bar{u}^{Nk}\end{array}\right]\ \leq\ \bar{\boldsymbol{b}},\;\;\;\;\mbox{ for all }0\leq k\leq N$ (2.30) $\displaystyle\underline{{\boldsymbol{b}}}_{j}\leq\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{j}(\bar{x}_{r}^{N})^{T}\ \leq\bar{\boldsymbol{b}}_{j},\mbox{ if }1\leq j\leq m_{1}-1\mbox{ and }m_{1}\geq 2$ (2.32) $\displaystyle\displaystyle\sum_{n=0}^{N-r- m_{1}+1}|a^{N}_{n}(m_{1})|\leq{\boldsymbol{d}}$ (2.33) Comparing to Problem B, (2.26) is the discretization of the control system defined by the differential equation. The regularization condition (2.33) assures that the derivative of the interpolation up to the order of $m_{1}$ is bounded. It is proved in the following sections that the integer $m_{1}$ is closely related to the convergence rate. The inequalities (2.30), (2.32) and (2.33) are regularization conditions that do not exist in Problem B. It is proved in the next few sections that these additional constraints do not affect the feasibility of Problem ${\rm B}^{\rm N}$. Therefore, it does not put an extra limit to the family of problems to be solved. In searching for a discrete optimal solution, it is standard for software packages of nonlinear programming to require a search region. Typically, the search region is defined by a constraint (2.30). However, this box-shaped region may contain solutions that are not good approximations of the continuous-time solution. To guarantee the rate of convergence, the search region is refined to a smaller one by imposing constraints (2.32) and (2.33). It is proved in this paper that there always exist feasible solutions that satisfy all the constraints and the optimal cost converges, provided the upper and lower bounds are large enough. In (2.32), $\underline{{\boldsymbol{b}}}_{j}$ and $\bar{\boldsymbol{b}}_{j}$ represent the bounds of initial derivatives. In (2.33), ${\boldsymbol{d}}$ is the bound determined by $x_{r}^{(m_{1}+1)}$ satisfying the inequality (3.6). Without known the optimal solution, these bounds of search region have to be estimated before computation or they are determined by numerical experimentations. The constraints (2.32) and (2.33) are necessary to avoid the restrictive consistent approximation assumption made in [7]. At a more fundamental level, the order of derivatives, $m_{1}$ in (2.33), determines the convergence rate of the approximate optimal control. Another interesting fact that amply justify these additional constraints is that Problem ${\rm B}^{\rm N}$ may not even have an optimal solution if we do not enforce (2.30). This is shown by the following counter example. ###### Example 1 Consider the following problem of optimal control. $\displaystyle\min_{(x(\cdot),u(\cdot))}\int_{-1}^{1}\displaystyle\frac{(x(t)-u(t))^{2}}{u(t)^{4}}dt$ $\displaystyle\dot{x}=u$ (2.34) $\displaystyle x(-1)=e^{-1}$ It is easy to check that the optimal solution is $\displaystyle u=e^{t},$ $\displaystyle x(t)=e^{t}$ and the optimal cost value is zero. Although the solution to the problem (2.34) is simple and analytic, the PS discretization of (2.34) does not have an optimal solution if the constraint (2.30) is not enforced. To prove this claim, consider the PS discretization, $\displaystyle\min_{(\bar{x}^{N},\bar{u}^{N})}\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})=\displaystyle\sum_{k=0}^{N}\displaystyle\frac{(\bar{x}^{Nk}-D_{k}(\bar{x}^{N})^{T})^{2}}{\left(D_{k}(\bar{x}^{N})^{T}\right)^{4}}w_{k}$ $\displaystyle D(\bar{x}^{N})^{T}=(\bar{u}^{N})^{T}$ (2.35) $\displaystyle\bar{x}^{N0}=e^{-1}$ where $D_{k}$ is the $k$th row of the differentiation matrix $D$. Let $x^{N}(t)$ be the interpolation polynomial of $\bar{x}^{N}$, then it is obvious that $x^{N}(t)-\dot{x}^{N}(t)\not\equiv 0$ Thus, there exists $k$ so that $\bar{x}^{Nk}-D_{k}(\bar{x}^{N})^{T}\neq 0$ So, $\begin{array}[]{llllllllll}\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})>0\end{array}$ (2.36) for all feasible pairs $(\bar{x}^{N},\bar{u}^{N})$. For any $\alpha>0$, define $\bar{x}^{Nk}=e^{-1}+\alpha(t_{k}+1)$ The interpolation of $\bar{x}^{N}$ is the linear polynomial $x^{N}(t)=e^{-1}+\alpha(t+1)$ Then, $D_{k}(\bar{x}^{N})^{T}=\dot{x}^{N}(t_{k})=\alpha$ The cost function is $\displaystyle\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ $\displaystyle=$ $\displaystyle\displaystyle\sum_{k=0}^{N}\displaystyle\frac{(e^{-1}+\alpha(t_{k}+1)-\alpha)^{2}}{\alpha^{4}}w_{k}$ $\displaystyle=$ $\displaystyle\displaystyle\sum_{k=0}^{N}\displaystyle\frac{(e^{-1}+\alpha t_{k})^{2}}{\alpha^{4}}w_{k}$ $\displaystyle\leq$ $\displaystyle\displaystyle\sum_{k=0}^{N}\displaystyle\frac{(e^{-1}+\alpha)^{2}}{\alpha^{4}}w_{k}$ $\displaystyle=$ $\displaystyle 2\displaystyle\frac{(e^{-1}+\alpha)^{2}}{\alpha^{4}}$ Therefore, $\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ can be arbitrarily small as $\alpha$ approaches $\infty$. However, $\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ is always positive as shown by (2.36). We conclude that the discretization (2.35) has no minimum value for $\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$. ## 3 Convergence Rate Given a solution to Problem ${\rm B}^{\rm N}$, we use (2.9) to approximate the optimal control. In this section we prove that, under this approximate optimal control, the value of the cost function converges to the optimal cost of Problem B as the number of nodes is increased. More importantly, we can prove a high-order rate of convergence. In the literature, it has been proved that PS methods have a spectral rate when approximating $C^{\infty}$ functions, i.e. the rate is faster than any polynomial rate. However, there are no results in the literature thus far on the convergence rate of PS optimal control. Meanwhile, in many problems solved by PS optimal control we clearly observed a rate of high-order in the convergence. In this section, we prove a convergence rate that depends on the smoothness of the optimal control. More specifically, the rate is about $\frac{1}{N^{2m/3-1}}$, where $m$ is defined by the smoothness of the optimal trajectory. If the cost function can be accurately computed, then the convergence rate is improved to $\frac{1}{N^{2m-1}}$. In the special case of $C^{\infty}$, it is proved that PS method is able to converge faster than any given polynomial rate. Before we introduce the main theorems of this section, the following example in [7] is briefly presented to show the rapid convergence of the PS optimal control method. ###### Example 2 Consider the following nonlinear optimal control problem: $\displaystyle\left\\{\begin{array}[]{lrl}{\rm Minimize}&J[x(\cdot),u(\cdot)]=&4x_{1}(2)+x_{2}(2)+4\displaystyle\int_{0}^{2}u^{2}(t)\ dt\\\ {\rm Subject\ to}&\dot{x}_{1}(t)=&x_{2}^{3}(t)\\\ &\dot{x}_{2}(t)=&u(t)\\\ &(x_{1}(0),x_{2}(0))=&(0,1)\end{array}\right.$ (3.5) It can be shown that the exact optimal control is defined by $u^{\ast}(t)=-\frac{8}{(2+t)^{3}}$. For this problem, the PS method achieves the accuracy in the magnitude of $10^{-8}$ with only 18 nodes. A detail comparison of the PS method with some other discretization methods are addressed in [7]. From Figure 2 in logarithmically scaled coordinates, it is obvious that the computation using the PS method converges exponentially. Figure 2: Error vs number of the nodes for the pseudospectral method Problem ${\rm B}^{\rm N}$ has several bounds in its definition, $\underline{{\boldsymbol{b}}}$, $\bar{\boldsymbol{b}}$, $\underline{{\boldsymbol{b}}}_{j}$, $\bar{\boldsymbol{b}}_{j}$, and ${\boldsymbol{d}}$. These bounds can be selected from a range determined by Problem B. The constraints $\underline{{\boldsymbol{b}}}$ and $\bar{\boldsymbol{b}}$ are lower and upper bounds so that the optimal trajectory of Problem B is contained in the interior of the region. Suppose Problem B has an optimal solution $(x^{\ast}(t),u^{\ast}(t))$ in which $(x_{r}^{\ast}(t))^{(m)}$ has bounded variation for some $m\geq 3$, where $x_{r}^{\ast}(t)$ is the $r$th component of the optimal trajectory. Suppose $m_{1}$ in Problem ${\rm B}^{\rm N}$ satisfies $2\leq m_{1}\leq m-1$. Then, we can select the bounds $\underline{{\boldsymbol{b}}}_{j}$ and $\bar{\boldsymbol{b}}_{j}$ so that $(x_{r}^{\ast}(t))^{(j)}$ is contained in the interior of the region. For ${\boldsymbol{d}}$, we assume $\displaystyle{\boldsymbol{d}}$ $\displaystyle>$ $\displaystyle\displaystyle\frac{6}{\sqrt{\pi}}(U(\left.x_{r}^{\ast}\right.^{(m_{1}+1)})+V(\left.x_{r}^{\ast}\right.^{(m_{1}+1)}))\zeta(3/2)$ (3.6) where $U(\left.x_{r}^{\ast}\right.^{(m_{1}+1)})$ is the upper bound and $V(\left.x_{r}^{\ast}\right.^{(m_{1}+1)})$ is the total variation of $\left.x_{r}^{\ast}\right.^{(m_{1}+1)}(t)$; and $\zeta(s)$ is the $\zeta$ function defined by $\displaystyle\zeta(s)=\sum_{k=1}^{\infty}\displaystyle\frac{1}{k^{s}}$ (3.7) If all the bounds are selected as above, then it is proved in Section 4 that Problem ${\rm B}^{\rm N}$ is always feasible provided $m\geq 2$. Note that in practical computation, $\underline{{\boldsymbol{b}}}$, $\bar{\boldsymbol{b}}$, $\underline{{\boldsymbol{b}}}_{j}$, $\bar{\boldsymbol{b}}_{j}$, and ${\boldsymbol{d}}$ are unknown. They must be estimated based upon experience or other information about the system. ###### Theorem 1 Suppose Problem B has an optimal solution $(x^{\ast}(t),u^{\ast}(t))$ in which the $m$-th order derivative $(x_{r}^{\ast}(t))^{(m)}$ has a bounded variation for some $m\geq 3$. In Problem ${\rm B}^{\rm N}$, select $m_{1}$ and $\alpha$ so that $1\leq m_{1}\leq m-1$ and $0<\alpha<m_{1}-1$. Suppose $f(\cdot)$, $g(\cdot)$, $F(\cdot)$, and $E(x_{0},\cdot)$ are $C^{m}$ and globally Lipschitz. Suppose all other bounds in Problem ${\rm B}^{\rm N}$ are large enough. Given any sequence $\begin{array}[]{llllllllll}\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N\geq N_{1}}\end{array}$ (3.8) of optimal solutions of Problem ${\rm B}^{\rm N}$. Then the approximate cost converge to the optimal value at the following rate $\displaystyle\left|J(x^{\ast}(\cdot),u^{\ast}(\cdot))-J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))\right|$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M_{1}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}+\displaystyle\frac{M_{2}}{N^{\alpha}}$ (3.9) $\displaystyle\left|J(x^{\ast}(\cdot),u^{\ast}(\cdot))-\bar{J}^{N}(\bar{x}^{\ast N},\bar{u}^{\ast N})\right|$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M_{1}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}+\displaystyle\frac{M_{2}}{N^{\alpha}}$ (3.10) where $M_{1}$ and $M_{2}$ are some constants independent of $N$. In (3.9), $(x^{\ast N}(t),u^{\ast N}(t))$ is the interpolation of (3.8) defined by (2.8)-(2.9). In fact, $x^{\ast N}(t)$ is the trajectory of (2.6) under the control input $u^{\ast N}(t)$. Theorem 1 implies that the costs of any sequence of discrete optimal solutions must converge to the optimal cost of Problem B, no matter the sequence of the discrete state and control trajectories converge or not. In other words, it is possible that the sequence of discrete optimal controls does not converge to a unique continuous-time control; meanwhile the costs using these approximate optimal controls converge to the true optimal cost of Problem B. Therefore, this theorem does not require the local uniqueness of solutions for Problem B. This is different from many existing convergence theorems of computational optimal control, in which a unique optimal solution and coercivity are assumed. This is made possible because the proofs in this paper do not rely on the necessary conditions of optimal control. The key idea in the proof is to shape the search region in Problem ${\rm B}^{\rm N}$by regulating the discrete solutions using (2.30)-(2.32)-(2.33). We would like to emphasize that the regulation constraints are added to the discretized problem, not the original Problem B. So, the constraints do not restrict the problem to be solved, and they do not need to be verified before computation. In addition, increasing the number of constraints results in smaller search region for an optimal solution. ###### Remark 3.1 If $f(\cdot)$, $g(\cdot)$, $F(\cdot)$ and $x_{r}^{\ast}(t)$ are $C^{\infty}$, then we can select $m$ and $m_{1}$ arbitrarily large. In this case, we can make the optimal cost of Problem ${\rm B}^{\rm N}$converge faster than any given polynomial rate. ###### Remark 3.2 From (3.9) and (3.10), the convergence rate is determined by $m$, the smoothness of the optimal trajectory, and $m_{1}$, the order in the regulation of discrete solutions. While $m$ is a property of Problem B that cannot be changed, $m_{1}$ in Problem ${\rm B}^{\rm N}$ can be selected within a range. However, the errors in (3.9) and (3.10) have two parts, one is an increasing function of $m_{1}$ and the other is a decreasing function of $m_{1}$. In Corollary 1, we show an optimal selection of $m_{1}$ to maximize the combined convergence rate. The proof is convoluted involving results from several different areas, including nonlinear functional analysis, orthogonal polynomials, and approximation theory. First, we introduce the concept of Fréchet derivative. Let us consider the continuous cost function, $J(x(\cdot),u(\cdot))$, subject to (2.6)-(2.7) as a nonlinear functional of $u(\cdot)$, denoted by ${\cal J}(u)$. For any $u$ in the Banach space $W^{m-1,\infty}$, suppose there exists a linear bounded operator ${\cal L}$: $W^{m-1,\infty}\rightarrow\Re$ such that $|{\cal J}(u+\Delta u)-{\cal J}(u)-L\Delta u|=o(||\Delta u||_{W^{m-1,\infty}})$ for all $u+\Delta u$ in an open neighborhood of $u$ in $W^{m-1,\infty}$. Then, ${\cal L}$ is called the Fréchet derivative of ${\cal J}(u)$ at $u$, denoted by ${\cal J}^{\prime}(u)=\cal L$. If ${\cal J}^{\prime}(u)$ exists at all points in an open subset of $W^{m-1,\infty}$, then ${\cal J}^{\prime}(u)$ is a functional from this open set to the Banach space $L(W^{m-1,\infty},\Re)$ of all bounded linear operators. If this new functional has a Fréchet derivative, then it is called the second order Fréchet derivative, denoted by ${\cal J}^{\prime\prime}(u)$. The following lemma is standard in nonlinear functional analysis [21]. ###### Lemma 1 Suppose ${\cal J}$ takes a local minimum value at $u^{\ast}$. Suppose ${\cal J}$ has second order Fréchet derivative at $u^{\ast}$. Then, ${\cal J}(u^{\ast}+\Delta u)=({\cal J}^{\prime\prime}(u^{\ast})\Delta u)\Delta u+o(||\Delta u||^{2})$ The rate of convergence for the spectral coefficients can be estimated by the following Jackson’s Theorem. ###### Lemma 2 (Jackson’s Theorem [20]) Let $h(t)$ be of bounded variation in $[-1,1]$. Define $H(t)=H(-1)+\displaystyle{\int_{-1}^{t}}h(s)ds$ then $\\{a_{n}\\}_{n=0}^{\infty}$, the sequence of spectral coefficients of $H(t)$, satisfies the following inequality $a_{n}<\displaystyle\frac{6}{\sqrt{\pi}}(U(h(t))+V(h(t)))\displaystyle\frac{1}{n^{3/2}}$ for $n\geq 1$. Given a continuous function $h(t)$ defined on $[-1,1]$. Let $\hat{p}^{N}(t)$ be the best polynomial of degree $N$, i.e. the $N$th order polynomial with the smallest distance to $h(t)$ under $||\cdot||_{\infty}$ norm. Let $I_{N}h(t)$ be the polynomial interpolation using the value of $h(t)$ at the LGL nodes. Then, we have the following inequality from the theory of approximation and orthogonal polynomials [4], [11]. ###### Lemma 3 $||h(t)-I_{N}h||_{\infty}\leq(1+\Lambda_{N})||h(t)-\hat{p}^{N}(t)||_{\infty}$ where $\Lambda_{N}$ is called Lebesgue constant. It satisfies $\Lambda_{N}\leq\displaystyle\frac{2}{\pi}log(N+1)+0.685\cdots$ The best polynomial approximation represents the closest polynomial to a function under $||\cdot||_{\infty}$. The error can be estimated by the following Lemma [4]. ###### Lemma 4 (1) Suppose $h(t)\in W^{m,\infty}$. Let $\hat{p}^{N}(t)$ be the best polynomial approximation. Then $||\hat{p}^{N}(t)-h(t)||_{\infty}\leq\displaystyle\frac{C}{N^{m}}||h(t)||_{W^{m,\infty}}$ for some constant $C$ independent of $h(t)$, $m$ and $N$. (2) If $h(t)\in W^{m,2}$, then $||h(t)-P_{N}h(t)||_{\infty}\leq\displaystyle\frac{C||h(t)||_{W^{m,2}}}{N^{m-3/4}}$ where $P_{N}h$ is the N-th order truncation of the Legendre series of $h(t)$. (3) If $h(t)$ has the $m$-th order strong derivative with a bounded variation, then $||h(t)-P_{N}h(t)||_{\infty}\leq\displaystyle\frac{CV(h^{(m)}(t))}{N^{m-1/2}}$ The following lemmas are proved specifically for PS optimal control methods. Similar results can be found in [14] except that some assumptions on $m_{1}$ are relaxed. ###### Lemma 5 ([14]) (i) For any trajectory, $(\bar{x}^{N},\bar{u}^{N})$, of the dynamics (2.26), the pair $(x^{N}(t),u^{N}(t))$ defined by (2.8)-(2.9) satisfies the differential equations defined in (2.6). Furthermore, $\displaystyle\bar{x}^{Nk}=x^{N}(t_{k}),\;\bar{u}^{Nk}=u^{N}(t_{k}),\;\mbox{for }k=0,1,\cdots,N$ (3.11) (ii) For any pair $(x^{N}(t),u^{N}(t))$ in which $x^{N}(t)$ consists of polynomials of degree less than or equal to $N$ and $u^{N}(t)$ is a function, if $(x^{N}(t),u^{N}(t))$ satisfies the differential equations in (2.6), then $(\bar{x}^{N},\bar{u}^{N})$ defined by (3.11) satisfies (2.26). (iii) If $(\bar{x}^{N},\bar{u}^{N})$ satisfies (2.26), then the degree of $x_{i}^{N}(t)$ is less than or equal to $N-i+1$. Proof. (i) Suppose $(\bar{x}^{N},\bar{u}^{N})$ satisfies the equations in (2.26). Because $x^{N}(t)$ is the polynomial interpolation of $\bar{x}^{N}$, and because of equations (2.14), we have $\begin{array}[]{llllllllll}\left[\begin{array}[]{cccccccccccccc}\dot{x}_{i}^{N}(t_{0})&\dot{x}_{i}^{N}(t_{1})&\cdots&\dot{x}_{i}^{N}(t_{N})\end{array}\right]\\\ =\bar{x}_{i}^{N}D^{T}\\\ =\bar{x}_{i+1}^{N}\\\ =\left[\begin{array}[]{cccccccccccccc}x_{i+1}^{N}(t_{0})&x_{i+1}^{N}(t_{1})&\cdots&x_{i+1}^{N}(t_{N})\end{array}\right]\end{array}$ Therefore, the polynomials $\dot{x}^{N}_{i}(t)$ and $x^{N}_{i+1}(t)$ must equal each other because they coincide at $N+1$ points and because the degrees of $x_{i}^{N}(t)$ and $x_{i+1}^{N}(t)$ are less than or equal to $N$. In addition, (2.9), the definition of $u^{N}(t)$, implies the last equation in (2.6). So, the pair $(x^{N}(t),u^{N}(t))$ satisfies all equations in (2.6). Now, we prove (3.11). Because $x^{N}(t)$ is an interpolation of $\bar{x}^{N}$, we know $\bar{x}^{Nk}=x^{N}(t_{k})$ for $0\leq k\leq N$. From (2.9), $\displaystyle u^{N}(t_{k})$ $\displaystyle=$ $\displaystyle\displaystyle\frac{\dot{x}_{r}^{N}(t_{k})-f(x^{N}(t_{k}))}{g(x^{N}(t_{k}))}$ (3.12) $\displaystyle=$ $\displaystyle\displaystyle\frac{\dot{x}^{N}_{r}(t_{k})-f(\bar{x}^{Nk})}{g(\bar{x}^{Nk})}$ Because of (2.14), we have $\left[\begin{array}[]{cccccccccccccc}\dot{x}_{r}^{N}(t_{0})&\dot{x}_{r}^{N}(t_{1})&\cdots&\dot{x}_{r}^{N}(t_{N})\end{array}\right]^{T}=D(\bar{x}_{r}^{N})^{T}$ Therefore, (3.12) is equivalent to $\displaystyle\left[\begin{array}[]{cccccccccccccc}u^{N}(t_{0})&u^{N}(t_{1})&\cdots&u^{N}(t_{N})\end{array}\right]^{T}$ $\displaystyle=$ $\displaystyle\mbox{diag}\left(\displaystyle\frac{1}{g(\bar{x}^{N0})},\cdots,\displaystyle\frac{1}{g(\bar{x}^{NN})}\right)\left(D(\bar{x}_{r}^{N})^{T}-\left[\begin{array}[]{cccccccccccccc}f(\bar{x}^{N0})\\\ \vdots\\\ f(\bar{x}^{NN})\end{array}\right]\right)$ Comparing to the last equation in (2.26), it is obvious that $u^{N}(t_{k})=\bar{u}^{Nk}$. So, (3.11) holds true. Part (i) is proved. (ii) Assume $(x^{N}(t),u^{N}(t))$ satisfies the differential equations in (2.6). Because $x^{N}(t)$ are polynomials, (2.14) implies $\displaystyle\bar{x}_{i}^{N}D^{T}$ $\displaystyle=\left[\begin{array}[]{cccccccccccccc}\dot{x}_{i}^{N}(t_{0})&\dot{x}_{i}^{N}(t_{1})&\cdots&\dot{x}_{i}^{N}(t_{N})\end{array}\right]$ (3.15) $\displaystyle=\left[\begin{array}[]{cccccccccccccc}x_{i+1}^{N}(t_{0})&x_{i+1}^{N}(t_{1})&\cdots&x_{i+1}^{N}(t_{N})\end{array}\right]$ (3.17) $\displaystyle=\bar{x}_{i+1}^{N}$ Furthermore, $\displaystyle\bar{x}^{N}_{r}D^{T}$ $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}\dot{x}_{r}^{N}(t_{0})&\dot{x}_{r}^{N}(t_{1})&\cdots&\dot{x}_{r}^{N}(t_{N})\end{array}\right]$ (3.19) $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}f(x^{N}(t_{0}))+g(x^{N}(t_{0}))u^{N}(t_{0})&\cdots&f(x^{N}(t_{N}))+g(x^{N}(t_{N}))u^{N}(t_{N})\end{array}\right]$ (3.21) Equations (3.15) and (3.19) imply that $(\bar{x}^{N},\bar{u}^{N})$ satisfies (2.26). Part (ii) is proved. (iii) We know that the degree of $x_{1}^{N}(t)$, the interpolation polynomial, is less than or equal to $N$. From (i), we know $x_{2}^{N}(t)=\dot{x}_{1}^{N}(t)$. Therefore, the degree of $x_{2}^{N}(t)$ must be less than or equal to $N-1$. In general, the degree of $x_{i}^{N}(t)$ is less than or equal to $N-i+1$. $\Box$ ###### Lemma 6 Suppose $\\{(\bar{x}^{N},\bar{u}^{N})\\}_{N=N_{1}}^{\infty}$ is a sequence satisfying (2.26), (2.30), (2.32) and (2.33), where $m_{1}\geq 1$. Then, $\displaystyle\left\\{\left.||(x^{N}(t))^{(l)}||_{\infty}\right|N\geq N_{1},\,l=0,1,\cdots,m_{1}\right\\}$ is bounded. If $f(x)$ and $g(x)$ are $C^{m_{1}-1}$, then $\displaystyle\left\\{\left.||(u^{N}(t))^{(l)}||_{\infty}\right|N\geq N_{1},\,l=0,1,\cdots,m_{1}-1\right\\}$ is bounded. Proof. Consider $(x_{r}^{N}(t))^{(m_{1})}$. From Lemma 5, it is a polynomial of degree less than or equal to $N-r-m_{1}+1$. Therefore, $\displaystyle(x_{r}^{N}(t))^{(m_{1})}=\displaystyle\sum_{n=0}^{N-r- m_{1}+1}a_{n}^{N}(m_{1})L_{n}(t)$ where $L_{n}(t)$ is the Legendre polynomial of degree $n$. It is known that $|L_{n}(t)|\leq 1$. Therefore, (2.33) implies that $||(x_{r}^{N}(t))^{(m_{1})}||_{\infty}$ is bounded by ${\boldsymbol{d}}$ for all $N\geq N_{1}$. Now, let us consider $(x_{r}^{N}(t))^{(m_{1}-1)}$. From (2.14) we have, $\displaystyle(x_{r}^{N}(t))^{(m_{1}-1)}$ $\displaystyle=$ $\displaystyle(x_{r}^{N}(t))^{(m_{1}-1)}|_{t=-1}+\int_{0}^{t}(x_{r}^{N}(s))^{(m_{1})}ds$ $\displaystyle=$ $\displaystyle\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{m_{1}-1}(\bar{x}_{r}^{N})^{T}+\int_{0}^{t}(x_{r}^{N}(s))^{(m_{1})}ds$ So, $||(x_{r}^{N}(t))^{(m_{1}-1)}||_{\infty}$, $N\geq N_{1}$, is bounded because of (2.32). Similarly, we can prove all derivatives of $x_{r}^{N}(t)$ of order less than $m_{1}$ are bounded. The same approach can also be applied to prove the bound $u^{N}(t)=\displaystyle\frac{\dot{x}_{r}^{N}(t)-f(x^{N}(t))}{g(x^{N}(t))}$ Because $f(x)$ and $g(x)$ have continuous derivatives of order less than or equal to $m_{1}-1$, the boundedness of $\left\\{\left.||(u^{N}(t))^{(l)}||_{\infty}\right|N\geq N_{1},\,j=0,1,\cdots,m_{1}-1\right\\}$ follows the boundedness of $(x_{r}^{N}(t))^{(l)}$ proved above. $\Box$ Given any function $h(t)$ defined on $[-1,1]$. In the following, $U(h)$ represents an upper bound of $h(t)$ and $V(h)$ represents the total variation. ###### Lemma 7 Let $(x(t),u(t))$ be a solution of the differential equation (2.6). Suppose $x_{r}^{(m)}(t)$ has bounded variation for some $m\geq 2$. Let $m_{1}$ be an integer satisfying $1\leq m_{1}\leq m-1$. Then, there exist constants $M>0$ and $N_{1}>0$ so that for each integer $N\geq N_{1}$ the differential equation (2.6) has a solution $(x^{N}(t),u^{N}(t))$ in which $x^{N}(t)$ consists of polynomials of degree less than or equal to $N$. Furthermore, the pair $(x^{N}(t),u^{N}(t))$ satisfies $\displaystyle||x_{i}^{N}(t)-x_{i}(t)||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-3/4}},\;\;\;i=1,2,\cdots,r$ (3.23) $\displaystyle||(x_{r}^{N}(t))^{(l)}-(x_{r}(t))^{(l)}||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-3/4}},\;\;\;\;l=1,2,\cdots,m_{1}$ (3.24) $\displaystyle||u^{N}(t)-u(t)||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-3/4}}$ (3.25) Furthermore, the spectral coefficients of $(x^{N}_{r})^{(m_{1})}(t)$ satisfy $\displaystyle|a^{N}_{n}(m_{1})|\leq\displaystyle\frac{6(U(x^{(m_{1}+1)}_{r})+V(x^{(m_{1}+1)}_{r}))}{\sqrt{\pi}n^{3/2}},\;\;n=1,2,\cdots,N-r-1$ (3.26) If $f(x)$ and $g(x)$ have Lipschitz continuous $L$th order partial derivatives for some $L\leq m_{1}-1$, then $\displaystyle||(u^{N}(t))^{(l)}-(u(t))^{(l)}||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-3/4}},\;\;\;l=1,\cdots,L$ (3.27) Furthermore, $\displaystyle\begin{array}[]{lll}x^{N}(-1)=x(-1)\\\ u^{N}(-1)=u(-1),&\mbox{ If }m_{1}\geq 2\end{array}$ (3.30) ###### Remark 3.3 In this lemma, if $x_{r}(t)$ has the $m$-th order strong derivative and if $x_{r}^{(m)}(t)$ has bounded variation for some $m\geq 2$, then the inequalities (3.23), (3.24), and (3.25) are slightly tighter. $\displaystyle||x_{i}^{N}(t)-x_{i}(t)||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-1/2}},\;\;\;i=1,2,\cdots,r$ (3.31) $\displaystyle||(x_{r}^{N}(t))^{(l)}-(x_{r}(t))^{(l)}||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-1/2}},\;\;\;\;l=1,2,\cdots,m_{1}$ (3.32) $\displaystyle||u^{N}(t)-u(t)||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{M||x_{r}||_{W^{m,2}}}{(N-r- m_{1}+1)^{(m-m_{1})-1/2}}$ (3.33) The proof is identical as that of Lemma 7 except that the error estimation in (3) of Lemma 4 is used. Proof. Consider the Legendre series $(x_{r})^{(m_{1})}(t)\sim\displaystyle\sum_{n=0}^{N-r- m_{1}+1}a_{n}^{N}(m_{1})L_{n}(t)$ A sequence of polynomials $x_{1}^{N}(t),\cdots,x_{r+m_{1}}^{N}(t)$ is defined as follows, $\displaystyle x_{r+m_{1}}^{N}(t)$ $\displaystyle=$ $\displaystyle\displaystyle\sum_{n=0}^{N-r-m_{1}+1}a_{n}^{N}(m_{1})L_{n}(t)$ $\displaystyle x_{r+m_{1}-1}^{N}(t)$ $\displaystyle=$ $\displaystyle(x_{r})^{(m_{1}-1)}(-1)+\displaystyle{\int_{-1}^{t}}x_{r+m_{1}}^{N}(s)ds$ $\displaystyle\vdots$ $\displaystyle x_{r+1}^{N}(t)$ $\displaystyle=$ $\displaystyle\dot{x}_{r}(-1)+\displaystyle{\int_{-1}^{t}}x_{r+2}^{N}(s)ds$ and $\displaystyle x_{i}^{N}(t)$ $\displaystyle=$ $\displaystyle x_{i}(-1)+\displaystyle{\int_{-1}^{t}}x_{i+1}^{N}(s)ds,\;\;\mbox{ for }1\leq i\leq r$ Define $x^{N}(t)=\left[\begin{array}[]{cccccccccccccc}x_{1}^{N}(t)&\cdots&x^{N}_{r}(t)\end{array}\right]^{T}$ and define $u^{N}(t)=\displaystyle\frac{x_{r+1}^{N}(t)-f(x^{N}(t))}{g(x^{N}(t))}$ From the definition of $x^{N}(t)$, we have $x^{N}(-1)=x(-1)$. If $m_{1}\geq 2$, then $x_{r+1}(-1)=\dot{x}_{r}(-1)$. From the definition of $u^{N}(t)$, we know $u^{N}(-1)=u(-1)$ provided $m_{1}\geq 2$. Therefore, $(x^{N}(t),u^{N}(t))$ satisfies (3.30). It is obvious that $x_{i}^{N}(t)$ is a polynomial of degree less than or equal to $N$; and $(x^{N}(t),u^{N}(t))$ satisfies the differential equation (2.6). Because we assume $V(x_{r}^{(m)})<\infty$, we have $x_{r}^{(m)}\in L^{2}$. From Lemma 4 $\displaystyle||x_{r+m_{1}}^{N}(t)-x_{r}^{(m_{1})}(t)||_{\infty}$ $\displaystyle=$ $\displaystyle||x_{r}^{(m_{1})}(t)-\displaystyle\sum_{n=0}^{N-r- m_{1}+1}a_{n}^{N}(m_{1})L_{n}(t)||_{\infty}$ $\displaystyle\leq$ $\displaystyle C_{1}||x_{r}||_{W^{m,2}}(N-r-m_{1}+1)^{-(m-m_{1})+3/4}$ for some constant $C_{1}>0$. Therefore, $\displaystyle|x^{N}_{r+m_{1}-1}(t)-(x_{r})^{(m_{1}-1)}(t)|$ $\displaystyle\leq$ $\displaystyle\displaystyle{\int_{-1}^{t}}|x^{N}_{r+m_{1}}(s)-(x_{r})^{(m_{1})}(s)|ds$ $\displaystyle\leq$ $\displaystyle 2C_{1}||x_{r}||_{W^{m,2}}(N-r- m_{1}+1)^{-(m-m_{1})+3/4}$ Similarly, we can prove (3.23) and (3.24). To prove (3.26), note that the spectral coefficient $a^{N}_{n}(m_{1})$ of $(x_{r}^{N})^{(m_{1})}(t)$ is the same as the spectral coefficients of $(x_{r})^{(m_{1})}(t)$. From Jackson’s Theorem (Lemma 2), we have $|a^{N}_{n}(m_{1})|<\displaystyle\frac{6}{\sqrt{\pi}}(U(x^{(m_{1}+1)}_{r})+V(x^{(m_{1}+1)}_{r}))\displaystyle\frac{1}{n^{3/2}}$ In a bounded set around $x(t)$, we have $g(x)>\alpha>0$ for some $\alpha>0$ because $f$ and $g$ are Lipschitz continuous (Definition of Problem B). Therefore, the function $\displaystyle\frac{s-f(x)}{g(x)}$ is Lipschitz in a neighborhood of $(x,s)$, i.e. there exists a constant $C_{2}$ independent of $N$ such that $\displaystyle|u^{N}(t)-u(t)|$ $\displaystyle=$ $\displaystyle\left|\frac{x_{r+1}^{N}(t)-f(x^{N}(t))}{g(x^{N}(t))}-\frac{\dot{x}_{r}(t)-f(x(t))}{g(x(t))}\right|$ (3.34) $\displaystyle\leq$ $\displaystyle C_{2}(|x_{r+1}^{N}(t)-\dot{x}_{r}(t)|+|x_{1}^{N}(t)-x_{1}(t)|+\cdots+|x_{r}^{N}(t)-x_{r}(t)|)$ Hence, (3.25) follows (3.23), (3.24) and (3.34) when $l=0$. Similarly, we can prove (3.27) for $l\leq L$. $\Box$ Now, only after this lengthy work of preparation, we are ready to prove Theorem 1. Proof of Theorem 1: Let $(x^{\ast}(t),u^{\ast}(t))$ be an optimal solution to Problem B. According to Lemma 7 and Remark 3.3, for any positive integer $N$ that is large enough, there exists a pair of functions $(\hat{x}^{N}(t),\hat{u}^{N}(t))$ in which $\hat{x}^{N}(t)$ consists of polynomials of degree less than or equal to $N$. Furthermore, the pair satisfies the differential equation with initial conditions in Problem B and $\displaystyle||\hat{x}^{N}(t)-x^{\ast}(t)||_{\infty}$ $\displaystyle<$ $\displaystyle\displaystyle\frac{L}{(N-r-m_{1}+1)^{m-m_{1}-1/2}}$ (3.35) $\displaystyle||\hat{u}^{N}(t)-u^{\ast}(t)||_{\infty}$ $\displaystyle<$ $\displaystyle\displaystyle\frac{L}{(N-r-m_{1}+1)^{m-m_{1}-1/2}}$ (3.36) $\displaystyle||(\hat{x}_{r}^{N}(t))^{(l)}-(x^{\ast}_{r}(t))^{(l)}||_{\infty}$ $\displaystyle<$ $\displaystyle\displaystyle\frac{L}{(N-r- m_{1}+1)^{m-m_{1}-1/2}},\;\;\;1\leq l\leq m_{1}$ (3.37) If we define $\hat{\bar{u}}^{Nk}=\hat{u}^{N}(t_{k}),\hat{\bar{x}}^{Nk}=\hat{x}^{N}(t_{k})$ Then $\\{(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})\\}$ satisfies (2.26) and (2.27) (Lemma 5 and 7). Because $\hat{x}_{r}^{N}(t)$ is a polynomial of degree less than or equal to $N$ and because of (2.14), we know $(\hat{x}^{N}_{r}(t))^{(j)}$ equals the interpolation polynomial of $\hat{\bar{x}}^{N}_{r}(D^{T})^{j}$. So, $\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{j}(\hat{\bar{x}}_{r}^{N})^{T}=(\hat{x}^{N}_{r}(t))^{(j)}|_{t=-1}$ Therefore, (3.37) implies (2.32) if the bounds $\underline{{\boldsymbol{b}}}_{j}$ and ${\boldsymbol{b}}_{j}$ are large enough. In addition, the spectral coefficients of $\hat{\bar{x}}^{N}_{r}(D^{T})^{m_{1}}$ is the same as the spectral coefficients of $(\hat{x}^{N}_{r}(t))^{(m_{1})}$. From (3.26), (3.7) and (3.6), we have $\displaystyle\sum_{n=0}^{N-r-m_{1}+1}|a^{N}_{n}(m_{1})|\leq{\boldsymbol{d}}$ So, the spectral coefficients of $(\hat{x}_{r}^{N})^{(m_{1})}$ satisfies (2.33). Because we select $\underline{{\boldsymbol{b}}}$ and $\bar{\boldsymbol{b}}$ large enough so that the optimal trajectory of the original continuous-time problem is contained in the interior of the region, then (3.35) and (3.36) imply (2.30) for $N$ large enough. In summary, we have proved that $(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})$ is a discrete feasible trajectory satisfying all constraints, (2.26)-(2.33), in Problem ${\rm B}^{\rm N}$. Given any bounded control input $u(\cdot)$, because the system is globally Lipschitz, it uniquely determines the trajectory $x(\cdot)$ if the initial state is fixed. Therefore, the cost $J(x^{\ast}(\cdot),u^{\ast}(\cdot))$ can be considered as a functional, denoted by ${\cal J}(u)$. Because all the functions in Problem B are $C^{m}$ with $m\geq 2$, we know that ${\cal J}(u)$ has second order Fréchet derivative. By Lemma 1 $\displaystyle|J(x^{\ast}(\cdot),u^{\ast}(\cdot))-J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))|$ (3.38) $\displaystyle=$ $\displaystyle|{\cal J}(u^{\ast})-{\cal J}(\hat{u}^{N})|$ $\displaystyle\leq$ $\displaystyle C_{1}(||u^{\ast}-\hat{u}^{N}||_{W^{m_{1}-1,\infty}}^{2})$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{C_{2}}{(N-r-m_{1}+1)^{2m-2m_{1}-1}}$ for some constant numbers $C_{1}$ and $C_{2}$. The last inequality is from (3.36). Now, consider $F(\hat{x}^{N}(t),\hat{u}^{N}(t))$ as a function of $t$. Let $F^{N}(t)$ represent the polynomial interpolation of this function at $t=t_{0},t_{1},\cdots,t_{N}$. Let $\hat{p}(t)$ be the best polynomial approximation of $F(\hat{x}^{N}(t),\hat{u}^{N}(t))$ under the norm of $L^{\infty}[-1,1]$. Then we have $\displaystyle|J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))-\bar{J}^{N}(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})|$ (3.39) $\displaystyle=$ $\displaystyle|J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))-\displaystyle\sum_{k=0}^{N}F(\hat{\bar{x}}^{Nk},\hat{\bar{u}}^{Nk})w_{k}-E(\hat{\bar{x}}^{N0},\hat{\bar{x}}^{NN})|$ $\displaystyle=$ $\displaystyle\left|\int_{-1}^{1}F(\hat{x}^{N}(t),\hat{u}^{N}(t))dt-\int_{-1}^{1}F^{N}(t)dt\right|$ $\displaystyle\leq$ $\displaystyle\int_{-1}^{1}|F(\hat{x}^{N}(t),\hat{u}^{N}(t))-F^{N}(t)|dt$ $\displaystyle\leq$ $\displaystyle 2(1+\Lambda_{N})||\hat{p}(t)-F(\hat{x}^{N}(t),\hat{u}^{N}(t))||_{\infty}$ where $\begin{array}[]{llllllllll}\Lambda_{N}\leq\displaystyle\frac{2}{\pi}log(N+1)+0.685\cdots\end{array}$ (3.40) is the Lebesgue constant. The inequality (3.39) is a corollary of Lemma 3. Because $f(\cdot)$, $g(\cdot)$, and $F(\cdot)$ are $C^{m}$, it is known (Lemma 4) that the best polynomial approximation satisfies $||\hat{p}(t)-F(\hat{x}^{N}(t),\hat{u}^{N}(t))||_{\infty}\leq\displaystyle\frac{C_{3}}{N^{m_{1}-1}}||F(\hat{x}^{N}(t),\hat{u}^{N}(t))||_{W^{m_{1}-1,\infty}}$ Because of Lemma 6, $\\{||F(\hat{x}^{N}(t),\hat{u}^{N}(t))||_{W^{m_{1}-1,\infty}}|N\geq N_{1}\\}$ is bounded. Therefore, $\displaystyle|J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))-\bar{J}^{N}(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})|\leq\displaystyle\frac{(1+\Lambda_{N})C_{4}}{N^{m_{1}-1}}\leq\displaystyle\frac{C_{5}}{N^{\alpha}}$ (3.41) for some constant numbers $C_{4}$ and $C_{5}$ independent of $N$ and any $\alpha<m_{1}-1$. Let $\begin{array}[]{llllllllll}\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N=N_{0}}^{\infty}\end{array}$ (3.42) be a sequence of optimal discrete solutions. Its interpolation is denoted by $(x^{\ast N}(t),u^{\ast N}(t))$. Then, similar to the derivation above, we can prove $\displaystyle|J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))-\bar{J}^{N}(\bar{x}^{\ast N},\bar{u}^{\ast N})|$ $\displaystyle\leq$ $\displaystyle 2(1+\Lambda_{N})||p^{N}(t)-F(x^{\ast N}(t),u^{\ast N}(t))||_{\infty}$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{C_{6}(1+\Lambda_{N})}{N^{m_{1}-1}}||F(x^{\ast N}(t),u^{\ast N}(t))||_{W^{m_{1}-1,\infty}}$ where $p^{N}(t)$ is the best polynomial approximation of $F(x^{\ast N}(t),u^{\ast N}(t))$ with degree less than or equal to $N$. Because of Lemma 6, $||F(x^{\ast N}(t),u^{\ast N}(t))||_{W^{m_{1}-1,\infty}}|N\geq N_{1}\\}$ is bounded. So $\displaystyle|J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))-\bar{J}^{N}(\bar{x}^{\ast N},\bar{u}^{\ast N})|\leq\displaystyle\frac{C_{7}}{N^{\alpha}}$ (3.44) for some constant $C_{7}>0$. Now, we are ready to piece together the puzzle of inequalities and finalize the proof. $\begin{array}[]{rcllll}&&J(x^{\ast}(\cdot),u^{\ast}(\cdot))\\\ &\leq&J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))&\left(\begin{array}[]{ll}(x^{\ast N}(t),u^{\ast N}(t))\mbox{ is a feasible }\\\ \mbox{trajectory (Lemma \ref{lemma1})}\end{array}\right)\\\ &\leq&\bar{J}^{N}(\bar{x}^{\ast N},\bar{u}^{\ast N})+\displaystyle\frac{C_{7}}{N^{\alpha}}&\left(\mbox{ inequality }(\ref{eq3_11})\right)\\\ &\leq&\bar{J}^{N}(\hat{x}^{N},\hat{u}^{N})+\displaystyle\frac{C_{7}}{N^{\alpha}}&\left(\begin{array}[]{ll}(\hat{x}^{N},\hat{u}^{N})\mbox{ is a feasible discrete }\\\ \mbox{trajectory and }(\bar{x}^{\ast N},\bar{u}^{\ast N})\mbox{ is optimal}\end{array}\right)\\\ &\leq&J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))+\displaystyle\frac{C_{5}}{N^{\alpha}}+\displaystyle\frac{C_{7}}{N^{\alpha}}&\left(\mbox{ inequality }(\ref{eq3_8})\right)\\\ &\leq&J(x^{\ast}(\cdot),u^{\ast}(\cdot))+\displaystyle\frac{C_{2}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}\\\ &&+\displaystyle\frac{C_{5}}{N^{\alpha}}+\displaystyle\frac{C_{7}}{N^{\alpha}}&\left(\mbox{ inequality }(\ref{eq3_6})\right)\end{array}$ Therefore, $0\leq J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))-J(x^{\ast}(\cdot),u^{\ast}(\cdot))\leq\displaystyle\frac{C_{2}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}+\displaystyle\frac{C_{5}}{N^{\alpha}}+\displaystyle\frac{C_{7}}{N^{\alpha}}$ This inequality implies (3.9). Furthermore, (3.9) and (3.44) imply (3.10). $\Box$ According to Theorem 1, the convergence rate of the approximate cost is determined by two terms with the rates $\displaystyle\displaystyle\frac{1}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}\sim\displaystyle\frac{1}{N^{2m-2m_{1}-1}}$ (3.45) and $\displaystyle\displaystyle\frac{1}{N^{\alpha}}\sim\displaystyle\frac{1}{N^{m_{1}-1}}$ (3.46) where $m$, the smoothness of $x^{\ast}(t)$, is fixed. However, $m_{1}$ can be selected provided $f(\cdot)$, $g(\cdot)$, and $F(\cdot)$ are smooth enough. Note that increasing $m_{1}$ will increase the rate defined by (3.46), but decrease the rate defined by (3.45). There is a value of $m_{1}$ that determines the maximum rate. Given any real number $a\in\Re$, let $[a]$ be the greatest integer less than or equal to $a$. ###### Corollary 1 Under the same assumption as Theorem 1, the convergence rate of $J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))$ and $\bar{J}^{N}(\bar{x}^{\ast N},\bar{u}^{\ast N})$ is $O\left(\frac{1}{N^{[\frac{2m}{3}]-\delta}}\right)$ in which $\delta=\left\\{\begin{array}[]{ll}1&0<\gamma<\frac{2}{3}\\\ 3\left(1-\gamma\right)&\gamma\geq\frac{2}{3}\\\ 1-\mbox{any positive number},&\gamma=0\end{array}\right.$ where $\gamma=\frac{2m}{3}-[\frac{2m}{3}]$. To achieve this rate, $m_{1}=\left\\{\begin{array}[]{lll}\left[\displaystyle\frac{2m}{3}\right],&0\leq\gamma<\frac{2}{3}\\\ \\\ \left[\displaystyle\frac{2m}{3}\right]+1,&\gamma\geq\frac{2}{3}\end{array}\right.$ Proof. The optimal convergence rate is determined by $\max_{2\leq m_{1}\leq m-1}\min\\{2m-2m_{1}-1,\,m_{1}-1\\}$ The maxmin is achieved at $m_{1}=\frac{2m}{3}$ However, it may not be an integer. If $m_{1}$ is not an integer, we have two options, $m_{1}=[\frac{2m}{3}]\mbox{ or }[\frac{2m}{3}]+1$ If we define $\gamma=\frac{2m}{3}-[\frac{2m}{3}]$ then either $m_{1}=\frac{2m}{3}-\gamma$ or $m_{1}=\frac{2m}{3}-\gamma+1$. It is straightforward to verify that $\min\\{2m-2m_{1}-1,\,m_{1}-1\\}=\left\\{\begin{array}[]{lll}\frac{2m}{3}-\gamma-1,&m_{1}=\frac{2m}{3}-\gamma\\\ \frac{2m}{3}-\gamma-3(1-\gamma),&m_{1}=\frac{2m}{3}-\gamma+1\end{array}\right.$ Therefore, $\frac{2m}{3}-1-\gamma$ is larger when $\gamma<\frac{2}{3}$, and $\frac{2m}{3}-1-2(1-\gamma)$ is larger if $\gamma\geq\frac{2}{3}$. The special case at $\gamma=0$ is because of (3.46) when $\frac{2m}{3}$ equals an integer. $\Box$ Different from numerical computations of differential equations, solving an optimal control problem requires the approximation, (2.1), of the integration as an addition to the approximation, (2.26), of the differential equation. The contributions of these approximations to the overall approximation error are different; and the errors are inversely related to each other. The following theorem indicates that the rate (3.45) is due to the approximation error of the differential equation and the rate (3.46) is due to the approximation error of the quadrature integration rule (4.9). To verify this fact, we define the following discretization problem with exact integration. Problem ${\rm B}^{\rm N}$(J) Find $\bar{x}^{Nk}\in\Re^{r}$ and $\bar{u}^{Nk}\in\Re$, $k\ =\ 0,1,\ldots,N$, that minimize $\displaystyle J(x^{N}(\cdot),u^{N}(\cdot))$ $\displaystyle=$ $\displaystyle\int_{-1}^{1}F(x^{N}(t),u^{N}(t))\ dt+E(x^{N}(-1),x^{N}(1))$ (3.47) subject to $\displaystyle\left\\{\begin{array}[]{rcl}D(\bar{x}_{1}^{N})^{T}&=&(\bar{x}_{2}^{N})^{T}\\\ D(\bar{x}_{2}^{N})^{T}&=&(\bar{x}_{3}^{N})^{T}\\\ &\vdots&\\\ D(\bar{x}_{r-1}^{N})^{T}&=&(\bar{x}_{r}^{N})^{T}\\\ D(\bar{x}_{r}^{N})^{T}&=&\left[\begin{array}[]{cccccccccccccc}f(\bar{x}^{N0})+g(\bar{x}^{N0})\bar{u}^{N0}\\\ \vdots\\\ f(\bar{x}^{NN})+g(\bar{x}^{NN})\bar{u}^{NN}\end{array}\right]\\\ \end{array}\right.$ (3.56) $\displaystyle\bar{x}^{N0}=x_{0}$ (3.57) $\displaystyle\underline{{\boldsymbol{b}}}\leq\left[\begin{array}[]{cccccccccccccc}\bar{x}^{Nk}\\\ \bar{u}^{Nk}\end{array}\right]\ \leq\ \bar{\boldsymbol{b}},\;\;\;\;\mbox{ for all }0\leq k\leq N$ (3.60) $\displaystyle\underline{{\boldsymbol{b}}}_{j}\leq\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{j}(\bar{x}_{r}^{N})^{T}\ \leq\bar{\boldsymbol{b}}_{j},\;\;1\leq j\leq m_{1}-1$ (3.62) $\displaystyle\displaystyle\sum_{n=0}^{N-r- m_{1}+1}|a^{N}_{n}(m_{1})|\leq{\boldsymbol{d}}$ (3.63) In Problem ${\rm B}^{\rm N}$(J), $(x^{N}(t),u^{N}(t))$ is the interpolation of $(\bar{x}^{N},\bar{u}^{N})$. In this discretization, we approximate the differential equation by the PS method. However, the integration in the cost function is exact. In this case, the overall error is controlled by the single rate (3.45) rather than the two-rate convergence of Problem ${\rm B}^{\rm N}$. Without the integration error of the cost function, the convergence rate is improved to $\displaystyle\frac{1}{N^{2m-3}}$; and the smoothness requirement can be reduced to $m\geq 2$. ###### Theorem 2 Suppose Problem B has an optimal solution $(x^{\ast}(t),u^{\ast}(t))$ in which the strong derivative $(x_{r}^{\ast}(t))^{(m)}$ has bounded variation for some $m\geq 2$. In Problem ${\rm B}^{\rm N}$(J), select $m_{1}$ so that $1\leq m_{1}\leq m-1$. Suppose $f(\cdot)$, $g(\cdot)$, and $F(\cdot)$ are $C^{m}$. Suppose all other bounds in Problem ${\rm B}^{\rm N}$ are large enough. Given any sequence $\begin{array}[]{llllllllll}\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N\geq N_{1}}\end{array}$ (3.64) of optimal solutions of Problem ${\rm B}^{\rm N}$(J). Then the cost of (3.64) converges to the optimal cost at the following rate $\displaystyle\left|J(x^{\ast}(\cdot),u^{\ast}(\cdot))-J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))\right|\leq\displaystyle\frac{M_{1}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}$ (3.65) for some constants $M_{1}$ independent of $N$. Proof. Let $\begin{array}[]{llllllllll}\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N=N_{0}}^{\infty}\end{array}$ (3.66) be a sequence of optimal solutions of Problem ${\rm B}^{\rm N}$(J). According to Lemma 7 and Remark 3.3, for any positive integer $N$ that is large enough, there exists a pair of functions $(\hat{x}^{N}(t),\hat{u}^{N}(t))$ in which $\hat{x}^{N}(t)$ consists of polynomials of degree less than or equal to $N$. Furthermore, the pair satisfies the differential equation in Problem B and the inequalities (3.35), (3.36), and (3.37). If we define $\hat{\bar{u}}^{Nk}=\hat{u}^{N}(t_{k}),\hat{\bar{x}}^{Nk}=\hat{x}^{N}(t_{k})$ Then, from the first part in the proof of Theorem 1, $(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})$ is a discrete feasible solution satisfying all constraints in Problem ${\rm B}^{\rm N}$(J). By Lemma 1 $\displaystyle|J(x^{\ast}(\cdot),u^{\ast}(\cdot))-J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))|$ (3.67) $\displaystyle=$ $\displaystyle|{\cal J}(u^{\ast})-{\cal J}(\hat{u}^{N})|$ $\displaystyle\leq$ $\displaystyle C_{1}(||u^{\ast}-\hat{u}^{N}||_{W^{m_{1}-1,\infty}}^{2})$ $\displaystyle\leq$ $\displaystyle\displaystyle\frac{C_{2}}{(N-r-m_{1}+1)^{2m-2m_{1}-1}}$ for some constant numbers $C_{1}$ and $C_{2}$. The last inequality is from (3.25). The interpolation $(x^{\ast N}(t),u^{\ast N}(t))$ of (3.66) is a feasible trajectory of Problem B (Lemma 5). Thus, $\begin{array}[]{rcllll}&&J(x^{\ast}(\cdot),u^{\ast}(\cdot))\\\ &\leq&J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))&\left(\begin{array}[]{ll}(x^{\ast N}(t),u^{\ast N}(t))\mbox{ is a feasible }\\\ \mbox{trajectory (Lemma \ref{lemma1})}\end{array}\right)\\\ &\leq&J(\hat{x}^{N}(\cdot),\hat{u}^{N}(\cdot))&\left(\begin{array}[]{ll}(\hat{\bar{x}}^{N},\hat{\bar{u}}^{N})\mbox{ is a feasible discrete }\\\ \mbox{trajectory and }(\bar{x}^{\ast N},\bar{u}^{\ast N})\mbox{ is optimal}\end{array}\right)\\\ &\leq&J(x^{\ast}(\cdot),u^{\ast}(\cdot))+\displaystyle\frac{C_{2}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}&\left(\mbox{ inequality }(\ref{eq3_6a})\right)\end{array}$ Therefore, $0\leq J(x^{\ast N}(\cdot),u^{\ast N}(\cdot))-J(x^{\ast}(\cdot),u^{\ast}(\cdot))\leq\displaystyle\frac{C_{2}}{(N-r- m_{1}-1)^{2m-2m_{1}-1}}$ $\Box$ ## 4 Existence and Convergence of Approximate Optimal Solutions In Section 3, the rate of convergence for the cost function is proved. However, the results do not guarantee the convergence of the approximate optimal trajectory $\\{(x^{N}(t),u^{N}(t))\\}$. In this section, we prove the existence of feasible trajectories for Problem ${\rm B}^{\rm N}$ and the existence of a convergent subsequence in any set of approximate optimal solutions. In addition, we consider a larger family of problems. Different from Section 2 where Problem B does not contain constraints other than the control system, in this section the problem of optimal control may contain nonlinear path constraints. Furthermore, general endpoint conditions are allowed, rather than being limited to the initial value problem as in the previous sections. Problem B: Determine the state-control function pair $(x(t),u(t))$, $x\in\Re^{r}$ and $u\in\Re$, that minimizes the cost function $\displaystyle J(x(\cdot),u(\cdot))$ $\displaystyle=$ $\displaystyle\int_{-1}^{1}F(x(t),u(t))\ dt+E(x(-1),x(1))$ (4.1) subject to the state equation $\displaystyle\left\\{\begin{array}[]{lll}\dot{x}_{1}=x_{2}\\\ \;\;\;\vdots\\\ \dot{x}_{r-1}=x_{r}\\\ \dot{x}_{r}=f(x)+g(x)u\end{array}\right.$ (4.6) end-point conditions $\displaystyle e(x(-1),x(1))$ $\displaystyle=$ $\displaystyle 0$ (4.7) and state-control constraints $\displaystyle h(x(t),u(t))$ $\displaystyle\leq$ $\displaystyle 0$ (4.8) where $x\in\Re^{r}$, $u\in\Re$, and $F:\Re^{r}\times\Re\to\Re$, $E:\Re^{r}\times\Re^{r}\to\Re$, $f:\Re^{r}\to\Re$, $g:\Re^{r}\to\Re$ $e:\Re^{r}\times\Re^{r}\to\Re^{N_{e}}$ and $h:\Re^{r}\times\Re\to\Re^{N_{h}}$ are all Lipschitz continuous functions with respect to their arguments. In addition, we assume $g(x)\neq 0$ for all $x$. The corresponding discretization is defined as follows. Problem ${\bf B}^{\bf N}$: Find $\bar{x}^{Nk}\in\Re^{r}$ and $\bar{u}^{Nk}\in\Re$, $k\ =\ 0,1,\ldots,N$, that minimize $\displaystyle\bar{J}^{N}(\bar{x}^{N},\bar{u}^{N})$ $\displaystyle=$ $\displaystyle\sum_{k=0}^{N}F(\bar{x}^{Nk},\bar{u}^{Nk})w_{k}+E(\bar{x}^{N0},\bar{x}^{NN})$ (4.9) subject to $\displaystyle\left\\{\begin{array}[]{rcl}D(\bar{x}_{1}^{N})^{T}&=&(\bar{x}_{2}^{N})^{T}\\\ D(\bar{x}_{2}^{N})^{T}&=&(\bar{x}_{3}^{N})^{T}\\\ &\vdots&\\\ D(\bar{x}_{r-1}^{N})^{T}&=&(\bar{x}_{r}^{N})^{T}\\\ D(\bar{x}_{r}^{N})^{T}&=&\left[\begin{array}[]{cccccccccccccc}f(\bar{x}^{N0})+g(\bar{x}^{N0})\bar{u}^{N0}\\\ \vdots\\\ f(\bar{x}^{NN})+g(\bar{x}^{NN})\bar{u}^{NN}\end{array}\right]\\\ \end{array}\right.$ (4.18) $\displaystyle\|e(\bar{x}^{N0},\bar{x}^{NN})\|_{\infty}\leq(N-r-1)^{-\beta}$ (4.19) $\displaystyle h(\bar{x}^{Nk},\bar{u}^{Nk})\leq(N-r-1)^{-\beta}\cdot\mathbf{1},\qquad\ \ \ \ \mbox{ for all }0\leq k\leq N$ (4.20) $\displaystyle\underline{{\boldsymbol{b}}}\leq\left[\begin{array}[]{cccccccccccccc}\bar{x}^{Nk}\\\ \bar{u}^{Nk}\end{array}\right]\ \leq\ \bar{\boldsymbol{b}},\;\;\;\;\mbox{ for all }0\leq k\leq N$ (4.23) $\displaystyle\underline{{\boldsymbol{b}}}_{j}\leq\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{j}(\bar{x}_{r}^{N})^{T}\ \leq\bar{\boldsymbol{b}}_{j},\mbox{ if }1\leq j\leq m_{1}-1\mbox{ and }m_{1}\geq 2$ (4.25) $\displaystyle\displaystyle\sum_{n=0}^{N-r- m_{1}+1}|a^{N}_{n}(m_{1})|\leq{\boldsymbol{d}}$ (4.26) The discretization is almost identical to the one used in the previous sections except for the path constraints and the endpoint conditions, which must be treated with care. Note that in Problem ${\rm B}^{\rm N}$the right sides of (4.19) and (4.20) are not zero. It is necessary to relax (4.7) and (4.8) by a small margin for the reason of feasibility. The margin approaches zero as $N$ is increased. Without this relaxation, it is shown by a counter example in [7] that Problem ${\rm B}^{\rm N}$ may have no feasible trajectories. Some feasibility and convergence results were proved in [7], which take the form of consistent approximation theory based on the convergence assumption about $\\{\dot{x}_{r}^{N}(t)\\}$ and $\\{\bar{x}^{N0}\\}$. The goal of this section is to remove this bothersome assumption by using a fundamentally different approach. In addition, the proofs in this section are not based on necessary conditions of optimal control and any coercivity assumption, which are widely used in existing work on the convergence of direct optimal control methods. Before we introduce main results in this section, some useful results from [7] are summarized in the following Lemma. ###### Lemma 8 ([7]) Suppose Problem B has an optimal solution $(x^{\ast}(t),u^{\ast}(t))$ satisfying $x^{\ast}_{r}(t)\in W^{m,\infty}$, $m\geq 2$. Let $\\{(\bar{x}^{N},\bar{u}^{N})\\}_{N=N_{1}}^{\infty}$ be a sequence of feasible solutions to (4.18)-(4.23). Suppose there is a subsequence $\\{N_{j}\\}_{j=1}^{\infty}$ of $\\{N\\}_{N=1}^{\infty}$ such that the sequence $\left\\{\bar{x}^{N_{j}0}\right\\}_{j=1}^{\infty}$ converges as $N_{j}\rightarrow\infty$. Suppose there exists a continuous function $q(t)$ such that $\dot{x}_{r}^{N_{j}}(t)$ converges to $q(t)$ uniformly in $[-1,1]$. Then, there exists $(x^{\infty}(t),u^{\infty}(t))$ satisfying (4.6)-(4.8) such that the following limits converge uniformly in $[-1,1]$. $\displaystyle\lim_{N_{j}\rightarrow\infty}(x^{N_{j}}(t)-x^{\infty}(t))=0$ (4.27) $\displaystyle\lim_{N_{j}\rightarrow\infty}(u^{N_{j}}(t)-u^{\infty}(t))=0$ (4.28) $\displaystyle\lim_{N_{j}\rightarrow\infty}\bar{J}^{N_{j}}(\bar{x}^{N_{j}},\bar{u}^{N_{j}})=J(x(\cdot),u(\cdot))$ (4.29) $\displaystyle\lim_{N_{j}\rightarrow\infty}J(x^{N_{j}},u^{N_{j}})=J(x(\cdot),u(\cdot))$ (4.30) In addition to the above assumptions, if $\\{(\bar{x}^{N},\bar{u}^{N})\\}_{N=N_{1}}^{\infty}$ is a sequence of optimal solutions subject to the constraints (4.18)-(4.23), then $(x^{\infty}(t),u^{\infty}(t))$ must be an optimal solution to Problem B. The following are the two main theorems of this section. Relative to [14], these results has a tightened bounds for $m_{1}$ and $\beta$. ###### Theorem 3 (Existence of solutions) Consider Problem B and Problem ${\rm B}^{\rm N}$ defined in Section 2. Suppose Problem B has a feasible trajectory $(x(t),u(t))$ in which $(x_{r}(t))^{(m)}$ has bounded variation for some $m\geq 2$. In Problem ${\rm B}^{\rm N}$, let $m_{1}$ be any integer and $\beta$ be any real number satisfying $1\leq m_{1}\leq m-1$ and $0<\beta<(m-m_{1})-\frac{3}{4}$. Then, there exists $N_{1}>0$ so that, for all $N\geq N_{1}$, Problem ${\rm B}^{\rm N}$ has a feasible trajectory satisfying (4.18)-(4.26). Furthermore, $(x(t),u(t))$ and the interpolation $(x^{N}(t),u^{N}(t))$ satisfy (3.23)-(3.26). ###### Theorem 4 (Convergence) Consider Problem B and Problem ${\rm B}^{\rm N}$ defined in Section 2. Suppose Problem B has an optimal solution $(x^{\ast}(t),u^{\ast}(t))$ in which $(x^{\ast}_{r}(t))^{(m)}$ has bounded variation for some $m\geq 3$. In Problem ${\rm B}^{\rm N}$, let $m_{1}$ be any integer and $\beta$ be any real number satisfying $2\leq m_{1}\leq m-1$ and $0<\beta<(m-m_{1})-\frac{3}{4}$. Then for any sequence $\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N=N_{1}}^{\infty}$ of optimal solutions of Problem ${\rm B}^{\rm N}$, there exists a subsequence, $\\{(\bar{x}^{\ast N_{j}},\bar{u}^{\ast N_{j}})\\}_{j\geq 1}^{\infty}$, and an optimal solution, $(x^{\ast}(t),u^{\ast}(t))$, of Problem B so that the following limits converge uniformly in $[-1,1]$ $\displaystyle\lim_{N_{j}\rightarrow\infty}(x^{\ast N_{j}}(t)-x^{\ast}(t))$ $\displaystyle=$ $\displaystyle 0$ $\displaystyle\lim_{N_{j}\rightarrow\infty}(u^{\ast N_{j}}(t)-u^{\ast}(t))$ $\displaystyle=$ $\displaystyle 0$ (4.31) $\displaystyle\lim_{N_{j}\rightarrow\infty}\bar{J}^{N_{j}}(\bar{x}^{\ast N_{j}},\bar{u}^{\ast N_{j}})$ $\displaystyle=$ $\displaystyle J(x^{\ast}(\cdot),u^{\ast}(\cdot))$ $\displaystyle\lim_{N_{j}\rightarrow\infty}J(x^{\ast N_{j}}(\cdot),u^{\ast N_{j}}(\cdot))$ $\displaystyle=$ $\displaystyle J(x^{\ast}(\cdot),u^{\ast}(\cdot))$ where $(x^{\ast N_{j}}(t),u^{\ast N_{j}}(t))$ is the interpolation of $(\bar{x}^{\ast N},\bar{u}^{\ast N})$. ###### Remark 4.1 The integers $m$ and $m_{1}$ in Theorem 3 are smaller than those in Theorem 4, i.e. the existence theorem is proved under a weaker smoothness assumption than the convergence theorem. To prove these theorems, we first briefly review some results on real analysis and then prove a lemma. Given a sequence of functions $\\{f_{k}(t)\\}_{k=1}^{\infty}$ defined on $[a,b]$. It is said to be uniformly equicontinuous if for every $\epsilon>0$, there exists a $\delta>0$ such that for all $t$, $t^{\prime}$ in $[a,b]$ with $|t^{\prime}-t|<\delta$, we have $|f_{k}(t)-f_{k}(t^{\prime})|<\epsilon$ for all $k\geq 1$. The following Proposition and Theorem are standard in real analysis [20]. ###### Proposition 1 If $f_{k}(t)$ is differentiable for all $k$, and if $\\{\dot{f}_{k}(t)\\}_{k=1}^{\infty}$ is bounded. Then, $\\{f_{k}(t)\\}_{k=1}^{\infty}$ is uniformly equicontinuous. ###### Theorem 5 (Arzelà-Ascoli Theorem) Consider a sequence of continuous functions $\\{h_{n}(t)\\}_{n=1}^{\infty}$ defined on a closed interval $[a,b]$ of the real line with real values. If this sequence is uniformly bounded and uniformly equicontinuous, then it admits a subsequence which converges uniformly. ###### Lemma 9 ([14])Let $\\{(\bar{x}^{N},\bar{u}^{N})\\}_{N=N_{1}}^{\infty}$ be a sequence satisfying (4.18)-(4.23). Assume the set $\displaystyle\left\\{\left.||\ddot{x}^{N}_{r}(t)||_{\infty}\right|N\geq N_{1}\right\\}$ (4.32) is bounded. Then, there exists $(x^{\infty}(t),u^{\infty}(t))$ satisfying (4.6)-(4.8) and a subsequence $\\{(\bar{x}^{N_{j}},\bar{u}^{N_{j}})\\}_{N_{j}\geq N_{1}}^{\infty}$ such that (4.27), (4.28), (4.29) and (4.30) hold. Furthermore, if $\\{(\bar{x}^{N},\bar{u}^{N})\\}_{N=N_{1}}^{\infty}$ is a sequence of optimal solutions to Problem ${\rm B}^{\rm N}$, then $(x^{\infty}(t),u^{\infty}(t))$ must be an optimal solution to Problem B. Proof. Let $x_{r}^{N}(t)$ be the interpolation polynomial of $\bar{x}_{r}^{N}$. Because (4.32) is a bounded set, we know that the sequence of functions $\\{\dot{x}_{r}^{N}(t)|N\geq N_{1}\\}$ is uniformly equicontinuous (Proposition 1). By the Arzelà-Ascoli Theorem, a subsequence $\\{\dot{x}_{r}^{N_{j}}(t)\\}$ converges uniformly to a continuous function $q(t)$. In addition, because of (4.23), we can select the subsequence so that $\\{\bar{x}^{N_{j}0}\\}_{N_{j}\geq N_{1}}^{\infty}$ is convergent. Therefore, all conclusions in Lemma 8 hold true. $\Box$ Now, we are ready to prove the theorems. Proof of Theorem 3: For the feasible trajectory $(x(t),u(t))$, consider the pair $(x^{N}(t),u^{N}(t))$ in Lemma 7 that satisfies the differential equation (4.6). Define $\displaystyle\begin{array}[]{rcl}\bar{x}^{Nk}&=&x^{N}(t_{k})\\\ \bar{u}^{Nk}&=&u^{N}(t_{k})\end{array}$ (4.35) for $0\leq k\leq N$. From Lemma 5, we know that $\\{(\bar{x}^{N},\bar{u}^{N})\\}$ satisfies the discrete equations in (4.18). In the next we prove that the mixed state-control constraint (4.20) is satisfied. Because $h$ is Lipschitz continuous and because of (3.23) and (3.25), there exists a constant $C$ independent of $N$ so that $\displaystyle\|h(x(t),u(t))-h(x^{N}(t),u^{N}(t))\|$ $\displaystyle\leq$ $\displaystyle C(|x_{1}(t)-x^{N}_{1}(t)|+\cdots+|x_{r}(t)-x^{N}_{r}(t)|+|u(t)-u^{N}(t)|)$ $\displaystyle\leq$ $\displaystyle CMV||x_{r}||_{W^{m,2}}(r+1)(N-r- m_{1}+1)^{-(m-m_{1})+3/4}$ Hence $\displaystyle h(x^{N}(t),u^{N}(t))$ $\displaystyle\leq$ $\displaystyle h(x(t),u(t))+CM||x_{r}||_{W^{m,2}}(r+1)(N-r- m_{1}+1)^{-(m-m_{1})+3/4}\cdot\mathbf{1}$ $\displaystyle\leq$ $\displaystyle CM||x_{r}||_{W^{m,2}}(r+1)(N-r-m_{1}+1)^{-(m-m_{1})+3/4}$ Because $\beta<m-m_{1}-\frac{3}{4}$, there exists a positive integer $N_{1}$ such that, for all $N>N_{1}$, $\displaystyle CM||x_{r}||_{W^{m,2}}(r+1)(N-r-m_{1}+1)^{-(m-m_{1})+3/4}$ $\displaystyle\leq$ $\displaystyle(N-r-1)^{-\beta}$ Therefore $x^{N}_{1}(t_{k})$, $\ldots$, $x^{N}_{r}(t_{k})$, $u^{N}(t_{k})$, $k=0,1,\ldots,N$, satisfy the mixed state and control constraint (4.20) for all $N>N_{1}$. By a similar procedure, we can prove that the endpoint condition (4.19) is satisfied. Because $x_{r}^{N}(t)$ is a polynomial of degree less than or equal to $N$, and because of (2.14) and (4.35), we know $(x^{N}_{r}(t))^{(j)}$ equals the interpolation polynomial of $\bar{x}^{N}_{r}(D^{T})^{j}$. So, $\left[\begin{array}[]{cccccccccccccc}1&0&\cdots&0\end{array}\right]D^{j}(\bar{x}_{r}^{N})^{T}=(x^{N}_{r}(t))^{(j)}|_{t=-1}$ Therefore, (3.24) implies (4.25) if the interval between $\underline{{\boldsymbol{b}}}_{j}$ and ${\boldsymbol{b}}_{j}$ is large enough. In addition, the spectral coefficients of $\bar{x}^{N}_{r}(D^{T})^{m_{1}}$ is the same as the spectral coefficients of $(x^{N}_{r}(t))^{(m_{1})}$. From (3.26) and (3.6), we have $\displaystyle\sum_{n=0}^{N-r-m_{1}+1}|a^{N}_{n}(m_{1})|\leq{\boldsymbol{d}}$ So, $\\{(\bar{x}^{N},\bar{u}^{N})\\}$ satisfies (4.26). Because we select $\underline{{\boldsymbol{b}}}$ and $\bar{\boldsymbol{b}}$ large enough so that the optimal trajectory of the original continuous-time problem is contained in the interior of the region, we can assume that $(x(t),u(t))$ is also bounded by $\underline{{\boldsymbol{b}}}$ and $\bar{\boldsymbol{b}}$. Then, (3.23) and (3.25) imply (4.23) for $N$ large enough. To summarize, $(\bar{x}^{N},\bar{u}^{N})$ satisfies (4.18)-(4.26). Therefore, it is a feasible trajectory of (4.18)-(4.23). $\Box$ Proof of Theorem 4: Consider $\\{(\bar{x}^{\ast N},\bar{u}^{\ast N})\\}_{N=N_{1}}^{\infty}$, a sequence of optimal solutions of Problem ${\rm B}^{\rm N}$. From Lemma 6, $\\{||\ddot{x}_{r}^{\ast N}(t)||_{\infty}|N\geq N_{1}\\}$ is bounded. Now, we can apply Lemma 9 to conclude that there exists a subsequence of $\\{(x^{\ast N}(t),u^{\ast N}(t))\\}_{N=N_{1}}^{\infty}$ and an optimal solution of Problem B so that the limits in (4.31) converge uniformly. $\Box$ ## 5 Simulation results The rate of convergence for the optimal cost is illustrated in the following example $\displaystyle\min_{u}\int_{0}^{\pi}(1-x_{1}+x_{1}x_{2}+x_{1}u)^{2}dt$ subject to $\displaystyle\dot{x}_{1}=-x_{1}^{2}x_{2}$ $\displaystyle\dot{x}_{2}=-1+\frac{1}{x_{1}}+x_{2}+\sin t+u$ $\displaystyle x(0)=\left[\begin{array}[]{cccccccccccccc}1\\\ 0\end{array}\right],\;\;x(\pi)=\left[\begin{array}[]{cccccccccccccc}\frac{1}{\pi+1}\\\ 2\end{array}\right]$ The analytic solution of this problem is known so that the approximation error can be computed $\displaystyle x_{1}(t)=\frac{1}{1-\sin t+t}$ $\displaystyle x_{2}(t)=1-\cos t$ $\displaystyle u=-(t+1)+\sin t+\cos t$ $\displaystyle\mbox{optimal cost}=0$ The problem is solved using PS optimal control method. The approximated optimal cost is compared to the true value. The number of nodes, N, ranges from $4$ to $16$. The error decreases rapidly as shown in Table 1. N | 4 | 6 | 8 | 10 | 12 | 14 | 16 ---|---|---|---|---|---|---|--- Error | $7.5\times 10^{-2}$ | $1.1\times 10^{-3}$ | $2.1\times 10^{-4}$ | $7.1\times 10^{-5}$ | $6.7\times 10^{-6}$ | $1.0\times 10^{-6}$ | $5.8\times 10^{-7}$ Table 1: The error of optimal cost The rate of convergence is illustrated in the following Figure 3. Figure 3: Log-scale plot of the error of optimal cost (the solid curve) Because the analytic solution is $C^{\infty}$, the rate of convergence of the PS method is faster than any polynomial rate. As a result, it converges exponentially. Of course, in practical computations the accuracy is limited by the machine precision of the computers. Therefore, the accuracy cannot be improved after $N$ is sufficiently large. ## 6 Conclusions It is proved that the PS optimal control has a high-order rate of convergence. According to the theorems in Section 3, the approximate cost computed using the Legendre PS method converges at an order determined by the smoothness of the original problem. More specifically, the rate is about $\frac{1}{N^{2m/3-1}}$, where $m$ is defined by the smoothness of the optimal trajectory. If the cost function can be accurately computed, then the convergence rate is improved to $\frac{1}{N^{2m-1}}$. If the optimal control is $C^{\infty}$, then the convergence rate can be made faster than any given polynomial rate. The results in Section 4 imply that the discretization using the Legendre PS method is feasible; and there always exists a convergent subsequence from the approximate discrete optimal solutions, provided some smoothness assumptions are satisfied. ## References * [1] J. T. Betts, Practical Methods for Optimal Control Using Nonlinear Programming, SIAM, Philadelphia, PA, 2001. * [2] J. T. Betts, “Survey of Numerical Methods for Trajectory Optimization,” Journal of Guidance, Control, and Dynamics, Vol. 21, No. 2, 1998, pp. 193-207. * [3] J. P. Boyd, Chebyshev and Fourier Spectral Methods, second edition, Dover, 2001, * [4] C. Canuto, M. Y. Hussaini, A. Quarteroni and T. A. Zang, Spectral Method in Fluid Dynamics. New York: Springer-Verlag, 1988. * [5] G. Elnagar, and M. A. Kazemi, Pseudospectral Chebyshev Optimal Control of Constrained Nonlinear Dynamical Systems, Computational Optimization and Applications, 11, 1998, pp. 195-217. * [6] Fahroo, F., Ross, I. M., ”Costate Estimation by a Legendre Pseudospectral Method,” Proceedings of the AIAA Guidance, Navigation and Control Conference, 10-12 August 1998, Boston, MA. * [7] Q. Gong, W. Kang, and I. M. Ross, A Pseudospectral Method for the Optimal Control of Constrained Feedback Linearizable Systems, IEEE Trans. Automat. Contr., Vol. 51, No. 7, pp. 1115-1129, 2006. * [8] Q. Gong, M. Ross, W. Kang, F. Fahroo, Connections Between the Covector Mapping Theorem and Convergence of Pseudospectral Methods for Optimal Control, Computational Optimization and Applications, to appear. * [9] W. W. Hager, Runge-Kutta methods in optimal control and the transformed adjoint system, Numerische Mathematik, Vol. 87, pp. 247-282, 2000. * [10] A. L. Dontchev and W. W. Hager, The Euler approximation in state constrained optimal control, Mathematics of Computation, Vol. 70, pp. 173-203, 2000. * [11] J. Hesthaven, S. Gottlieb, and D. Gottlieb, Spectral Methods for Time-Dependent Problems, Cambridge University Press, 2007. * [12] W. Kang, N. Bedrossian, Pseudospectral Optimal Control Theory Makes Debut Flight - Saves NASA $1M in under 3 hrs, SIAM News, September, 2007. * [13] W. Kang, Q. Gong, and I. M. Ross, On the Convergence of Nonlinear Optimal Control using Pseudospectral Methods for Feedback Linearizable Systems, International Journal of Robust and Nonlinear Control, Vol. 17, 1251-1277, online publication, 3 January, 2007. * [14] W. Kang, I. M. Ross, Q. Gong, Pseudospectral Optimal Control and Its Convergence Theorems, Analysis and Design of Nonlinear Control Systems - In Honor of Alberto Isidori, A. Astolfi and L. Marconi eds., Springer, 2008. * [15] S. W. Paris and C. R. Hargraves, OTIS 3.0 Manual, Boeing Space and Defense Group, Seattle, WA, 1996. * [16] S. W. Paris, J. P. Riehl, and W. K. Sjauw, “Enhanced Procedures for Direct Trajectory Optimization Using Nonlinear Programming and Implicit Integration,” Proceedings of the AIAA/AAS Astrodynamics Specialist Conference and Exhibit, 21-24 August 2006, Keystone, CO. AIAA Paper No. 2006-6309. * [17] E. Polak, Optimization: Algorithms and Consistent Approximations, Springer-Verlag, Heidelberg, 1997. * [18] J. P. Riehl, S. W. Paris, and W. K. Sjauw, “Comparision of Implicit Integration Methods for Solving Aerospace Trajectory Optimization Problems,” Proceedings of the AIAA/AAS Astrodynamics Specialist Conference and Exhibit, 21-24 August 2006, Keystone, CO. AIAA Paper No. 2006-6033. * [19] Ross, I. M., A Beginner s Guide to DIDO: A MATLAB Application Package for Solving Optimal Control Problems, Elissar Inc., Monterey, CA, October 2007. * [20] G. Sansone, A. H. Diamond, and E. Hille, Orthogonal Functions, Robert E. Krieger Publishing Co., Huntington, New York, 1977. * [21] A. Wouk, A Course of Applied Functional Analysis, John Wiley & Sons, New York, 1979.
arxiv-papers
2009-04-06T02:08:15
2024-09-04T02:49:01.721441
{ "license": "Public Domain", "authors": "Wei Kang", "submitter": "Wei Kang", "url": "https://arxiv.org/abs/0904.0833" }
0904.0917
# Probing Quantum Hall Pseudospin Ferromagnet by Resistively Detected NMR G. P. Guo(1) Y. J. Zhao(1) T. Tu(1) tutao@ustc.edu.cn X. J. Hao(1) G. C. Guo(1) H. W. Jiang(2) jiangh@physics.ucla.edu (1) Key Laboratory of Quantum Information, University of Science and Technology of China, Chinese Academy of Sciences, Hefei 230026, P. R. China (2) Department of Physics and Astronomy, University of California at Los Angeles, 405 Hilgard Avenue, Los Angeles, CA 90095, USA ###### Abstract Resistively Detected Nuclear Magnetic Resonance (RD-NMR) has been used to investigate a two-subband electron system in a regime where quantum Hall pseudo-spin ferromagnetic (QHPF) states are prominently developed. It reveals that the easy-axis QHPF state around the total filling factor $\nu=4$ can be detected by the RD-NMR measurement. Approaching one of the Landau level (LL) crossing points, the RD-NMR signal strength and the nuclear spin relaxation rate $1/T_{1}$ enhance significantly, a signature of low energy spin excitations. However, the RD-NMR signal at another identical LL crossing point is surprisingly missing which presents a puzzle. ###### pacs: 73.43.Nq, 71.30.+h, 72.20.My The multi-component electron systems have been continuously drawing intensive research interest because of its novel ground states and excitations DasSarma . In experimental systems, different Landau levels (LLs) can be tuned to cross by varying gate voltage, charge density, magnetic field or the magnetic field tilted angle to the sample. Electron-electron correlations become particularly prominent when two or more sets of LLs with different layer, subband, valley, spin, or Landau level indices are brought into degeneracy DasSarma ; Wescheider1999 ; Shayegan2000 ; Hirayama2001 ; Jiang2005 ; Jiang2006 ; Tsui2006 ; Shayegan2006 . Recent experiments in single quantum well with two subbands occupied systems Jiang2005 ; Jiang2006 , showed evidence of the formation of quantum Hall pseudospin ferromagnets (QHPFs) due to the interactions of the two subbands (termed as pseudospins) around the LLs crossing point. The QHPFs taking place at total filling factor $\nu=3,5$ and $\nu=4$ are easy-plane or easy-axis QHPFs respectively, depending on the details of the two subbands configurations. In spite of various theoretical models MacDonald2000 ; DasSarma2003 ; Hao2008 motivated by these findings, a comprehensive understanding is not yet achieved. Thus far, experimental and theoretical studies all focused on the pseudospin freedom. However, in this work we would address the unique spin excitations in the QHPF states. To address the question whether spin states in two-subband systems in nature, measurements other than the conventional transport and optical means are needed. Since the Zeeman energy of nuclear spin is about $3$ orders of magnitude smaller than that of electron spin, exchange of spin angular momentum between the electron and nuclear spin is allowed only when the electron system supports spin excitations with low energy. The nuclear spin relaxation rate $1/T_{1}$ thus probes the density of states at low energy of the electron spin system that cannot be accessed by other means. The resistively detected NMR technique has recently emerged as an effective method to probe collective spin states in the fractional quantum Hall regime KlitzingNMR1 ; KlitzingNMR2 , the Skyrmion spin texture close to the filling factor $1$ PortalNMR ; TsuiNMR , the role of electron spin polarization in the phase transition of a bilayer system EisensteinNMR ; HirayamaNMR1 , and the ferromagnetic state accompanied by collective spin excitations of a two- subband system JiangNMR . Here we use this technique to study spin freedom and its relation with pseudospin in the vicinity of the QHPF states at filling factor $\nu=3,4,5$. It reveals that the easy-axis QHPF state at $\nu=4$ is sensitive to the RD-NMR measurement. As approaching to one LL crossing point at $\nu=4$ where the easy-axis QHPF phase is well developed, the RD-NMR signal strength and the nuclear spin relaxation rate $1/T_{1}$ enhance quickly which may be due to the low energy spin excitations there. Furthermore, the RD-NMR signal can be suppressed anomaly at another identical LL crossing point of $\nu=4$. The sample was grown by molecular-beam epitaxy and consists of a symmetrical modulation-doped $24$ nm wide single GaAs quantum well bounded on each side by Si $\delta$-doped layers of AlGaAs with doping level $n_{d}=10^{12}$ cm-2. Heavy doping creates a very dense 2DEG, resulting in the filling of two subbands in the well. As determined from the Hall resistance data and Shubnikov-de Haas oscillations in the longitudinal resistance, the total density is $n=8.0\times 10^{11}$ cm-2, where the first and the second subband have a density of $n_{1}=6.1\times 10^{11}$ cm-2 and $n_{2}=1.9\times 10^{11}$ cm-2. The sample has a low-temperature mobility $\mu=4.1\times 10^{5}$ cm2/V s, which is extremely high for a 2DEG with two filled subbands. A $100$ $\mu$m wide Hall bar with $270$ $\mu$m between voltage probes was patterned by standard lithography techniques. A NiCr top gate was evaporated on the top of the sample, approximately $350$ nm away from the center of the quantum well. By applying a negative gate voltage on the NiCr top gate, the electron density can be varied continuously. Several turns of NMR coil were wound around the sample, which was placed in a Top-Loading Dilution Refrigerator with a base temperature of $15$ mK. A small radio frequency (rf) magnetic field generated by the coil with a matching frequency $f=\gamma H_{0}$ will cause NMR for 75As nuclei, where the gyromagnetic ratio $\gamma=7.29$ MHz/T. The resistance was measured using quasi-dc lock-in technique with $11.3$ Hz. Figure 1: (a) The longitudinal resistance $R_{xx}$ in the density ($n$) - magnetic field ($B_{\bot}$) phase diagram at filling factor $\nu=3,4,5$, which are measured at the base temperature. (b) Schematic drawing of the crossing between different indices Landau levels and resulting easy-plane or easy-axis pseudo-spin states at points B, D and A, C, as correspondingly marked in Fig. 2a. Figure 2: (a) The NMR signals phase diagram of the sample at $\nu=3,4,5$. The cross and circle symbols in the map denote the places where the NMR signals are measured. The ’$\times$’ mean places where there are no NMR signals, while the ’$\circ$’ show the places where the NMR signals are observed. And the size of ’$\circ$’ symbols give a schematic illustration of the strength of NMR signals. The dashed line L1 is the trace along which we measured NMR signal as shown in Fig. 5. (b) Typical resistively detected NMR spectrum measured around point C and A, B, D. In the present work, we refer the first and second subbands, to as symmetric and antisymmetric states. In the pseudo-spin language, one of them can be labeled as pseudo-spin up ($\Uparrow$) and the other as pseudo-spin down ($\Downarrow$). When a magnetic field $B_{\bot}$ is applied, the energy spectrum of the quantum well discretizes into a sequence of Landau levels. We label the single-particle levels ($i,N,\sigma$), which $i$ ($=\Uparrow,\Downarrow$), $N$, and $\sigma$ ($=\uparrow,\downarrow$) are the pseudo-spin, orbital and spin quantum numbers. In the present work we have concentrated our study around the filling factor $\nu=3,4,5$, where the filling factor $\nu$ denotes the number of filled Landau levels. The longitudinal resistance $R_{xx}$ in the density ($n$) - perpendicular magnetic field ($B_{\bot}$) plane exhibits a square-like structure around $\nu=3,4,5$, as shown in Fig. 1a. The most noticeable feature of the square-like structure is the disappearance of the extended states (i.e., bright lines) on its four boundaries, marked by A, B, C, D in Fig. 1a. Here point A corresponds to the degeneracy point of $\left|(\Uparrow,1,\downarrow)\right\rangle$ and $\left|(\Downarrow,0,\uparrow)\right\rangle$, point B corresponds to that of $\left|(\Uparrow,1,\uparrow)\right\rangle$ and $\left|(\Downarrow,0,\uparrow)\right\rangle$, point C corresponds to that of $\left|(\Uparrow,1,\uparrow)\right\rangle$ and $\left|(\Downarrow,0,\downarrow)\right\rangle$, point D corresponds to that of $\left|(\Uparrow,1,\downarrow)\right\rangle$ and $\left|(\Downarrow,0,\downarrow)\right\rangle$, as illustrated schematically in the Landau level fan diagram Fig. 1b. The disappearance and result square structure represents a pseudo-spin ferromagnet, which is due to the opening pseudo-spin gaps of easy-plane or easy-axis pseudo-spin ferromagnetic states, respectively at the level crossing points of B, D and A, C, as depicted in Fig. 1b Jiang2005 ; Jiang2006 ; Hirayama2001 ; MacDonald2000 . RD-NMR, performed in the proximity of the square structure, reveals prominent (absent) NMR signal at different regions. In order to get a clear signal and minimize heat effect, most of experiments were carried out with a rf power of $0$ dBm. The ac current $I_{ac}$ was $50$ nA, and a large dc current $I_{dc}=250$ nA were applied to enhance the NMR signal. All the measurements were carried out at temperature below $120$ mK. The measurement result under the same condition are shown in Fig. 2a, the cross and circle symbols in the map denote the places where the NMR signals are measured. The cross ’$\times$’ means the places where there are no NMR signals, while the circle ’$\circ$’ shows the places where the NMR signals are observed. And the size of ’$\circ$’ symbols give a schematic illustration of the strength of NMR signals. From this map we found that the NMR signals only occur at the upper arm of the square structure around crossing point C, while we didn’t find any signal at the lower arm of this square structure around another crossing point A and its two sides around crossing point B and D. Now we focused on the region around the LL crossing point C, where pronounced NMR signals were observed. Typical NMR lines around point C are shown in Fig. 2b. The relative change of $R_{xx}$ is typically about 1% at resonance. Upon resonance, $R_{xx}$ in all NMR lines shows a sharp decrease followed by a much slower relaxation process back to its original value, which is characterized by the nuclear spin relaxation time owing to the interaction with the electron spin system, $T_{1}$, as will be discussed below. In these experiments, we have changed the rf amplitude from $-15$ dBm to $2$ dBm. Even very weak, the NMR signal can be recognized at $-15$ dBm. We believe the RD-NMR described here is due to the electron and nuclear spin flip-flop effect JiangNMR . For the two dimensional electron system in GaAs, the contact hyperfine interaction with the polarized nuclei acts as an effective magnetic field $B_{N}$ for the electron spin. The effective electron spin-flip energy is then reduced, $E_{z}=g^{\ast}\mu_{B}BS_{z}+A\left\langle I_{z}\right\rangle S_{z}=g^{\ast}\mu_{B}(B+B_{N})S_{z}$ as $g^{\ast}<0$. When the NMR resonance condition is matched, the nuclear spins are depolarized and the electron Zeeman energy increases consequently. Since $R_{xx}$ is dependent on the thermally activated energy gap $E_{a}$, $R_{xx}\propto\exp(-E_{a}/2k_{B}T)$, the NMR is manifested by a drop in $R_{xx}$, as shown by all the NMR lines in Fig. 2b. This allows the nuclear spin polarization to be sensitively detected by a change in the transport coefficient of the electron system $R_{xx}$. The above observations reveals the spin excitation in the square structure is of intrinsic interest and is well correlated with the spin excitations of the easy-axis QHPF states. At point C, when the two competing pseudospin (up and down) states acquire the same energy and leads to easy-axis anisotropy, they separate into domains with opposite pseudospin states Hirayama2001 ; Jiang2006 ; MacDonald2000 ; MacDonald2001 . On the other hand, the pseudospin up and down states have opposite spins. As a result, magnetic domains form and the electronic state within each domain is described as an Ising-like QH ferromagnet with either one of two possible spin orientations. As the applied current forces electrons to scatter between adjacent domains with different spin but almost degenerate energy, the nuclei in the neighborhood can become polarized and probed by the RD-NMR measurement. However at other crossing point B and D, the QHPF states are easy-plane, which means that the two degenerate Landau levels are mixing and no spin magnetization formation. Since easy-plane QHPF state can not spontaneously separate into magnetic domains, there is no nuclear polarization and the NMR signals are destroyed. To support the mechanism of the polarized nuclear spins, current dependence of the NMR signal was studied. In this measurement, the sample resistance was measured with a low ac current of $20$ nA, while ramping the dc current in a wide range to bias the sample. The result indicates that the NMR signal is enhanced by a factor of $8$ in the low current range from $100$ nA up to $250$ nA. The data thus consist with the picture of current induced dynamic polarization. Figure 3: Measuring nuclear spin relaxation time $T_{1}$ around point C by recording time evolution of $R_{xx}$ irradiated by rf, initially off resonance, on resonance and finally off resonance. $T_{1}$ is determined by an exponential fit to the experiment data. Figure 4: (a) Plot of the resistively detected NMR signal ratio $\Delta R_{xx}/R_{xx}$ (black square), nuclear spin relaxation rate $1/T_{1}$ (blue circle) against gate voltage $V_{g}$ along the line L1 (in Fig. 2a). (b) Plot of electron activation energy gap $E_{a}$ against gate voltage $V_{g}$ along the same line. To gain more support of our observation of the nature of the spin in the easy- axis QHPF states, we studied the coupling between the nuclei and the electrons by measuring the nuclear spin relaxation time $T_{1}$, at various positions near the crossing point C. First, rf was tuned into resonance, and $R_{xx}$ shows a sharp decrease due to the nuclear depolarization. Then, the frequency was switched back to off resonance. Nuclear spins that have once flopped hardly relax back because of their longer relaxation time $T_{1}$, which is on the order of minutes, relative to that of the electrons. Hence, $R_{xx}$ slowly relaxes back to its original value, and $T_{1}$ can be derived by fitting $R_{xx}$ to the relation $R_{xx}=\alpha+\beta\exp(-t/T_{1})$. Fig. 3 shows the data around point C to determine $T_{1}$. Further insight is gained by investigating the NMR signals along the line L1 (please see Fig. 2a). As depicted in Fig. 4a, our measurement shows a clear peak of NMR ratio $\Delta R_{xx}/R_{xx}$ at the crossing point C where the easy-axis pseudo-spin ferromagnetic states is well developed. The obtained values of nuclear spin relaxation rate $1/T_{1}$ along line L1 are also plotted in Fig. 4a. $1/T_{1}$ rapidly increases from nearly zero to $8\times 10^{-3}$ (1/s) toward to the crossing point C, as electron becomes the pseudo- spin ferromagnetic states. For comparison, in Fig. 4b we also show the electron activation energy gap $E_{a}$ along the line L1. The single particle energy difference $E_{z}$ acts as effective Zeeman energy, and $E_{a}$ shows a slope of $5$ times greater than the single particle Zeeman gap $E_{z}$. This unusual behavior is likely to be caused by the easy-axis ferromagnetism Jiang2006 ; Hirayama2001 . These quantities all show an obvious change as approaching to the crossing point and demonstrate that $1/T_{1}$ is a sensitive indicator of the pseudo-spin ferromagnetic formation. The similarity between these phenomenon strongly suggest that an intimate link between the spin and pseudo-spin in the easy-axis pseudo-spin ferromagnetic states. Interestingly, the data shown in Fig. 4b shows that the slop of activation energy gap $E_{a}$ to single particle Zeeman gap is as large as $5$, which implies many spin flips within the magnetic domain walls and support low energy mode of spin excitations Eisenstein1995 ; MacDonald2001 . As approaching to the crossing point C, there are low energy spin excitations which give new channel to relax the nuclear spin through the electron and nuclear spin flip-flop process. Thus the NMR signal ratio $\Delta R_{xx}/R_{xx}$ and the nuclear spin relaxation rate $1/T_{1}$ enhanced. Despite the fact that the bulk of the results can be understood within the framework of pseudo-spin quantum Hall ferromagnetism, there is still an apparent puzzle. While we can find very strong NMR signals at the upper arm of the square structure around point C, there is no detectible signal at the lower arm of this square structure around point A. Since the two points have equivalent LLs crossing configurations, one would expect that they are the same easy-axis QHPF states and should produce similar NMR responses. In principle, the NMR signal can be suppressed by spin-orbital coupling HirayamaNMR2 or mobility of domains HirayamaNMR3 . However, in our case, point A and C have identical strength in spin-orbital coupling and disorder. Therefore, the anomalous suppression of NMR signal at point A may suggest that there could be some additional physics which has not yet been recognized in the theory of pseudo-spin quantum Hall ferromagnetism. In summary, RD-NMR has been measured in a two-subband electron system around the LLs crossing points at total filling factor $\nu=3,5$ and $4$ where easy- plane or easy-axis QHPF states are well developed. It reveals that the easy- axis quantum Hall pseudospin state of $\nu=4$ is sensitive to the RD-NMR measurement. As approaching to one LL crossing point at $\nu=4$, the RD-NMR signal strength and the nuclear spin relaxation rate $1/T_{1}$ enhance quickly which may be due to the low energy spin excitations. At another identical LL crossing point of $\nu=4$, the RD-NMR signal is found to be suppressed and remains as a puzzle to be understood. Of course further study is necessary to access the detailed mechanism. This work at USTC was funded by National Basic Research Programme of China (Grants No. 2006CB921900 and No. 2009CB929600), the Innovation funds from Chinese Academy of Sciences, and National Natural Science Foundation of China (Grants No. 10604052 and No. 10874163 and No.10804104). The work at UCLA was supported by the NSF under Grant No. DMR-0804794. ## References * (1) Chap 2 and 5 in Perspectives on Quantum Hall Effects, S. Das Sarma and A. Pinczuk eds., (Wiley, New York, 1997). * (2) V. Piazza, V. Pellegrini, F. Beltram, W. Wegscheider, T. Jungwirth, and A. H. MacDonald, Nature 402, 638 (1999). * (3) E. P. De Portere, E. Tutuc, S. J. Papadakis, M. Shayegan, Science 290, 1546 (2000). * (4) K. Muraki, T. Saku, and Y. Hirayama, Phys. Rev. Lett. 87, 196801 (2001). * (5) X. C. Zhang, D. R. Faulhaber and H. W. Jiang, Phys. Rev. Lett. 95, 216801 (2005). * (6) X. C. Zhang, I. Martin and H. W. Jiang, Phys. Rev. B 74, 073301 (2006). * (7) K. Lai, W. Pan, D.C. Tsui, S. Lyon, M. Muhlberger and F. Schaffler, Phys. Rev. Lett. 96, 076805 (2006). * (8) K. Vakili, T. Gokmen, O. Gunawan, Y. P. Shkolnikov, E. P. De Poortere and M. Shayegan, Phys. Rev. Lett. 97. 116803 (2006). * (9) T. Jungwirth and A. H. MacDonald, Phys. Rev. B 63, 035305 (2000). * (10) D. W. Wang, E. Demler, and S. Das Sarma, Phys. Rev. B 68, 165303 (2003). * (11) X. J. Hao et al., arXiv:0807.0297. * (12) J. H. Smet et al., Nature (London) 415, 281 (2002). * (13) O. Stern et al., Phys. Rev. B 70, 075318 (2004). * (14) W. Desrat et al., Phys. Rev. Lett. 88, 256807 (2002). * (15) G. Gervais et al., Phys. Rev. Lett. 94, 196803 (2005). * (16) I. B. Spielman et al., Phys. Rev. Lett. 94, 076803 (2005). * (17) N. Kumada et al., Phys. Rev. Lett. 94, 096802 (2005). * (18) X. C. Zhang, G. D. Scott and H. W. Jiang, Phys. Rev. Lett. 98, 246802 (2007). * (19) T. Jungwirth and A. H. MacDonald, Phys. Rev. Lett. 87, 216801 (2001). * (20) A. Schmeller, J. P. Eisenstein, L. N. Pfeiffer, and K. W. West, Phys. Rev. Lett. 75, 4290 (1995). * (21) K. Hashimoto et al., Phys. Rev. Lett. 94, 146601 (2005). * (22) Y. Hirayama et al., Physica E. 20, 133 (2003).
arxiv-papers
2009-04-06T13:33:03
2024-09-04T02:49:01.729469
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "G. P. Guo, Y. J. Zhao, T. Tu, X. J. Hao, G. C. Guo, H. W. Jiang", "submitter": "Tao Tu", "url": "https://arxiv.org/abs/0904.0917" }
0904.0977
# Bayesian MAP Model Selection of Chain Event Graphs G. Freeman g.freeman@warwick.ac.uk J.Q. Smith j.q.smith@warwick.ac.uk Department of Statistics, University of Warwick, Coventry, CV4 7AL ###### Abstract The class of chain event graph models is a generalisation of the class of discrete Bayesian networks, retaining most of the structural advantages of the Bayesian network for model interrogation, propagation and learning, while more naturally encoding asymmetric state spaces and the order in which events happen. In this paper we demonstrate how with complete sampling, conjugate closed form model selection based on product Dirichlet priors is possible, and prove that suitable homogeneity assumptions characterise the product Dirichlet prior on this class of models. We demonstrate our techniques using two educational examples. ###### keywords: chain event graphs , Bayesian model selection , Dirichlet distribution ††journal: Journal of Multivariate Analysis ## 1 Introduction Bayesian networks (BNs) are currently one of the most widely used graphical models for representing and analysing finite discrete graphical multivariate distributions with their explicit coding of conditional independence relationships between a system’s variables [1, 2]. However, despite their power and usefulness, it has long been known that BNs cannot fully or efficiently represent certain common scenarios. These include situations where the state space of a variable is known to depend on other variables, or where the conditional independence between variables is itself dependent on the values of other variables. Some examples of such latter scenarios are given by Poole and Zhang [3]. In order to overcome such deficiencies, enhancements have been proposed to the basic Bayesian network in order to create so-called “context-specific” Bayesian networks [3]. These have their own problems, however: either they represent too much of the information about a model in a non-graphical way, thus undermining the rationale for using a graphical model in the first place, or they struggle to represent a general class of models efficiently. Other graphical approaches that seek to account for “context- specific” beliefs suffer from similar problems. This has led to the proposal of a new graphical model — the chain event graph (CEGs) — which first propounded in [4]. As well as solving the aforementioned problems associated with Bayesian networks and related graphical models, CEGs are able, not unrelatedly, to encode far more efficiently the common structure in which models are elicited — as asymmetric processes — in a single graph. To this end, CEGs are based not on Bayesian networks, but on event trees (ETs) [5]. Event trees are trees where nodes represent situations — i.e. scenarios in which a unit might find itself — and each node’s extending edges represent possible future situations that can develop from the current one. It follows that every atom of the event space is encoded by exactly one root-to-leaf path, and each root-to-leaf path corresponds to exactly one atomic event. It has been argued that ETs are expressive frameworks to directly and accurately represent beliefs about a process, particularly when the model is described most naturally, as in the example below, through how situations might unfold [5]. However, as explained in [4], ETs can contain excessive redundancy in their structure, with subtrees describing probabilistically isomorphic unfoldings of situations being represented separately. They are also unable to explicitly express a model’s non-trivial conditional independences. The CEG deals with these shortcomings by combining the subtrees that describe identical subprocesses (see [4] for further details), so that the CEG derived from a particular ET has a simpler topology while in turn expressing more conditional independence statements than is possible through an ET. We illustrate the construction and the types of symmetries it is possible to code using a CEG with the following running example. ###### Example 1 Successful students on a one year programme study components $A$ and $B$, but not everyone will study the components in the same order: each student will be allocated to study either module $A$ or $B$ for the first 6 months and then the other component for the final 6 months. After the first 6 months each student will be examined on their allocated module and be awarded a distinction (denoted with $D$), a pass ($P$) or a fail ($F$), with an automatic opportunity to resit the module in the last case. If they resit then they can pass and be allowed to proceed to the other component of their course, or fail again and be permanently withdrawn from the programme. Students who have succeeded in proceeding to the second module can again either fail, pass or be awarded a distinction. On this second round, however, there is no possibility of resitting if the component is failed. With an obvious extension of the labelling, this system can be depicted by the event tree given in Figure 1. [treemode=R,nodesep=1pt]$V_{0}$$A$ $F_{1,A}$$F_{R,A}$ $P_{R,A}$$F_{2,R,B}$ $P_{2,R,B}$$D_{2,R,B}$ $P_{1,A}$$F_{2,B}$ $P_{2,B}$ $D_{2,B}$ $D_{1,A}$$F_{2,B}$ $P_{2,B}$ $D_{2,B}$ $B$$F_{1,B}$ $F_{R,B}$ $P_{R,B}$$F_{2,R,A}$ $P_{2,R,A}$ $D_{2,R,A}$ $P_{1,B}$$F_{2,A}$ $P_{2,A}$ $D_{2,A}$ $D_{1,B}$$F_{2,A}$ $P_{2,A}$ $D_{2,A}$ Figure 1: Event tree of a student’s potential progress through a hypothetical course described in Example 1. Each non-leaf node represents a juncture at which a random event will take place, with the selection of possible outcomes represented by the edges emanating from that node. Each edge distribution is defined conditional on the path passed through earlier in the tree to reach the specific node. To specify a full probability distribution for this model it is sufficient to only specify the distributions associated with the unfolding of each situation a student might reach. However, in many applications it is often natural to hypothesise a model where the distribution associated with the unfolding from one situation is assumed identical to another. Situations that are thus hypothesised to have the same transition probabilities to their children are said to be in the same _stage_. Thus in Example 1 suppose that as well as subscribing to the ET of Figure 1 we want to consider a model also embodying the following three hypotheses: 1. 1. The chances of doing well in the second component are the same whether the student passed first time or after a resit. 2. 2. The components $A$ and $B$ are equally hard. 3. 3. The distribution of marks for the second component is unaffected by whether students passed or got a distinction for the first component. These hypotheses can be identified with a partitioning of the non-leaf nodes (situations). In Figure 1 the set of situations is $\mathcal{S}=\\{V_{0},A,B,P_{1,A},P_{1,B},D_{1,A},D_{1,B},F_{1,A},F_{1,B},P_{R,A},P_{R,B}\\}.$ The partition $C$ of $\mathcal{S}$ that encodes exactly the above three hypotheses consists of the stages $u_{1}=\left\\{A,B\right\\}$, $u_{2}=\left\\{F_{1,A},F_{1,B}\right\\}$, and $u_{3}=\left\\{P_{1,A},P_{1,B},P_{R,A},P_{R,B},D_{1,A},D_{1,B}\right\\}$ together with the singleton $u_{0}=\left\\{V_{0}\right\\}$. Thus the second stage $u_{2}$, for example, implies that the probabilities on the edges $\left(F_{1,B},F_{R,B}\right)$ and $\left(F_{1,A},F_{R,A}\right)$ are equal, as are the probabilities on $\left(F_{1,B},P_{R,B}\right)$ and $\left(F_{1,A},P_{R,A}\right)$. Clearly the joint probability distribution of the model – whose atoms are the root to leaf paths of the tree – is determined by the conditional probabilities associated with the stages. A CEG is the graph that is constructed to encode a model that can be specified through an event tree combined with a partitioning of its situations into stages. In this paper we suppose that we are in a context similar to that of Example 1, where, for any possible model, the sample space of the problem must be consistent with a single event tree, but where on the basis of a sample of students’ records we want to select one of a number of different possible CEG models, i.e. we want to find the “best” partitioning of the situations into stages. We take a Bayesian approach to this problem and choose the model with the highest posterior probability — the Maximum A Posteriori (MAP) model. This is the simplest and possibly most common Bayesian model selection method, advocated by, for example, Dennison et al [6], Castelo [7], and Heckerman [8], the latter two specifically for Bayesian network selection. The paper is structured as follows. In the next section we review the definitions of event trees and CEGs. In Section 3 we develop the theory of how conjugate learning of CEGs is performed. In Section 4 we apply this theory by using the posterior probability of a CEG as its score in a model search algorithm that is derived using an analogous procedure to the model selection of BNs. We characterise the product Dirichlet distribution as a prior distribution for the CEGs’ parameters under particular homogeneity conditions. In Section 5 the algorithm is used to discover a good explanatory model for real students’ exam results. We finish with a discussion. ## 2 Definitions of event trees and chain event graphs In this section we briefly define the event tree and chain event graph. We refer the interested reader to [4] for further discussion and more detail concerning their construction. Bayesian networks, which will be referenced throughout the paper, have been defined many times before. See [8] for an overview. ### 2.1 Event Trees Let $T=(V(T),E(T))$ be a directed tree where $V(T)$ is its node set and $E(T)$ its edge set. Let $S(T)=\\{v:v\in V(T)-L(T)\\}$ be the set of situations of $T$, where $L(T)$ is the set of leaf (or terminal) nodes. Furthermore, define $\mathbb{X}=\\{\lambda(v_{0},v):v\in V(T)\backslash S(T)\\}$, where $\lambda(a,b)$ is the path from node $a$ to node $b$, and $v_{0}$ is the root node, so that $\mathbb{X}$ is the set of root-to-leaf paths of $T$. Each element of $\mathbb{X}$ is called an atomic event, each one corresponding to a possible unfolding of events through time by using the partial ordering induced by the paths. Let $\mathbb{X}(v)$ denote the set of children of $v\in V(T)$. In an event tree, each situation $v\in S(T)$ has an associated random variable $X(v)$ with sample space $\mathbb{X}(v)$, defined conditional on having reached $v$. The distribution of $X(v)$ is determined by the primitive probabilities $\\{\pi(v^{\prime}|v)=p(X(v)=v^{\prime}):v^{\prime}\in\mathbb{X}(v)\\}$. With random variables on the same path being mutually independent, the joint probability of events on a path can be calculated by multiplying the appropriate primitive probabilities together. Each primitive probability $\pi(v^{\prime}|v)$ is a colour for the directed edge $e=(v,v^{\prime})$, so that we can have $\pi(e)=\pi(v^{\prime}|v)$. ###### Example 2 Figure 2 shows a tree for two Bernoulli random variables, $X$ and $Y$, with $X$ occurring before $Y$. In an educational example $X$ could be the indicator variable of a student passing one module, and $Y$ the indicator variable for a subsequent module. [treemode=R,nodesep=1pt]$v_{0}$$v_{1}$ $v_{3}$ $v_{4}$ $v_{2}$$v_{5}$ $v_{6}$ Figure 2: Simple event tree. The non-zero-probability events in the joint probability distribution of two Bernoulli random variables, $X$ and $Y$, with $X$ observed before $Y$, can be represented by this tree. Here, all four joint states are possible, because there are four root-to-leaf paths through the nodes. Here we have random variables $X(v_{0})=X$, $X(v_{1})=Y|(X=0)$ and $X(v_{2})=Y|(X=1)$, and primitive probabilities $\pi(v_{1}|v_{0})=p(X=0)$, $\pi(v_{3}|v_{1})=p(Y=0|X=0)$ and so on for every other edge. Joint probabilities can be found by multiplying primitive probabilities along a path, e.g. $p(X=0,Y=0)=p(X=0)p(Y=0|X=0)=\pi(v_{1}|v_{0})\pi(v_{3}|v_{1})$ as $v_{0}$ and $v_{1}$ are on a path. ### 2.2 Chain Event Graphs Starting with an event tree $T$, define a floret of $v\in S(T)$ as $\mathcal{F}(v,T)=\left(V\left(\mathcal{F}(v,T)\right),E\left(\mathcal{F}(v,T)\right)\right)$ where $V(\mathcal{F}(v,T))=\\{v\\}\cup\\{v^{\prime}\in V(T):(v,v^{\prime})\in E(T)\\}$ and $E(\mathcal{F}(v,T))=\\{e\in E(T):e=(v,v^{\prime})\\}$. The floret of a vertex $v$ is thus a sub-tree consisting of $v$, its children, and the edges connecting $v$ and its children, as shown in Figure 3. This represents, as defined in section 2.1, the random variable $X(v)$ and its sample space $\mathbb{X}(v)$. [treemode=R,nodesep=1pt]$v$$v_{1}$ $v_{2}$ … $v_{k-1}$ $v_{k}$ Figure 3: Floret of $v$. This subtree represents both the random variable $X(v)$ and its state space $\mathbb{X}(v)$. One of the redundancies that can be eliminated from an ET is that of the florets’ edges of two situations, $v$ and $v^{\prime}$ say, which have identical associated edge probabilities despite being defined by different conditioning paths. We say these two situations are at the same stage. This concept is formally defined as follows. ###### Definition 3 Two situations $v,v^{\prime}\in S(T)$ are in the same stage $u$ if and only if $X(v)$ and $X(v^{\prime})$ have the same distribution under a bijection $\psi_{u}(v,v^{\prime}):E(\mathcal{F}(v,T))\rightarrow E(\mathcal{F}(v^{\prime},T))$ i.e. $\psi_{u}(v,v^{\prime}):\mathbb{X}(v)\rightarrow\mathbb{X}(v^{\prime})$ The set of stages of an ET $T$ is written $J(T)$. This set partitions the set of situations $S(T)$. We can construct a staged tree $\mathcal{G}(T,L(T))$ with $V(\mathcal{G})=V(T)$, $E(\mathcal{G})=E(T)$, and colour its edges such that: * 1. If $v\in u$ and $u$ contains no other vertices, then all $(v,v^{*})\in E(\mathcal{G})$ are left uncoloured; * 2. If $v\in u$ and $u$ contains other vertices, then all $(v,v^{*})\in E(\mathcal{G})$ are coloured; and * 3. Whenever $e(v,v^{*})\mapsto e(v^{\prime},v^{\prime*})$ under $\psi_{u}(v,v^{\prime})$, then the two edges must have the same colour. There is another type of situation that is of further interest. When the whole development from two situations $v$ and $v^{\prime}$ have identical distributions, i.e. there exists a bijection between their respective subtrees similar to that between stages as defined in Definition 3, then the situations are said to be in the same position. This is defined formally as follows. ###### Definition 4 Two situations $v,v^{\prime}\in S(T)$ are in the same position $w$ if and only if there exists a bijection $\phi_{w}(v,v^{\prime}):\Lambda(v,T)\rightarrow\Lambda(v^{\prime},T)$ where $\Lambda(v,T)$ is the set of paths in $T$ from $v$ to a leaf node of $T$, such that * 1. all edges in all of the paths in $\Lambda(v,T)$ and $\Lambda(v^{\prime},T)$ are coloured in $\mathcal{G}(T,L(T))$; and * 2. for every path $\lambda(v)\in\Lambda(v,T)$, the ordered sequence of colours in $\lambda(v)$ equals the ordered sequence of colours in $\lambda(v^{\prime}):=\phi_{w}(v,T)(\lambda(v))\in\Lambda(v^{\prime},T)$ This ensures that when $v$ and $v^{\prime}$ are in the same position, then under the map $\phi_{w}(v,v^{\prime})$ future development from either node follows identical probability distributions. We denote the set of positions as $K(T)$. Positions are an obvious way of equating situations, because the different conditioning variables of different nodes in the same position have no effect on any subsequent development. It is clear that $K(T)$ is a finer partition of $V(T)$ than $J(T)$, and indeed that $J(T)$ partitions $K(T)$, as situations in the same position will also be in the same stage. We now use stages and positions to compress the event tree into a chain event graph. First, the probability graph of the event tree $\mathcal{H}(\mathcal{G}(T))=\mathcal{H}(T)=(V(\mathcal{H}),E(\mathcal{H}))$ is drawn, where $V(\mathcal{H})=K(T)\cup\\{w_{\infty}\\}$ and $E(\mathcal{H})$ is constructed as follows. * 1. For each pair of positions $w,w^{\prime}\in K(T)$, if there exists $v,v^{\prime}\in S(T)$ such that $v\in w$,$v^{\prime}\in w^{\prime}$ and $e(v,v^{\prime})\in E(T)$, then an associated edge $e(w,w^{\prime})\in E(\mathcal{H})$ is drawn. Furthermore, if for a position $w$ there exists $v\in S(T)$, $v^{\prime}\in L(T)$ and $e(v,v^{\prime})\in E(T)$ such that $v\in w$, then an associated edge $e(w,w_{\infty})\in E(\mathcal{H})$ is drawn. * 2. The colour of this edge, $e(w,w^{\prime})$, is the same as the colour of the associated edge $e(v,v^{\prime})$. Now the CEG can finally be constructed by taking the probability graph $\mathcal{H}(T)$ and connecting the positions that are in the same stage using undirected edges: Let $\mathcal{C}(T)$ be a mixed graph with vertex set $V(\mathcal{C})=V(\mathcal{H})$, directed edge set $E_{d}(\mathcal{C})=E(\mathcal{H})$, and undirected edge set $E_{u}(\mathcal{C})=\\{(w,w^{\prime}):u(w)=u(w^{\prime}),\,w,w^{\prime}\in V(\mathcal{C})\\}$. An example of a CEG that could be constructed from the event tree in Figure 1 is shown in Figure 5. ## 3 Conjugate learning of CEGs One convenient property of CEGs is that conjugate updating of the model parameters proceeds in a closely analogous fashion to that on a BN. Conjugacy is a crucial part of the model selection algorithm that will be described in Section 4, because it leads to closed form expressions for the posterior probabilities of candidate CEGs. This in turn makes it possible to search the often very large model space quickly to find optimal models. We demonstrate here how a conjugate analysis on a CEG proceeds. Let a CEG $C$ have set of stages $J(C)=\\{u_{1},\dots,u_{k}\\}$, and let each stage $u_{i}$ have $k_{i}$ emanating edges (labelled $e_{1},\dots,e_{k_{i}}$) with associated probability vector $\boldsymbol{\pi}_{i}=(\pi_{i1},\pi_{i2},\ldots,\pi_{ik_{i}})^{\prime}$ (where $\sum_{j=1}^{k_{i}}\pi_{ij}=1$ and $\pi_{ij}>0$ for $j\in\\{1,\dots,k\\}$). Then, under random sampling, the likelihood of the CEG can be decomposed into a product of the likelihood of each probability vector, i.e. $p(\boldsymbol{x}|\boldsymbol{\pi},C)=\prod\limits_{i=1}^{k}p_{i}(\boldsymbol{x}_{i}|\boldsymbol{\pi}_{i},C)$ where $\boldsymbol{\pi}=\left\\{\boldsymbol{\pi}_{1},\boldsymbol{\pi}_{2},\ldots,\boldsymbol{\pi}_{k}\right\\}$, and $\boldsymbol{x}=\left\\{\boldsymbol{x}_{1},\dots,\boldsymbol{x}_{k}\right\\}$ is the complete sample data such that each $\boldsymbol{x}_{i}=(x_{i1},\dots,x_{ik_{i}})^{\prime}$ is the vector of the number of units in the sample (for example, the students in Example 1) that start in stage $u_{i}$ and move to the stage at the end of edge $e_{ij}$ for $j\in\\{1,\dots,k_{i}\\}$. If it is further assumed that $\boldsymbol{x}_{i}\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\boldsymbol{x}_{j}|\boldsymbol{\pi},\forall i\neq j$ then $p_{i}(\boldsymbol{x}_{i}|\boldsymbol{\pi}_{i},C)=\prod\limits_{j=1}^{k_{i}}\pi_{ij}^{x_{ij}}$ (1) Thus, just as for the analogous situation with BNs, the likelihood of a random sample also separates over the components of $\boldsymbol{\pi}$. With BNs, a common modelling assumption is of local and global independence of the probability parameters [9]; the corresponding assumption here is that the parameters $\boldsymbol{\pi}_{1}$,$\boldsymbol{\pi}_{2}$,$\ldots$,$\boldsymbol{\pi}_{k}$ of $\boldsymbol{\pi}$ are all mutually independent a priori. It will then follow, with the separable likelihood, that they will also be independent a posteriori. If the probabilities $\boldsymbol{\pi}_{i}$ are assigned a Dirichlet distribution, $\operatorname{Dir}(\boldsymbol{\alpha}_{i})$, a priori, where $\boldsymbol{\alpha}_{i}=(\alpha_{i1},\alpha_{i2},\ldots,\alpha_{ik_{i}})^{\prime}$, so that for values of $\pi_{ij}$ such that $\sum_{j=1}^{k_{i}}\pi_{ij}=1$ and $\pi_{ij}>0$ for $1\leq j\leq k_{i}$, the density of $\boldsymbol{\pi}_{i}$, $q_{i}(\boldsymbol{\pi}_{i}|C)$, can be written $q_{i}(\boldsymbol{\pi}_{i}|C)=\frac{\Gamma(\alpha_{i1}+\ldots+\alpha_{ik_{i}})}{\Gamma(\alpha_{i1})\ldots\Gamma(\alpha_{ik_{i}})}\prod\limits_{j=1}^{k_{i}}\pi_{ij}^{\alpha_{ij}-1}$ where $\Gamma(z)=\int_{0}^{\infty}t^{z-1}e^{-t}dt$ is the Gamma function. It then follows that $\boldsymbol{\pi}_{i}|\boldsymbol{x}$ $(=\boldsymbol{\pi}_{i}|\boldsymbol{x}_{i})$ also has a Dirichlet distribution, $\operatorname{Dir}(\boldsymbol{\alpha}_{i}^{\ast})$, a posteriori, where $\boldsymbol{\alpha}^{*}_{i}=(\alpha_{i1}^{*},\dots,\alpha_{ik_{i}}^{*})^{\prime}$, $\alpha_{ij}^{\ast}=\alpha_{ij}+x_{ij}$ for $1\leq j\leq k_{i},1\leq i\leq k$. The marginal likelihood of this model can be written down explicitly as the function of the prior and posterior Dirichlet parameters: $p(\boldsymbol{x}|C)=\prod_{i=1}^{k}\left[\frac{\Gamma(\sum_{j}\alpha_{ij})}{\Gamma(\sum_{j}\alpha_{ij}^{*})}\prod_{j=1}^{k_{i}}\frac{\Gamma(\alpha_{ij}^{*})}{\Gamma(\alpha_{ij})}\right].$ The computationally more useful logarithm of the marginal likelihood is therefore a linear combination of functions of $\alpha_{ij}$ and $\alpha_{ij}^{*}$. Explicitly, $\log p(\boldsymbol{x}|C)=\sum_{i=1}^{k}{\left[s(\boldsymbol{\alpha}_{i})-s(\boldsymbol{\alpha}_{i}^{\ast})\right]}+\sum_{i=1}^{k}{\left[t(\boldsymbol{\alpha}_{i}^{\ast})-t(\boldsymbol{\alpha}_{i})\right]}$ (2) where for any vector $\mathbf{c}=(c_{1},c_{2},\dots,c_{n})^{\prime}$, $s(\mathbf{c})=\log\Gamma(\sum_{v=1}^{n}{c_{v}})\mbox{ and }t(\mathbf{c})=\sum_{v=1}^{n}{\log\Gamma(c_{v})}$ (3) So the posterior probability of a CEG $C$ after observing $\boldsymbol{x}$, $q(C|\boldsymbol{x})$, can be calculated using Bayes’ Theorem, given a prior probability $q(C)$: $\log q(C|\boldsymbol{x})=\log p(\boldsymbol{x}|C)+\log q(C)+K$ (4) for some value $K$ which does not depend on $C$. This is the score that will be used when searching over the candidate set of CEGs for the model that best describes the data. ## 4 A Local Search Algorithm for Chain Event Graphs ### 4.1 Preliminaries With the log marginal posterior probability of a CEG model, $\log q(C|\boldsymbol{x})$, as its score, searching for the highest-scoring CEG in the set of all candidate models is equivalent to trying to find the Maximum A Posteriori (MAP) model [10]. The intuitive approach for searching $\boldsymbol{C}$, the candidate set of CEGs — calculating $q(C|\boldsymbol{x})$ (or $\log q(C|\boldsymbol{x})$) for every $C\in\boldsymbol{C}$ and choosing $C^{*}:=\max_{C}q(C|\boldsymbol{x})=\max_{C}\log q(C|\boldsymbol{x})$ — is infeasible for any but the most trivial problems. We describe in this section an algorithm for efficiently searching the model space by reformulating the model search problem as a clustering problem. As mentioned in Section 2.2, every CEG that can be formed from a given event tree can be identified exactly with a partition of the event tree’s nodes into stages. The coarsest partition $C_{\infty}$ has all nodes with $k$ outgoing edges in the same stage, $u_{k}$; the finest partition $C_{0}$ has each situation in its own stage, except for the trivial cases of those nodes with only one outgoing edge. Defined this way, the search for the highest-scoring CEG is equivalent to searching for the highest-scoring clustering of stages. Various Bayesian clustering algorithm exist [11], including many involving MCMC [12]. We show here how to implement an Bayesian agglomerative hierarchical clustering (AHC) exact algorithm related to that of Heard et al [13]. The AHC algorithm here is a local search algorithm that begins with the finest partition of the nodes of the underlying ET model (called $C_{0}$ above and henceforth) and seeks at each step to find the two nodes that will yield the highest-scoring CEG if combined. Some optional steps can be taken to simplify the search, which we will implement here. The first of these involves the calculation of the scores of the proposed models in the algorithm. By assuming that the probability distributions of stages that are formed from the same nodes of the underlying ET are equal in all CEGs, i.e. $p(\boldsymbol{x_{i}}|\boldsymbol{\pi_{i}},C_{1})=p(\boldsymbol{x_{i}}|\boldsymbol{\pi_{i}},C_{2}),\forall C_{1},C_{2}\in\boldsymbol{C}$, it becomes more efficient to calculate the differences of model scores, i.e. the logarithms of the relevant Bayes factors, than to calculate the two individual model scores absolutely. This is because, if for two CEGs their stage sets $J(C_{1})$ and $J(C_{2})$ differ only in that stages $u_{1a},u_{1b}\in C_{1}$ are combined into $u_{2c}\in C_{2}$, with all other stages unchanged, then the calculation of the logarithm of their posterior Bayes factor depends only on the stages involved; using the notation of Equation (3), $\displaystyle\log{\frac{q(C_{1}|\boldsymbol{x})}{q(C_{2}|\boldsymbol{x})}}$ $\displaystyle=\log{q(C_{1}|\boldsymbol{x})}-\log{q(C_{2}|\boldsymbol{x})}$ (5) $\displaystyle=\log{q(C_{1})}-\log{q(C_{2})}+\log{q(\boldsymbol{x}|C_{1})}-\log{q(\boldsymbol{x}|C_{2})}$ (6) $\displaystyle\begin{split}&=\log{q(C_{1})}-\log{q(C_{2})}+\sum_{i}{\left[s(\boldsymbol{\alpha}_{1i})-s(\boldsymbol{\alpha}_{1i}^{\ast})\right]}+\sum_{i}{\left[t(\boldsymbol{\alpha}_{1i}^{\ast})-t(\boldsymbol{\alpha}_{1i})\right]}\\\ &\qquad{}-\sum_{i}{\left[s(\boldsymbol{\alpha}_{2i})-s(\boldsymbol{\alpha}_{2i}^{\ast})\right]}-\sum_{i}{\left[t(\boldsymbol{\alpha}_{2i}^{\ast})-t(\boldsymbol{\alpha}_{2i})\right]}\end{split}$ (7) $\displaystyle\begin{split}&=\log{q(C_{1})}-\log{q(C_{2})}+s(\boldsymbol{\alpha}_{1a})-s(\boldsymbol{\alpha}_{1a}^{*})+t(\boldsymbol{\alpha}_{1a}^{*})-t(\boldsymbol{\alpha}_{1a})\\\ &\qquad{}+s(\boldsymbol{\alpha}_{1b})-s(\boldsymbol{\alpha}^{*}_{1b})+t(\boldsymbol{\alpha}^{*}_{1b})-t(\boldsymbol{\alpha}_{1b})\\\ &\qquad\qquad{}-s(\boldsymbol{\alpha}_{2c})+s(\boldsymbol{\alpha}_{2c}^{*})-t(\boldsymbol{\alpha}_{2c}^{*})+t(\boldsymbol{\alpha}_{2c})\end{split}$ (8) Using the trivial result that for any three CEGs $\log q(C_{3}|\boldsymbol{x})-\log q(C_{2}|\boldsymbol{x})=\left[\log q(C_{3}|\boldsymbol{x})-\log q(C_{1}|\boldsymbol{x})\right]-\left[\log q(C_{2}|\boldsymbol{x})-\log q(C_{1}|\boldsymbol{x})\right],$ it can be seen that in the course of the AHC algorithm, comparing two proposal CEGs from the current CEG can be done equivalently by comparing their log Bayes factors with the current CEG, which as shown above requires fewer calculations. The calculation of the score for each CEG $C$, as shown by Equation (4), shows that it is formed of two components: the prior probability of the CEG being the true model and the marginal likelihood of the data. These must therefore be set before the algorithm can be run, and it is here that the other simplifications are made. ### 4.2 The prior over the CEG space For any practical problem $\boldsymbol{C}$, the set of all possible CEGs for a given ET, is likely to be a very large set, making setting a value for $q(C),\forall C\in\boldsymbol{C}$ a non-trivial task. An obvious way to set a non-informative or exploratory prior is to choose the uniform prior, so that $q(C)=\frac{1}{\left|\boldsymbol{C}\right|}$. This has the advantages of being simple to set and of eliminating the $\log{q(C_{1})}-\log{q(C_{2})}$ term in Equation (8). A more sophisticated approach is to consider which potential clusters are more or less likely a priori, according to structural or causal beliefs, and to exploit the modular nature of CEGs by stating that the prior log Bayes factor of a CEG relative to $C_{0}$ is the sum of the prior log Bayes factors of the individual clusters relative to their components completely unclustered, and that these priors are modular across CEGs. This approach makes it simple to elicit priors over $\boldsymbol{C}$ from a lay expert, by requiring the elicitation only of the prior probability of each possible stage. A particular computational benefit of this approach is when the prior Bayes factor of any CEG $C$ with $C_{0}$ is believed to be zero, because one or more of its clusters is considered to be impossible. This is equivalent in the algorithm to not including the CEG in its search at all, as though it was never in $\boldsymbol{C}$ in the first place, with the obvious simplification of the search following. ### 4.3 The prior over the parameter space Just as when attempting to set $q(C)$, the size of most CEGs in practise leads to intractability of setting $p(\boldsymbol{x}|C)$ for each CEG $C$ individually. However, the task is again made possible by exploiting the structure of a CEG with judicious modelling assumptions. Assuming independence between the likelihoods of the stages for every CEG, so that $p(\boldsymbol{x}|\boldsymbol{\pi},C)$ is as determined by Equation (1), and the fact that $p(\boldsymbol{x}|C)=\int p(\boldsymbol{x}|\boldsymbol{\pi},C)p(\boldsymbol{\pi}|C)d\boldsymbol{\pi}$, it is clear that to set the marginal likelihood for each CEG is equivalent to setting the prior over the CEG’s parameters, i.e. setting $p(\boldsymbol{\pi}|C)$ for each $C$. With the two further structural assumptions that the stage priors are independent for all CEGs (so that $p(\boldsymbol{\pi}|C)=\prod_{i=1}^{k}p(\boldsymbol{\pi}_{i}|C)$) and that equivalent stages in different CEGs have the same prior distributions on their probability vectors, (i.e. $p(\boldsymbol{\pi}_{i}|C_{1})=p(\boldsymbol{\pi}_{i}|C_{2})$), it can be seen that the problem of setting $p(\boldsymbol{x}|\boldsymbol{\pi},C)$ is reduced to setting the parameter priors of each non-trivial floret in $C_{0}$ ($p(\boldsymbol{\pi}_{i}|C_{0}),i=1,\dots,k$) and the parameter priors of stages that are clusters of stages of $C_{0}$. The usual prior put on the probability parameters of finite discrete BNs is the product Dirichlet distribution. In Geiger and Heckerman [14] the surprising result was shown that a product Dirichlet prior is inevitable if local and global independence are assumed to hold over all Markov equivalent graphs on at least two variables. In this paper we show that a similar characterisation can be made for CEGs given the assumptions in the previous paragraph. We will first show that the floret parameters in $C_{0}$ must have Dirichlet priors, and second that all CEGs formed by clustering the florets in $C_{0}$ have Dirichlet priors on the stage parameters. One characterisation of $C_{0}$ is given by Theorem 5. ###### Theorem 5 If it is assumed a priori that the rates at which units take the root-to-leaf paths in $C_{0}$ are independent (“path independence”) and that the probability of which edge units take after arriving at a situation $v$ is independent of the rate at which units arrive at $v$ (“floret independence”), then the non-trivial florets of $C_{0}$ have independent Dirichlet priors on their probability vectors. ###### Proof 1 The proof is in the Appendix. Thus $p(\boldsymbol{\pi}_{i}|C_{0})$ is entirely determined by the stated rates $\gamma(\lambda)$ on the root-to-leaf paths $\lambda\in\Lambda(C_{0})$ of $C_{0}$. This is similar to the “equivalent sample sizes” method of assessing prior uncertainty of Dirichlet hyperparameters in BNs as discussed in Section 2 of Heckerman [8]. Another way to show that all non-trivial situations in $C_{0}$ have Dirichlet priors on their parameter spaces is to use the characterisation of the Dirichlet distribution first proven by Geiger and Heckerman [14], repeated here as Theorem 6. ###### Theorem 6 Let $\\{\theta_{ij}\\},1\leq i\leq k,1\leq j\leq n,\sum_{ij}{\theta_{ij}}=1$, where $k$ and $n$ are integers greater than 1, be positive random variables having a strictly positive pdf $f_{U}(\\{\theta_{ij}\\})$. Define $\theta_{i.}=\sum_{j=1}^{n}{\theta_{ij}}$, $\theta_{I.}=\\{\theta_{i.}\\}_{i=1}^{k-1}$, $\theta_{j|i}=\theta_{ij}/{\sum_{j}{\theta_{ij}}}$, and $\theta_{J|i}=\\{\theta_{j|i}\\}_{j=1}^{n-1}$. Then if $\\{\theta_{I.},\theta_{J|1},\dots,\theta_{J|k}\\}$ are mutually independent, $f_{U}(\\{\theta_{ij}\\})$ is Dirichlet. ###### Proof 2 Theorem 2 of Geiger and Heckerman [14]. ###### Corollary 7 If $C_{0}$ has a composite number $m$ of root-to-leaf paths and all Markov equivalent CEGs have independent floret distributions then the vector of probabilities on the root-to-leaf paths of $C_{0}$ must have a Dirichlet prior. This means in particular that, from the properties of the Dirichlet distribution, the floret of each situation with at least two outgoing edges has a Dirichlet prior on its edges. ###### Proof 3 Construct an event tree $C_{0}^{\prime}$ with $m$ root-to-leaf paths, where the floret of the root node $v_{0}^{\prime}$ has $k$ edges and each of the florets extending from the children of $v_{0}^{\prime}$ have $n$ edges terminating in leaf nodes, where $m=kn,k\geq 2,n\geq 2$. This will always be possible with a composite $m$. $C_{0}^{\prime}$ describes the same atomic events as $C_{0}$ with a different decomposition. Let the random variable associated with the root floret of $C_{0}^{\prime}$ be $X$, and let the random variable associated with each of the other florets be $Y|X=i,i=1,\dots,k$. Let $\theta_{ij}=P(X=i,Y=j)$. Then by the definition of event trees, $P(\theta_{ij}>0)>0,1\leq i\leq k,1\leq j\leq n$ and $\sum\theta_{ij}=1$. By the notation of Theorem 6, $\theta_{i.}=P(X=i)$ and $\theta_{j|i}=P(Y=j|X=i)$. By hypothesis the floret distributions of $C_{0}^{\prime}$ are independent. Therefore the condition of Theorem 6 holds and hence $f_{U}(\theta_{ij})$ is Dirichlet. From the equivalence of the atomic events, the probability distribution over the root-to-leaf path probabilities of $C_{0}$ is also Dirichlet, and so by Lemma 16, all non-trivial florets of $C_{0}$ therefore have Dirichlet priors on their probability vectors. To show that the stage parameters of all the other CEGs in $\boldsymbol{C}$ have independent Dirichlet priors, an inductive approach will be taken. Because of the assumption of consistency – that two identically composed stages in different CEGs have identical priors on their parameter space – for any given CEG $C$ whose stages all have independent Dirichlet priors on their parameters spaces, it is known that another CEG $C^{*}$ formed by clustering two stages $u_{1c},u_{2c}$ from $C$ into one stage $u_{c^{*}}$ will have independent Dirichlet priors on all its stages apart from $u_{c^{*}}$. It is thus only required to show that $\boldsymbol{\pi}_{c^{*}}$ has a Dirichlet prior. We prove this result for a class of CEGs called regular CEGs. ###### Definition 8 A stage $u$ is regular if and only if every path $\lambda\in\Lambda(C)$ contains either one situation in $u$ or none of the situations in $u$. ###### Definition 9 A CEG is regular if and only if every situation $u\in\boldsymbol{u}(C)$ is regular. ###### Theorem 10 Let $C$ be a regular CEG, and let $C^{*}$ be the CEG that is formed from $C$ by setting two of its stages, $u_{1c}$ and $u_{2c}$, as being in the same stage $u_{c^{*}}$, where $u_{c^{*}}$ is a regular stage, with all other attributes of the CEG unchanged from $C$. If all stages in $C$ have Dirichlet priors, then assuming that equivalent stages in different CEGs have equivalent priors, all stages in $C^{*}$ have Dirichlet priors. ###### Proof 4 Without loss of generality, let all situations in $u_{1c}$ and $u_{2c}$ have $s$ children each, and let the total number of situations in $u_{1c}$ and $u_{2c}$ be $r$. Thus there are $r$ situations in $u_{c^{*}}$, each with $s$ children. By the assumption of prior consistency across stages, all stages in $C^{*}$ have Dirichlet priors on their parameter spaces, so it is only required to prove that $u_{c^{*}}$ has a Dirichlet prior. Consider the CEG $C^{\prime}$ formed as follows: Let the root node of $C^{\prime}$, $v_{0}$, have 2 children, $v_{1}$ and $v^{\prime}$. Let $v^{\prime}$ be a terminal node, and let $v_{1}$ have $r$ children, $\\{v_{1}(1),\dots,v_{1}(r)\\}$, which are equivalent to the situations in $u_{c^{*}}$, including the property that they are in the same stage $u_{c^{\prime}}$. Lastly, let the children of $\\{v_{1}(1),\dots,v_{1}(r)\\}$, $\\{v_{1}(1,1),\dots,v_{1}(1,s),\dots,v_{1}(r,1),\dots,v_{1}(r,s)\\}$, be leaf nodes in $C^{\prime}$. By construction, the prior for $u_{c^{\prime}}$ is the same as that for $u_{c^{*}}$. Now construct another CEG $C^{*\prime}$ from $C^{\prime}$ by reversing the order of the stages $v_{1}$ and $u_{c^{\prime}}$. The new CEG has root node $v_{0}$ with the same distribution as $v_{0}\in C^{\prime}$. $v_{0}$ now has two children $v^{\prime}$ – the same as before – and $v_{2}$, which has $s$ children $\\{v_{2}(1),\dots,v_{2}(s)\\}$ in the same stage. Each node $v_{2}(i),i=1,\dots,s$ has $r$ children $v_{2}(i,1),\dots,v_{2}(i,r)$, all of which are leaf nodes. The two CEGs $C^{*\prime}$ and $C^{\prime}$ are Markov equivalent, as it is clear that $P(v_{1}(i,j))=P(v_{2}(j,i)),i=1,\dots,r,j=1,\dots,s$. The probabilities on the floret of $v_{2}$ are thus equal to the probabilities of the situations in the stage of $u_{c^{\prime}}$, and hence $u_{c^{*}}$. Because $v_{2}$ is a stage with only one situation, Theorem 5 implies that it has a Dirichlet prior. Therefore $u_{c^{*}}$ has a Dirichlet prior. An alternative justification for assigning a Dirichlet prior to any stage that is formed by clustering situations with Dirichlet priors on their state spaces can be obtained which does not depend on assuming Markov equivalency between CEGs derived from different event trees by assuming a property analogous to that of “parameter modularity” for BNs [15]. This property states that the distribution over structures common to two CEGs should be identical. ###### Definition 11 Let $u$ be a stage in a CEG $C$ composed of the situations $v_{1},\dots,v_{n}$ from $C_{0}$, each of which has $m$ children $v_{i1},\dots,v_{im},i=1,\dots,n$ such that $v_{ij}$ are the same colour for all $i$ for each $j$. Then $u$ has the property of margin equivalency if $\displaystyle\pi_{uj}$ $\displaystyle=P(v_{1j}\mbox{ or }v_{2j}\mbox{ or }\dots\mbox{ or }v_{nj}|v_{1}\mbox{ or }v_{2}\mbox{ or }\dots\mbox{ or }v_{n})$ (9) $\displaystyle=\frac{\sum_{i=1}^{n}{P(v_{ij})}}{\sum_{i=1}^{n}{P(v_{i})}}$ (10) is the same for both $C$ and $C_{0}$ for $j=1,\dots,m$. ###### Definition 12 $C$ has margin equivalency if all of its stages have margin equivalency. ###### Theorem 13 Let $u_{c}$ be a stage as defined in Definition 11 with $m\geq 2$. Then assuming independent priors between the situations for the associated finest- partition CEG $C_{0}$ of $C$, $\boldsymbol{\pi}_{v_{i}}\thicksim\operatorname{Dir}(\boldsymbol{\alpha}_{i})$ where $\boldsymbol{\alpha}_{i}=\left(\alpha_{i1},\dots,\alpha_{im}\right)$ for each $v_{i}$, $i=1,\dots,n$. Furthermore, for both $C$ and $C_{0}$, $\boldsymbol{\pi}_{u}\thicksim\operatorname{Dir}(\boldsymbol{\alpha}_{u})$, where $\boldsymbol{\alpha}_{u}=\left(\sum_{i}\alpha_{i1},\dots,\sum_{i}\alpha_{im}\right)$. ###### Proof 5 From Theorem [5] or Corollary [7], every non-trivial floret in $C_{0}$ has a Dirichlet prior on its edges, which includes in this case the situations $v_{1},\dots,v_{n}$. Let $\gamma_{ij}=\gamma\pi_{ij}$ for $i=1,\dots,n,\>j=1,\dots,m$ for some $\gamma\in\mathbb{R^{+}}$. Then it is a well-known fact that $\gamma_{ij}\thicksim\operatorname{Gamma}(\alpha_{ij},\beta)$ for all $1\leq i\leq n,1\leq j\leq m$ for some $\beta>0$, and that $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}_{j}\gamma_{ij}$. As $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}_{i}\boldsymbol{\pi}_{v_{i}}$, $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}_{ij}\gamma_{ij}$. Then by Lemma 15, letting $I[j]$ be the set of edges $\left\\{e_{ij}=e(v_{i},v_{ij}),i=1,\dots,n\right\\}$ for $j=1,\dots,m$, $\boldsymbol{\pi}_{u}\thicksim\operatorname{Dir}(\sum_{i}\alpha_{i1},\dots,\sum_{i}\alpha_{im})$ By margin equivalency, $\boldsymbol{\pi}_{u}$ must be set the same way for $C$. Note that the posterior of $\boldsymbol{\pi}_{u}$ for a stage $u$ that is composed of the $C_{0}$ situations $v_{1},\dots,v_{n}$ is thus $\boldsymbol{\pi}_{u}|\boldsymbol{x}\sim\operatorname{Dir}(\boldsymbol{\alpha}_{u}^{*})$ where $\boldsymbol{\alpha}_{u}^{*}=\boldsymbol{\alpha}_{u}+\boldsymbol{x}_{u}=\sum_{i=1}^{n}{\boldsymbol{\alpha}_{v_{n}}}+\sum_{i=1}^{n}{\boldsymbol{x}_{v_{n}}}$. Equation (8), therefore, becomes $\log{\frac{q(C_{1}|\boldsymbol{x})}{q(C_{2}|\boldsymbol{x})}}=\log{q(C_{1})}-\log{q(C_{2})}+s(\boldsymbol{\alpha}_{1a})-s(\boldsymbol{\alpha}_{1a}^{*})+t(\boldsymbol{\alpha}_{1a}^{*})-t(\boldsymbol{\alpha}_{1a})\\\ {}+s(\boldsymbol{\alpha}_{1b})-s(\boldsymbol{\alpha}^{*}_{1b})+t(\boldsymbol{\alpha}^{*}_{1b})-t(\boldsymbol{\alpha}_{1b})-s(\boldsymbol{\alpha}_{1a}+\boldsymbol{\alpha}_{1b})\\\ {}+s(\boldsymbol{\alpha}_{1a}^{*}+\boldsymbol{\alpha}^{*}_{1b})-t(\boldsymbol{\alpha}_{1a}^{*}+\boldsymbol{\alpha}^{*}_{1b})+t(\boldsymbol{\alpha}_{1a}+\boldsymbol{\alpha}_{1b})$ (11) ### 4.4 The algorithm The algorithm thus proceeds as follows: 1. 1. Starting with the initial ET model, form the CEG $C_{0}$ with the finest possible partition, where all leaf nodes are placed in the terminal stage $u_{\infty}$ and all nodes with only one emanating edge are placed in the same stage. Calculate $\log q(C_{0}|\boldsymbol{x})$ using (4). 2. 2. For each pair of situations $v_{i},v_{j}\in C_{0}$ with the same number of edges, calculate $\log{\frac{q(C_{1}^{*}|\boldsymbol{x})}{q(C_{0}|\boldsymbol{x})}}$ where $C_{1}^{*}$ is the CEG formed by having $v_{i},v_{j}$ in the same stage and keeping all others in their own stage; do not calculate if $q(C_{1}^{*})=0$. 3. 3. Let $C_{1}=\max_{C_{1}^{*}}(\log{\frac{q(C_{1}^{*}|\boldsymbol{x})}{q(C_{0}|\boldsymbol{x})}})$. 4. 4. Now calculate $C_{2}^{*}$ for each pair of stages in $C_{1}$ except where $q(C_{2}^{*})=0$, and record $C_{2}=\max(q(C_{2}^{*}|\boldsymbol{x}))$. 5. 5. Continue for $C_{3}$, $C_{4}$ and so on until the coarsest partition $C_{\infty}$ has been reached. 6. 6. Find $C=\max(C_{0},C_{1},\dots,C_{\infty})$, and select this as the MAP model. We note that the algorithm can also be run backwards, starting from $C_{\infty}$ and splitting one cluster in two at each step. This has the advantage of making the identification of positions in the MAP model easier. ## 5 Examples ### 5.1 Simulated data To first demonstrate the efficacy of the algorithm described above we implement the algorithm using simulated data for Example 1, where the CEG generating the data was as known and described in Section 1. Figure 4 shows the number of students in the sample who reached each situation in the tree. [treemode=R,nodesep=1pt]$V_{0}$$A$500 $F_{1,A}$108$F_{R,A}$41 $P_{R,A}$67$F_{2,R,B}$25 $P_{2,R,B}$35 $D_{2,R,B}$7 $P_{1,A}$261$F_{2,B}$21 $P_{2,B}$182 $D_{2,B}$58 $D_{1,A}$131$F_{2,B}$2 $P_{2,B}$30 $D_{2,B}$99 $B$500$F_{1,B}$100 $F_{R,B}$40 $P_{R,B}$60 $F_{2,R,A}$23 $P_{2,R,A}$33 $D_{2,R,A}$4 $P_{1,B}$251$F_{2,A}$26 $P_{2,A}$175 $D_{2,A}$50 $D_{1,B}$159$F_{2,A}$3 $P_{2,A}$48 $D_{2,A}$108 Figure 4: The event tree from Example 1 with the numbers representing the number of students in a simulated sample who reached each situation. In this complete dataset the progress of 1000 students has been tracked through the event tree. Half are assigned to take module $A$ first and the other half $B$. By finding the MAP CEG model in the light of this data we may find out whether the three hypotheses posed in the introduction are valid. We repeat them here for convenience: 1. 1. The chances of doing well in the second component are the same whether the student passed first time or after a resit. 2. 2. The components $A$ and $B$ are equally hard. 3. 3. The distribution of marks for the second component is unaffected by whether students passed or got a distinction for the first component. We set a uniform prior on the CEG priors and on the root-to-leaf paths of $C_{0}$, the finest partition of the tree, for illustration purposes. The algorithm is then implemented as follows. There are only two florets with two edges; with Beta(1,3) priors on each and a Beta(2,6) prior on the combined stage, the log Bayes factor is -1.85. Carrying out similar calculations for all the pairs of nodes with three edges, it is first decided to merge the nodes $P_{1,A}$ and $P_{1,B}$, which has a log Bayes factor of -3.76 against leaving them apart. Applying the algorithm to the updated set of nodes and iterating, the CEG in Figure 5 is found to be the MAP one. $\psmatrix[mnode=circle]&w_{2}\\\ w_{0}w_{1}w_{3}w_{\infty}\endpsmatrix\psset{shortput=tablr,arrows=->,nodesep=4.0pt}{\psset{arcangle=35.0}\ncarc{->}{2,1}{2,2}}^{A}{\psset{arcangle=-35.0}\ncarc{->}{2,1}{2,2}}^{B}{\psset{arcangle=35.0}\ncarc{->}{2,2}{1,3}}^{F_{1}}{\psset{arcangle=35.0}\ncarc{->}{2,2}{2,3}}^{P_{1}}{\psset{arcangle=-35.0}\ncarc{->}{2,2}{2,3}}^{D_{1}}{\ncline{->}{1,3}{2,6}}>{F_{R}}{\ncline{->}{1,3}{2,3}}>{P_{R}}{\psset{arcangle=10.0}\ncarc{->}{2,3}{2,6}}{\ncline{->}{2,3}{2,6}}{\psset{arcangle=-10.0}\ncarc{->}{2,3}{2,6}}$ Figure 5: The MAP CEG for that event tree in Figure 4 Under this model, it can be seen that all three hypotheses above are satisfied and that the MAP model is the correct one. ### 5.2 Student test data In our second example we apply the learning algorithm to a real dataset in order to test the algorithm’s efficacy in a real-life situation and to identify remaining issues with its usage. The dataset we used was an appropriately disguised set of marks taken over a 10-year period from four core modules of the MORSE degree course taught at the University of Warwick. A part of the event tree used as the underlying model for the first two modules is shown in Figure 6, along with a few illustrative data points. This is a simplification of a much larger study that we are currently investigating but large enough to illustrate the richness of inference possible with our model search. * [tnpos=l]1036 * [tnpos=l]936^$A$ * [tnpos=a]601^$1$ * [tnpos=a]601 * 288 * 272 * 41 * * [tnpos=a]257^$2$ * * * * * * [tnpos=a]78^$3$ * * * * * * [tnpos=l]100^$NA$ * * * * * Figure 6: Sub-tree of the event tree of possible grades for the MORSE degree course at the University of Warwick. Each floret of two edges describes whether a student’s marks are available for a particular module (denoted by the edge labelled $A$ for the first module) or whether they are missing ($NA$). If they are available, then they are counted as grade 1 if are 70% or higher, grade 2 if they are between 50% and 69% inclusive, and grade 3 if they are below 50%. Some illustrative count data are shown on corresponding nodes. For simplicity, the prior distributions on the candidate models and on the root-to-leaf paths for $C_{0}$ were both chosen to be uniform distributions. The MAP CEG model was not $C_{0}$, so that there were some non-trivial stages. In total, 170 situations were clustered into 32 stages. Some of the more interesting stages of this model are described in Table 1. Stage | Probability vector | Students | Situations | Locations | Comments ---|---|---|---|---|--- 7 | (0.47, 0.44, 0.08) | 685 | 2 | 1; 1,1,1 | High achievers 11 | (0.22, 0.43, 0.35) | 412 | 6 | 3; 1,2; 3,1; 1,1,3 | Middling students 13 | (0.33, 0.33, 0.33) | 16 | 18 | 4; 4,2; 4,3 | No students appeared in 17 of these situations 17 | (0.07, 0.27, 0.66) | 86 | 4 | 1,3; 3,2; 3,2,4 | Struggling students 27 | (0.19, 0.56, 0.25) | 464 | 7 | 1,1,4; 1,2,2; 1,3,2; 1,4,2 | More likely to get grade 2 than stage 11 28 | (0.11, 0.51, 0.38) | 436 | 6 | 1,2,3; 3,1,3; 1,2,4 | More likely to get grade 3 than stage 27 Table 1: Selected stages of MAP CEG model formed from data described in Section 5.2. The columns respectively detail the stage number, posterior expectation of the probability vector of that stage (rounded to two decimal places), number of students passing through that stage in the dataset, number of situations from the original ET in that stage, examples of situations in that stage (shown as sequence of grades, where “4” means that grade is missing), and any comments or observations related to that stage. From inspecting the membership of stages it was possible to identify various situations which were discovered to share distributions. From example, students who reach one of the two situations in stage 7 have an expected probability of 0.47 in getting a high mark, an expected probability of 0.44 of getting a middling grade, and only an expected probability of 0.08 of achieving the lowest grade. From being in a stage of their own, it can be deduced that students in these situations have qualitatively different prospects from students in any other situations. In contrast, students who reach one of the four situations in stage 17 have an expected probability of 0.66 of getting the lowest grade. ## 6 Discussion In this paper we have shown that chain event graphs are not just an efficient way of storing the information contained in an event tree, but also a natural way to represent the information that is most easily elicited from a domain expert: the order in which events happen, the distributions of variables conditional on the process up to the point they are reached, and prior beliefs about the relative homogeneity of different situations. This strength is exploited when the MAP CEG is discovered, as this can be used in a qualitative fashion to detect homogeneity between seemingly disparate situations. There are a number extensions to the theory in this paper that are currently being pursued. These fall mostly into the two categories: creating even richer model classes than those considered here; and developing even more efficient algorithms for selecting the MAP model in these model classes. The first category includes dynamic chain event graphs. This framework can supply a number of different model classes. The simplest case involves selecting a CEG structure that is constant across time, but with a time series on its parameters. A bigger class would allow the MAP CEG structure to change over time. These larger model classes would clearly be useful in the educational setting considered in this paper, as they would allow for background changes in the students’ abilities, for example. Another important model class is that which arises from uncertainty about the underlying event tree. A similar model search algorithm to the one described in this paper is possible in this case after setting a prior distribution on the candidate event trees. In order to search any of these model classes more effectively, the problem of finding the MAP model can be reformulated as a weighted MAX-SAT problem, for which algorithms have been developed. This approach was used to great effect for finding a MAP BN by Cussens [16]. ## Appendix Theorem 5 is based on three well-known results concerning properties of the Dirichlet distribution, which we review below. ###### Lemma 14 Let $\gamma_{j}\thicksim\operatorname{Gamma}(\alpha_{j},\beta),j=1,\dots,n$ where $\alpha_{j}>0$ for $j\in\\{1,\dots,n\\}$, $\beta>0$ and $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\limits_{i\in\\{1\dots n\\}}\gamma_{i}$. Furthermore, let $\theta_{j}=\frac{\gamma_{j}}{\gamma}$ for $j\in\\{1,\dots,n\\}$, where $\gamma=\sum_{i=1}^{n}{\gamma_{i}}$. Then $\boldsymbol{\theta}=\operatorname*{\left(\theta_{i}\right)}_{i=\\{1,\dots,n\\}}\thicksim\operatorname{Dir}\left(\alpha_{1},\dots,\alpha_{n}\right)$. ###### Proof 6 Kotz et al [17]. ###### Lemma 15 Let $I[j]\subseteq\\{1,\dots,n\\}$, $\gamma(I[j])=\sum_{i\in I[j]}\gamma_{i}$ and $\theta(I[j])=\sum_{i\in I[j]}\theta_{i}$. Then for any partition $I=\\{I[1],\dots,I[k]\\}$ of $\\{1,\dots,n\\}$, $\theta(I)=(\theta(I[1]),\theta(I[2]),\dots,\theta(I[k]))\thicksim\operatorname{Dir}\left(\alpha(I[1]),\dots,\alpha(I[k])\right)$ where $\alpha(I[j])=\sum_{i\in I[j]}{\alpha_{i}}$. ###### Proof 7 For any $I[j]\subseteq\\{1,\dots,n\\}$, $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\limits_{i\in I[j]}\gamma_{i}$, $\gamma(I[j])\thicksim\operatorname{Gamma}{\left(\alpha(I[j]),\beta\right)}$ (a well-known result; see, for example, Weatherburn [18]), and for any partition $I=\\{I[1],\dots,I[k]\\}$ of $\\{1,\dots,n\\}$, $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\limits_{i\in\\{1,\dots,k\\}}\gamma(I[j])$. Therefore, as $\theta(I[j])=\sum_{i\in I[j]}{\theta_{i}}=\sum_{i\in I[j]}{\frac{\gamma_{i}}{\gamma}}=\frac{\gamma(I[j])}{\gamma},\quad j=1,\dots,k$ and $\gamma=\sum_{i=1}^{k}{\gamma(I[i])}$, the result follows from Lemma 14. ###### Lemma 16 For any $I[j]\subseteq\\{1,\dots,n\\}$ where $\left|I[j]\right|\geq 2$, $\theta_{I[j]}=\left(\frac{\theta_{i}}{\theta(I[j])}\right)_{i\in I[j]}\thicksim\operatorname{Dir}\left((\alpha_{i})_{i\in I[j]}\right)$ ###### Proof 8 Wilks [19]. ###### Theorem 17 Let the rates of units along the root-to-leaf paths $\lambda_{i}\in\Lambda,i\in\\{1,\dots,\left|\Lambda\right|\\}$ of an event tree $T$ have independent Gamma distributions with the same scale parameter, i.e. $\gamma_{i}=\gamma(\lambda_{i})\thicksim\operatorname{Gamma}(\alpha_{i},\beta),i\in\\{1,\dots,\left|\Lambda\right|\\}$ and $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\limits_{i\in\\{1,\dots,\left|\Lambda\right|\\}}\gamma_{i}$. Then the distribution on each floret in the tree will be Dirichlet. ###### Proof 9 Consider a floret $\mathcal{F}$ with root node $v$ and edge set $\\{e_{1},\dots,e_{l}\\}$. The rate for each edge $e_{i}$, $\gamma(e_{i})$, is equal to $\gamma(\lambda_{e_{i}})$, where $\lambda_{e_{i}}$ is the root-to- leaf path that intersects with $e_{i}$, so that $\gamma(e_{i})\thicksim\operatorname{Gamma}(\alpha_{e_{i}},\beta)$ and $\operatorname*{{\;\bot\\!\\!\\!\\!\\!\\!\bot\;}}\limits_{i\in\\{1,\dots,l\\}}\gamma(e_{i})$. Let $I=\\{I[\mathcal{F}],I[\mathcal{\overline{F}}]\\}$ partition $\Lambda$, where $I[\mathcal{F}]=\\{\lambda_{e_{1}},\dots,\lambda_{e_{l}}\\}$ and $I[\mathcal{\overline{F}}]=I-I[\mathcal{F}]$. Then by Lemma 16, the probability vector on $\mathcal{F}$ is Dirichlet, where $\theta_{I[\mathcal{F}]}\thicksim\operatorname{Dir}\left((\alpha_{e_{i}})_{i\in\\{1,\dots,l\\}}\right)$ ## References * [1] R. G. Cowell, A. P. Dawid, S. L. Lauritzen, D. J. Spiegelhalter, Probabilistic Networks and Expert Systems, Springer, 1999. * [2] S. L. Lauritzen, Graphical Models (Oxford Statistical Science Series), Oxford University Press, USA, 1996. * [3] D. Poole, N. L. Zhang, Exploiting contextual independence in probabilistic inference, J. Artificial Intelligence Res. 18 (2003) 263–313. * [4] J. Q. Smith, P. E. Anderson, Conditional independence and chain event graphs, Artificial Intelligence 172 (1) (2008) 42–68. * [5] G. Shafer, The Art of Causal Conjecture, Artificial Intelligence, The MIT Press, 1996. * [6] D. G. T. Denison, C. C. Holmes, B. K. Mallick, A. F. M. Smith, Bayesian Methods for Nonlinear Classification and Regression, Wiley Series in Probability and Statistics, Wiley, 2002. * [7] R. Castelo, The discrete acyclic digraph markov model in data mining, Ph.D. thesis, Faculteit Wiskunde en Informatica, Universiteit Utrecht (Apr. 2002). * [8] D. Heckerman, A tutorial on learning with bayesian networks, in: M. I. Jordan (Ed.), Learning in Graphical Models, MIT Press, 1999, pp. 301–354. * [9] D. J. Spiegelhalter, S. L. Lauritzen, Sequential updating of conditional probabilities on directed graphical structures, Networks 20 (5) (1990) 579–605. * [10] J. Bernardo, A. F. M. Smith, Bayesian Theory, Wiley, Chichester, England, 1994. * [11] J. W. Lau, P. J. Green, Bayesian Model-Based clustering procedures, Journal of Computational and Graphical Statistics 16 (3) (2007) 526–558. * [12] S. Richardson, P. J. Green, On bayesian analysis of mixtures with an unknown number of components, Journal of the Royal Statistical Society. Series B (Methodological) 59 (4) (1997) 731–792. * [13] N. A. Heard, C. C. Holmes, D. A. Stephens, A quantitative study of gene regulation involved in the immune response of anopheline mosquitoes: An application of bayesian hierarchical clustering of curves, Journal of the American Statistical Association 101 (473) (2006) 18–29. * [14] D. Geiger, D. Heckerman, A characterization of the dirichlet distribution through global and local parameter independence, The Annals of Statistics 25 (3) (1997) 1344–1369. * [15] D. Heckerman, M. P. Wellman, Bayesian networks, Communications of the ACM 38 (3) (1995) 27–30. * [16] J. Cussens, Bayesian network learning by compiling to weighted MAX-SAT, in: D. A. McAllester, P. Myllymäki (Eds.), Proceedings of the 24th Conference in Uncertainty in Artificial Intelligence, AUAI Press, Helsinki, Finland, 2008, pp. 105–112. * [17] S. Kotz, N. Balakrishnan, N. L. Johnson, Continuous Multivariate Distributions, 2nd Edition, Wiley series in probability and statistics. Applied probability and statistics, Wiley, New York, 2000. * [18] C. E. Weatherburn, A first course in mathematical statistics, 2nd Edition, CUP, 1949. * [19] S. S. Wilks, Mathematical Statistics, Wiley, New York, 1962.
arxiv-papers
2009-04-06T17:51:33
2024-09-04T02:49:01.734931
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Guy Freeman and Jim Q. Smith", "submitter": "Guy Freeman", "url": "https://arxiv.org/abs/0904.0977" }
0904.0981
1em1em # Dependency Pairs and Polynomial Path Orders††thanks: This research is partially supported by FWF (Austrian Science Fund) projects P20133. Martin Avanzini and Georg Moser {martin.avanzini georg.moser}@uibk.ac.at (March 2009) ###### Abstract We show how polynomial path orders can be employed efficiently in conjunction with weak innermost dependency pairs to automatically certify polynomial runtime complexity of term rewrite systems and the polytime computability of the functions computed. The established techniques have been implemented and we provide ample experimental data to assess the new method. ###### Contents 1. 1 Introduction 2. 2 The Polynomial Path Order on Sequences 3. 3 Complexity Analysis Based on the Dependency Pair Method 4. 4 The Polynomial Path Order over Quasi-Precedences 5. 5 Dependency Pairs and Polynomial Path Orders 6. 6 Experimental Results 7. 7 Conclusion 8. A Appendix 1. A.1 Proof of Theorem 5.11 2. A.2 Proof of Theorem 5.14 ## 1 Introduction In order to measure the complexity of a (terminating) term rewrite system (TRS for short) it is natural to look at the maximal length of derivation sequences—the _derivation length_ —as suggested by Hofbauer and Lautemann in Hofbauer and Lautemann (1989). More precisely, the _runtime complexity function_ with respect to a (finite and terminating) TRS $\mathcal{R}$ relates the maximal derivation length to the size of the initial term, whenever the set of initial terms is restricted to constructor based terms, also called _basic_ terms. The restriction to basic terms allows us to accurately express the complexity of a program through the runtime complexity of TRSs. In this paper we study and combine recent efforts for the _automatic_ analysis of runtime complexities of TRSs. In Avanzini and Moser (2008) we introduced a restriction of the multiset path order, called _polynomial path order_ (_$\textsc{POP}^{\ast}$_ for short) that induces polynomial runtime complexity if restricted to innermost rewriting. The definition of $\textsc{POP}^{\ast}$ employs the idea of _tiered recursion_ Simmons (1988). Syntactically this amounts to a separation of arguments into _normal_ and _safe_ arguments, cf. Bellantoni and Cook (1992). Furthermore, Hirokawa and the second author introduced a variant of dependency pairs, dubbed _weak dependency pairs_ , that makes the dependency pair method applicable in the context of complexity analysis, cf. Hirokawa and Moser (2008b, a). We show how weak innermost dependency pairs can be successfully applied in conjunction with $\textsc{POP}^{\ast}$. The following example (see Fuhs et al. (2007)) motivates this study. Consider the TRS $\mathcal{R}_{\textsf{bin}}$ encoding the function $\lambda x.\lceil{\log(x+1)}\rceil$ for natural numbers given as tally sequences: $\displaystyle 1\colon$ $\displaystyle\mathsf{half}(\mathsf{0})$ $\displaystyle\to\mathsf{0}$ $\displaystyle 4\colon$ $\displaystyle\mathsf{bits}(\mathsf{0})$ $\displaystyle\to\mathsf{0}$ $\displaystyle 2\colon$ $\displaystyle\mathsf{half}(\mathsf{s}(\mathsf{0}))$ $\displaystyle\to\mathsf{0}$ $\displaystyle 5\colon$ $\displaystyle\mathsf{bits}(\mathsf{s}(\mathsf{0}))$ $\displaystyle\to\mathsf{s}(\mathsf{0})$ $\displaystyle 3\colon$ $\displaystyle\mathsf{half}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\to\mathsf{s}(\mathsf{half}(x))$ $\displaystyle\hskip 8.61108pt6\colon$ $\displaystyle\mathsf{bits}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\to\mathsf{s}(\mathsf{bits}(\mathsf{s}(\mathsf{half}(x))))$ It is easy to see that the TRS $\mathcal{R}_{\textsf{bin}}$ is not compatible with $\textsc{POP}^{\ast}$, even if we allow quasi-precedences, see Section 4. On the other hand, employing (weak innermost) dependency pairs, argument filtering, and the usable rules criteria in conjunction with $\textsc{POP}^{\ast}$, polynomial innermost runtime complexity of $\mathcal{R}_{\textsf{bin}}$ can be shown fully automatically. The combination of dependency pairs and polynomial path orders, while conceptually quite clear, turns out to be technical involved. One of the first obstacles one encounters is that the pair $(\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}},\mathrel{{>}_{\mathsf{pop*}}})$ cannot be used as a reduction pair in the spirit of Hirokawa and Moser (2008b), as $\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}$ fails to be closed under contexts. Conclusively, we start from scratch and study polynomial path orders in the context of _relative rewriting_ Geser (1990). Based on this study an incorporation of argument filterings becomes possible so that we can employ the pair $(\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}},\mathrel{{>}^{\pi}_{\mathsf{pop*}}})$ in conjunction with dependency pairs successfully. Here, $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$ refers to the order obtained by combining $\mathrel{{>}_{\mathsf{pop*}}}$ with the argument filtering $\pi$ as expected, and $\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}$ denotes the extension of $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$ by term equivalence, preserving the separation of safe and normal argument positions. Note that for polynomial path orders, the integration of argument filterings is not only non-trivial, but indeed a challenging task. This is mainly due to the embodiment of tiered recursion in $\textsc{POP}^{\ast}$. Thus we establish a combination of two syntactic techniques in complexity analysis. The experimental evidence given below indicates the power and in particular the efficiency of the provided results. Our next contribution is concerned with _implicit complexity theory_ , see for example Bonfante et al. (2009). A careful analyis of our main result shows that polynomial path orders in conjunction with (weak innermost) dependency pairs even induce polytime computability of the functions defined by the TRS studied. This result fits well with recent results by Marion and Péchoux on the use of restricted forms of the dependency pair method to charcterise complexity classes like PTIME or PSPACE, cf. Marion and Péchoux (2008). Note that both results allow to conclude, based on different restrictions, polytime computability of the functions defined by constructor TRSs, whose termination can be shown by the dependency pair method. Note that the results in Marion and Péchoux (2008) also capture programs admitting infeasible runtime complexities but define functions that are computable in polytime if suitable (and non-trivial) program transformations are used. Such programs are outside the scope of our results. Thus it seems that our results more directly assess the complexity of the given programs. Note that our tool provides (for the first time) a fully automatic application of the dependency pair method in the context of implicit complexity theory.111In this context it is perhaps interesting to note that for a variant of the TRS $\mathcal{R}_{\textsf{bin}}$, studied in Marion and Péchoux (2008), our tool verifies polytime computability fully automatically. See also Avanzini et al. (2008) for the description of a small tool that implements related characterisations of of the class of polynomial time computable functions. The rest of the paper is organised as follows. In Section 2 we present basic notions and recall (briefly) the _path order for FP_ from Arai and Moser (2005). We then briefly recall dependency pairs in the context of complexity analysis from Hirokawa and Moser (2008b, a), cf. Section 3. In Section 4 we present polynomial path orders over quasi-precedences. Our main results are presented in Section 5. We continue with experimental results in Section 6, and conclude in Section 7. ## 2 The Polynomial Path Order on Sequences We assume familiarity with the basics of term rewriting, see Baader and Nipkow (1998); Terese (2003). Let $\mathcal{V}$ denote a countably infinite set of variables and $\mathcal{F}$ a signature, containing at least one constant. The set of terms over $\mathcal{F}$ and $\mathcal{V}$ is denoted as $\mathcal{T}(\mathcal{F},\mathcal{V})$ and the set of ground terms as $\mathcal{T}(\mathcal{F})$. We write $\operatorname{\mathsf{Fun}}(t)$ and $\operatorname{\mathsf{Var}}(t)$ for the set of function symbols and variables appearing in $t$, respectively. The root symbol $\operatorname{\mathsf{rt}}(t)$ of a term $t$ is defined as usual and the (proper) subterm relation is denoted as $\mathrel{\unlhd}$ ($\mathrel{\lhd}$). We write $s|_{p}$ for the _subterm_ of $s$ at position $p$. The _size_ $\lvert{t}\rvert$ of a term $t$ is defined as usual and the _width_ of $t$ is defined as $\operatorname{\mathsf{width}}(t)\mathrel{:=}\max\\{{n,{\operatorname{\mathsf{width}}}({t}_{1}),\ldots,{\operatorname{\mathsf{width}}}({t}_{n})}\\}$ if $t=f({t}_{1},\ldots,{t}_{n})$ and $n>0$ or $\operatorname{\mathsf{width}}(t)=1$ else. Let $\succsim$ be a preorder on the signature $\mathcal{F}$, called _quasi-precedence_ or simply _precedence_. Based on $\succsim$ we define an equivalence $\approx$ on terms: $s\approx t$ if either (i) $s=t$ or (ii) $s=f({s}_{1},\ldots,{s}_{n})$, $t=g({t}_{1},\ldots,{t}_{n})$, $f\approx g$ and there exists a permutation $\pi$ such that $s_{i}\approx t_{\pi(i)}$. For a preorder $\succsim$, we use $\mathrel{\succsim}^{\mathsf{mul}}$ for the multiset extension of $\succsim$, which is again a preorder. The proper order (equivalence) induced by $\mathrel{\succsim}^{\mathsf{mul}}$ is written as $\mathrel{\succ}^{\mathsf{mul}}$ ($\mathrel{\approx}^{\mathsf{mul}}$). A _term rewrite system_ (_TRS_ for short) $\mathcal{R}$ over $\mathcal{T}(\mathcal{F},\mathcal{V})$ is a _finite_ set of rewrite rules $l\to r$, such that $l\notin\mathcal{V}$ and $\operatorname{\mathsf{Var}}(l)\supseteq\operatorname{\mathsf{Var}}(r)$. We write $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathcal{R}}}$ ($\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}$) for the induced (innermost) rewrite relation. The set of defined function symbols is denoted as $\mathcal{D}$, while the constructor symbols are collected in $\mathcal{C}$, clearly $\mathcal{F}=\mathcal{D}\cup\mathcal{C}$. We use $\operatorname{\mathsf{NF}}(\mathcal{R})$ to denote the set of normal forms of $\mathcal{R}$ and set $\mathsf{Val}\mathrel{:=}\mathcal{T}(\mathcal{C},\mathcal{V})$, the elements of $\mathsf{Val}$ are called _values_. A TRS is called _completely defined_ if normal forms coincide with values. We define $\mathcal{T}_{\mathsf{b}}\mathrel{:=}\\{f({v}_{1},\ldots,{v}_{n})\mid f\in\mathcal{D}\text{ and }v_{i}\in\mathsf{Val}\\}$ as the set of _basic terms_. A TRS $\mathcal{R}$ is a _constructor TRS_ if $l\in\mathcal{T}_{\mathsf{b}}$ for all ${l\to r}\in\mathcal{R}$. Let $\mathcal{Q}$ denote a TRS. The _generalised restricted rewrite relation $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{Q}$}}}_{\mathcal{R}}}$_ is the restriction of $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathcal{R}}}$ where all arguments of the redex are in normal form with respect to the TRS $\mathcal{Q}$ (see Thiemann (2007)). We define the (innermost) relative rewriting relation (denoted as $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}/\mathcal{S}}}$) as follows: ${\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}/\mathcal{S}}}}\mathrel{:=}{{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}^{\ast}_{\mathcal{S}}}}\cdot{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}_{\mathcal{R}}}}\cdot{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}^{\ast}_{\mathcal{S}}}}}\hbox to0.0pt{$\;$.\hss}$ Similarly, we set ${\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}}\mathrel{:=}{{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}^{\ast}_{\mathcal{S}}}}\cdot{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}^{\varepsilon}_{\mathcal{R}}}}\cdot{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{R}\cup\mathcal{S}$}}}^{\ast}_{\mathcal{S}}}}}$, to define an _(innermost) relative root-step_. A _polynomial interpretation_ is a well-founded and monotone algebra $(\mathcal{A},>)$ with carrier $\mathbb{N}$ such that $>$ is the usual order on natural numbers and all interpretation functions $f_{\mathcal{A}}$ are polynomials. Let $\alpha\colon\mathcal{V}\to\mathcal{A}$ denote an _assignment_ , then we write $[\alpha]_{\mathcal{A}}(t)$ for the evaluation of term $t$ with respect to $\mathcal{A}$ and $\alpha$. A polynomial interpretation is called a _strongly linear interpretation_ (_SLI_ for short) if all function symbols are interpreted by _weight functions_ $f_{\mathcal{A}}({x}_{1},\ldots,{x}_{n})=\sum_{i=1}^{n}x_{i}+c$ with $c\in\mathbb{N}$. The _derivation length_ of a terminating term $s$ with respect to $\to$ is defined as $\operatorname{dl}(s,\to)\mathrel{:=}\max\\{{n\mid\exists t.\;s\to^{n}t}\\}$, where $\to^{n}$ denotes the $n$-fold application of $\to$. The _innermost runtime complexity function_ $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ with respect to a TRS $\mathcal{R}$ is defined as $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}(n)\mathrel{:=}\max\\{\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})\mid\text{$t\in\mathcal{T}_{\mathsf{b}}$ and $\lvert{t}\rvert\leqslant n$}\\}$. If no confusion can arise $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is simply called _runtime complexity function_. Below we recall the bare essentials of the polynomial path order $\mathrel{\blacktriangleright}$ on sequences (POP for short) as put forward in Arai and Moser (2005). We kindly refer the reader to Arai and Moser (2005); Avanzini and Moser (2008) for motivation and examples. We recall the definition of _finite approximations $\mathrel{\blacktriangleright}_{k}^{l}$_ of $\mathrel{\blacktriangleright}$. The latter is conceived as the _limit_ of these approximations. The domain of this order are so called _sequences_ $\operatorname{\mathcal{S}eq}(\mathcal{F},\mathcal{V})\mathrel{:=}\mathcal{T}(\mathcal{F}\cup\\{\circ\\},\mathcal{V})$. Here $\mathcal{F}$ is a finite signature and $\circ\not\in\mathcal{F}$ a fresh variadic function symbol, used to form sequences. We denote sequences $\circ({s}_{1},\ldots,{s}_{n})$ by $[{s}_{1}\cdots{s}_{n}]$ and write $a\mathrel{::}[{b}_{1}\cdots{b}_{n}]$ for the sequence $[a\leavevmode\nobreak\ {b}_{1}\cdots{b}_{n}]$. Let $\succsim$ denote a precedence. The order $\mathrel{\blacktriangleright}_{k}^{l}$ is based on an auxiliary order $\mathrel{\gtrdot}_{k}^{l}$ (and the equivalence $\approx$ on terms defined above). Below we set ${\mathrel{\not{\gtrsim}}_{k}^{l}}\mathrel{:=}{\mathrel{\gtrdot}_{k}^{l}}\cup{\approx}$. We write ${\not{\\{}}t_{1},\dots,t_{n}{\not{\\}}}$ to denote multisets and $\uplus$ for the multiset sum. ###### Definition 2.1. Let $k,l\geqslant 1$. The order $\mathrel{\gtrdot}_{k}^{l}$ induced by $\succsim$ is inductively defined as follows: $s\mathrel{\gtrdot}_{k}^{l}t$ for $s=f({s}_{1},\ldots,{s}_{n})$ or $s=[{s}_{1}\cdots{s}_{n}]$ if either 1. (i) $s_{i}\leavevmode\nobreak\ \mathrel{\not{\gtrsim}}_{k}^{l}\leavevmode\nobreak\ t$ for some $i\in\\{{1,\dots,n}\\}$, or 2. (ii) $s=f({s}_{1},\ldots,{s}_{n})$, $t=g({t}_{1},\ldots,{t}_{m})$ with $f\succ g$ or $t=[{t}_{1}\cdots{t}_{m}]$, $s\mathrel{\gtrdot}_{k}^{l-1}t_{j}$ for all $j\in\\{{1,\dots,m}\\}$, and $m<k+\operatorname{\mathsf{width}}(s)$, 3. (iii) $s=[{s}_{1}\cdots{s}_{n}]$, $t=[{t}_{1}\cdots{t}_{m}]$ and the following properties hold: * – ${\not{\\{}}{t}_{1},\ldots,{t}_{m}{\not{\\}}}=N_{1}\uplus\cdots\uplus N_{n}$ for some multisets $N_{1},\dots,N_{n}$, and * – there exists $i\in\\{{1,\dots,n}\\}$ such that ${\not{\\{}}s_{i}{\not{\\}}}\not\approx^{\mathsf{mul}}N_{i}$, and * – for all $1\leqslant i\leqslant n$ such that ${\not{\\{}}s_{i}{\not{\\}}}\not\approx^{\mathsf{mul}}N_{i}$ we have $s_{i}\mathrel{\gtrdot}_{k}^{l}r$ for all $r\in N_{i}$, and $m<k+\operatorname{\mathsf{width}}(s)$. ###### Definition 2.2. Let $k,l\geqslant 1$. The _approximation $\mathrel{\blacktriangleright}_{k}^{l}$ of the polynomial path order on sequences_ induced by $\succsim$ is inductively defined as follows: $s\mathrel{\blacktriangleright}_{k}^{l}t$ for $s=f({s}_{1},\ldots,{s}_{n})$ or $s=[{s}_{1}\cdots{s}_{n}]$ if either $s\mathrel{\gtrdot}_{k}^{l}t$ or 1. (i) $s_{i}\mathrel{\not{\gtrsim}}_{k}^{l}t$ for some $i\in\\{{1,\dots,n}\\}$, 2. (ii) $s=f({s}_{1},\ldots,{s}_{n})$, $t=[{t}_{1}\cdots{t}_{m}]$, and the following properties hold: * – $s\mathrel{\blacktriangleright}_{k}^{l-1}t_{j_{0}}$ for some $j_{0}\in\\{{1,\dots,m}\\}$, * – $s\mathrel{\gtrdot}_{k}^{l-1}t_{j}$ for all $j\neq j_{0}$, and $m<k+\operatorname{\mathsf{width}}(s)$, 3. (iii) $s=f({s}_{1},\ldots,{s}_{n})$, $t=g({t}_{1},\ldots,{t}_{m})$, $f\sim g$ and $[{s}_{1}\cdots{s}_{n}]\mathrel{\blacktriangleright}_{k}^{l}[{t}_{1}\cdots{t}_{m}]$, or 4. (iv) $s=[{s}_{1}\cdots{s}_{n}]$, $t=[{t}_{1}\cdots{t}_{m}]$ and the following properties hold: * – ${\not{\\{}}{t}_{1},\ldots,{t}_{m}{\not{\\}}}=N_{1}\uplus\cdots\uplus N_{n}$ for some multisets $N_{1},\dots,N_{n}$, and * – there exists $i\in\\{{1,\dots,n}\\}$ such that ${\not{\\{}}s_{i}{\not{\\}}}\not\approx^{\mathsf{mul}}N_{i}$, and * – for all $1\leqslant i\leqslant n$ such that ${\not{\\{}}s_{i}{\not{\\}}}\not\approx^{\mathsf{mul}}N_{i}$ we have $s_{i}\mathrel{\blacktriangleright}_{k}^{l}r$ for all $r\in N_{i}$, and $m<k+\operatorname{\mathsf{width}}(s)$. Above we set ${\mathrel{\not{\gtrsim}}_{k}^{l}}\mathrel{:=}{\mathrel{\blacktriangleright}_{k}^{l}}\cup{\approx}$ and abbreviate $\mathrel{\blacktriangleright}_{k}^{k}$ as $\mathrel{\blacktriangleright}_{k}$ in the following. Note that the empty sequence is minimal with respect to both orders. It is easy to see that for $k\leqslant l$, we have ${\mathrel{\gtrdot}_{k}}\subseteq{\mathrel{\gtrdot}_{l}}$ and ${\mathrel{\blacktriangleright}_{k}}\subseteq{\mathrel{\blacktriangleright}_{l}}$. Note that $s\mathrel{\blacktriangleright}_{k}t$ implies that $\operatorname{\mathsf{width}}(t)<\operatorname{\mathsf{width}}(s)+k$. For a fixed approximation $\mathrel{\blacktriangleright}_{k}$, we define the length of its longest decent as follows: $\mathsf{G}_{k}(t)\mathrel{:=}\max\\{{n\mid t=t_{0}\mathrel{\blacktriangleright}_{k}t_{1}\mathrel{\blacktriangleright}_{k}\dots\mathrel{\blacktriangleright}_{k}t_{n}}\\}$. The following proposition is a reformulation of (Arai and Moser, 2005, Lemma 6). ###### Proposition 2.3. Let $k\in\mathbb{N}$. There exists a polynomial interpretation $\mathcal{A}$ such that $\mathsf{G}_{k}(t)\leqslant[\alpha]_{\mathcal{A}}(t)$ for all assignments $\alpha\,\colon\,\mathcal{V}\to\mathbb{N}$. As a consequence, for all terms $f({t}_{1},\ldots,{t}_{n})$ with $[\alpha]_{\mathcal{A}}(t_{i})=\operatorname{\mathsf{O}}(\lvert{t_{i}}\rvert)$, $\mathsf{G}_{k}(f({t}_{1},\ldots,{t}_{n}))$ is bounded by a polynomial $p$ in the size of $t$, where $p$ depends on $k$ only. Observe that the polynomial interpretation $\mathcal{A}$ as employed in the proposition fulfils: $\circ_{\mathcal{A}}({m}_{1},\ldots,{m}_{n})=\sum_{i=1}^{n}m_{i}+n$. In particular, we have $[\alpha]_{\mathcal{A}}([])=0$. ## 3 Complexity Analysis Based on the Dependency Pair Method In this section, we briefly recall the central definitions and results established in Hirokawa and Moser (2008b, a). We kindly refer the reader to Hirokawa and Moser (2008b, a) for further examples and underlying intuitions. Let $\mathcal{X}$ be a set of symbols. We write $C\langle{t}_{1},\ldots,{t}_{n}\rangle_{\mathcal{X}}$ to denote $C[{t}_{1},\ldots,{t}_{n}]$, whenever $\operatorname{\mathsf{rt}}(t_{i})\in\mathcal{X}$ for all $i\in\\{{1,\dots,n}\\}$ and $C$ is a $n$-hole context containing no symbols from $\mathcal{X}$. We set $\mathcal{D}^{\sharp}\mathrel{:=}\mathcal{D}\cup\\{{f^{\sharp}\mid f\in\mathcal{D}}\\}$ with each $f^{\sharp}$ a fresh function symbol. Further, for $t=f({t}_{1},\ldots,{t}_{n})$ with $f\in\mathcal{D}$, we set $t^{\sharp}\mathrel{:=}f^{\sharp}({t}_{1},\ldots,{t}_{n})$. ###### Definition 3.1. Let $\mathcal{R}$ be a TRS. If $l\to r\in\mathcal{R}$ and $r=C\langle{u}_{1},\ldots,{u}_{n}\rangle_{\mathcal{D}}$ then $l^{\sharp}\to\operatorname{COM}(u_{1}^{\sharp},\ldots,u_{n}^{\sharp})$ is called a _weak innermost dependency pair_ of $\mathcal{R}$. Here $\operatorname{COM}(t)=t$ and $\operatorname{COM}({t}_{1},\ldots,{t}_{n})=\mathsf{c}(t_{1},\ldots,t_{n})$, $n\not=1$, for a fresh constructor symbol $\mathsf{c}$, the _compound symbol_. The set of all weak innermost dependency pairs is denoted by $\mathsf{WIDP}(\mathcal{R})$. ###### Example 3.2. Reconsider the example $\mathcal{R}_{\textsf{bits}}$ from the introduction. The set of weak innermost dependency pairs $\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}})$ is given by $\displaystyle 7\colon$ $\displaystyle\mathsf{half}^{\sharp}(\mathsf{0})$ $\displaystyle\to\mathsf{c_{1}}$ $\displaystyle 10\colon$ $\displaystyle\mathsf{bits}^{\sharp}(\mathsf{0})$ $\displaystyle\to\mathsf{c_{3}}$ $\displaystyle 8\colon$ $\displaystyle\mathsf{half}^{\sharp}(\mathsf{s}(\mathsf{0}))$ $\displaystyle\to\mathsf{c_{2}}$ $\displaystyle 11\colon$ $\displaystyle\mathsf{bits}^{\sharp}(\mathsf{s}(\mathsf{0}))$ $\displaystyle\to\mathsf{c_{4}}$ $\displaystyle 9\colon$ $\displaystyle\mathsf{half}^{\sharp}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\to\mathsf{half}^{\sharp}(x)$ $\displaystyle\hskip 12.91663pt12\colon$ $\displaystyle\mathsf{bits}^{\sharp}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\to\mathsf{bits}^{\sharp}(\mathsf{s}(\mathsf{half}(x)))$ We write $f\rhd_{\mathrm{d}}g$ if there exists a rewrite rule $l\to r\in\mathcal{R}$ such that $f=\operatorname{\mathsf{rt}}(l)$ and $g$ is a defined symbol in $\operatorname{\mathsf{Fun}}(r)$. For a set $\mathcal{G}$ of defined symbols we denote by $\mathcal{R}{\restriction}\mathcal{G}$ the set of rewrite rules $l\to r\in\mathcal{R}$ with $\operatorname{\mathsf{rt}}(l)\in\mathcal{G}$. The set $\mathcal{U}(t)$ of usable rules of a term $t$ is defined as $\mathcal{R}{\restriction}\\{{g\mid\text{$f\rhd_{\mathrm{d}}^{*}g$ for some $f\in\operatorname{\mathsf{Fun}}(t)$}}\\}$. Finally, we define $\mathcal{U}(\mathcal{P})=\bigcup_{l\to r\in\mathcal{P}}\mathcal{U}(r)$. ###### Example 3.3 (Example 3.2 continued). The usable rules of $\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}})$ consist of the following rules: $1\colon\mathsf{half}(\mathsf{0})\to\mathsf{0}$, $2\colon\mathsf{half}(\mathsf{s}(\mathsf{0}))\to\mathsf{0}$, and $3\colon\mathsf{half}(\mathsf{s}(\mathsf{s}(x)))\to\mathsf{half}(x)$. The following proposition allows the analysis of the (innermost) runtime complexity through the study of (innermost) relative rewriting, see Hirokawa and Moser (2008b) for the proof. ###### Proposition 3.4. Let $\mathcal{R}$ be a TRS, let $t$ be a basic terminating term, and let $\mathcal{P}=\mathsf{WIDP}(\mathcal{R})$. Then $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})\leqslant\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{U}(\mathcal{P})\,\cup\,\mathcal{P}}})$. Moreover, if $\mathcal{P}$ is non-duplicating and ${\mathcal{U}(\mathcal{P})}\subseteq{>_{\mathcal{A}}}$ for some SLI $\mathcal{A}$. Then there exist constants $K,L\geqslant 0$ (depending on $\mathcal{P}$ and $\mathcal{A}$ only) such that $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})\leqslant K\cdot\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}(\mathcal{P})}})+L\cdot\lvert{t^{\sharp}}\rvert$. This approach admits also an integration of _dependency graphs_ Arts and Giesl (2000) in the context of complexity analysis. The nodes of the _weak innermost dependency graph_ $\mathsf{WIDG}(\mathcal{R})$ are the elements of $\mathcal{P}$ and there is an arrow from $s\to t$ to $u\to v$ if there exist a context $C$ and substitutions $\sigma$, $\tau$ such that $t\sigma\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{R}}}C[u\tau]$. Let $\mathcal{G}=\mathsf{WIDG}(\mathcal{R})$; a _strongly connected component_ (_SCC_ for short) in $\mathcal{G}$ is a maximal _strongly connected subgraph_. We write ${\mathcal{G}}/_{\\!\equiv}$ for the _congruence graph_ , where $\equiv$ is the equivalence relation induced by SCCs. ###### Example 3.5 (Example 3.2 continued). $\mathcal{G}=\mathsf{WIDG}(\mathcal{R}_{\textsf{bits}})$ consists of the nodes (7)–(12) as mentioned in Example 3.2 and has the following shape: 798101211 The only non-trivial SCCs in $\mathcal{G}$ are $\\{9\\}$ and $\\{12\\}$. Hence ${\mathcal{G}}/_{\\!\equiv}$ consists of the nodes $[7]_{\equiv}$–$[12]_{\equiv}$, and edges $([a]_{\equiv},[b]_{\equiv})$ for edges $(a,b)$ in $\mathcal{G}$. Here $[a]_{\equiv}$ denotes the equivalence class of $a$. We set $\operatorname{\mathsf{L}}(t)\mathrel{:=}\max\\{{\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}_{m}/\mathcal{S}}})\mid\text{$(\mathcal{P}_{1},\ldots,\mathcal{P}_{m})$ a path in ${\mathcal{G}}/_{\\!\equiv}$, $\mathcal{P}_{1}\in\mathsf{Src}$}}\\}$, where $\mathsf{Src}$ denote the set o f source nodes from ${\mathcal{G}}/_{\\!\equiv}$ and $\mathcal{S}=\mathcal{P}_{1}\cup\cdots\cup\mathcal{P}_{m-1}\cup\mathcal{U}(\mathcal{P}_{1}\cup\cdots\cup\mathcal{P}_{m})$. The proposition allows the use of different techniques to analyse polynomial runtime complexity on separate paths, cf. Hirokawa and Moser (2008a). ###### Proposition 3.6. Let $\mathcal{R}$, $\mathcal{P}$, and $t$ be as above. Then there exists a polynomial $p$ (depending only on $\mathcal{R}$) such that $\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}(\mathcal{P})}})\leqslant p(\operatorname{\mathsf{L}}(t^{\sharp}))$. ## 4 The Polynomial Path Order over Quasi-Precedences In this section, we briefly recall the central definitions and results established in Avanzini and Moser (2008); Avanzini et al. (2008) on the _polynomial path order_. We employ the variant of $\textsc{POP}^{\ast}$ based on quasi-precendences, cf. Avanzini et al. (2008). As mentioned in the introduction, $\textsc{POP}^{\ast}$ relies on tiered recursion, which is captured by the notion of _safe mapping_. A _safe mapping_ $\operatorname{\mathsf{safe}}$ is a function that associates with every $n$-ary function symbol $f$ the set of _safe argument positions_. If $f\in\mathcal{D}$ then $\operatorname{\mathsf{safe}}(f)\subseteq\\{{1,\dots,n}\\}$, for $f\in\mathcal{C}$ we fix $\operatorname{\mathsf{safe}}(f)=\\{{1,\dots,n}\\}$. The argument positions not included in $\operatorname{\mathsf{safe}}(f)$ are called _normal_ and denoted by $\operatorname{\mathsf{nrm}}(f)$. We extend $\operatorname{\mathsf{safe}}$ to terms $t\not\in\mathcal{V}$ as follows: we define $\operatorname{\mathsf{safe}}(f({t}_{1},\ldots,{t}_{n}))\mathrel{:=}\\{{t_{i_{1}},\dots,t_{i_{p}}}\\}$ where $\operatorname{\mathsf{safe}}(f)=\\{{{i}_{1},\ldots,{i}_{p}}\\}$, likewise we define $\operatorname{\mathsf{nrm}}(f({t}_{1},\ldots,{t}_{n}))\mathrel{:=}\\{{t_{j_{1}},\dots,t_{j_{q}}}\\}$ where $\operatorname{\mathsf{nrm}}(f)=\\{{{j}_{1},\ldots,{j}_{q}}\\}$. Not every precedence is suitable for $\mathrel{{>}_{\mathsf{pop*}}}$, in particular we need to assert that constructors are minimal. We say that a precedence $\succsim$ is _admissible_ for $\textsc{POP}^{\ast}$ if the following is satisfied: (i) $f\succ g$ with $g\in\mathcal{D}$ implies $f\in\mathcal{D}$, and (ii) if $f\approx g$ then $f\in\mathcal{D}$ if and only if $g\in\mathcal{D}$. In the sequel we assume any precedence is admissible. We extend the equivalence $\approx$ to the context of safe mapping: $s\mathrel{\text{\raisebox{-1.00006pt}{$\stackrel{{\scriptstyle\text{{\raisebox{-0.70004pt}{\tiny{$\operatorname{\mathsf{safe}}$}}}}}}{{\approx}}$}}}t$, if (i) $s=t$, or (ii) $s=f({s}_{1},\ldots,{s}_{n})$, $t=g({t}_{1},\ldots,{t}_{n})$, $f\approx g$ and there exists a permutation $\pi$ so that $s_{i}\mathrel{\text{\raisebox{-1.00006pt}{$\stackrel{{\scriptstyle\text{{\raisebox{-0.70004pt}{\tiny{$\operatorname{\mathsf{safe}}$}}}}}}{{\approx}}$}}}t_{\pi(i)}$, where $i\in\operatorname{\mathsf{safe}}(f)$ if and only if $\pi(i)\in\operatorname{\mathsf{safe}}(g)$ for all $i\in\\{{1,\dots,n}\\}$. Similar to POP, the definition of the polynomial path order $\mathrel{{>}_{\mathsf{pop*}}}$ makes use of an auxiliary order $\mathrel{{>}_{\mathsf{pop}}}$. ###### Definition 4.1. The auxiliary order $\mathrel{{>}_{\mathsf{pop}}}$ induced by $\succsim$ and $\operatorname{\mathsf{safe}}$ is inductively defined as follows: $s=f({s}_{1},\ldots,{s}_{n})\mathrel{{>}_{\mathsf{pop}}}t$ if either 1. (i) $s_{i}\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop}$}}}$}}}t$ for some $i\in\\{{1,\dots,n}\\}$, and if $f\in\mathcal{D}$ then $i\in\operatorname{\mathsf{nrm}}(f)$, or 2. (ii) $t=g({t}_{1},\ldots,{t}_{m})$, $f\succ g$, $f\in\mathcal{D}$ and $s\mathrel{{>}_{\mathsf{pop}}}t_{j}$ for all $j\in\\{{1,\dots,m}\\}$. ###### Definition 4.2. The _polynomial path order_ $\mathrel{{>}_{\mathsf{pop*}}}$ induced by $\succsim$ and $\operatorname{\mathsf{safe}}$ is inductively defined as follows: $s=f({s}_{1},\ldots,{s}_{n})\mathrel{{>}_{\mathsf{pop*}}}t$ if either $s\mathrel{{>}_{\mathsf{pop}}}t$ or 1. (i) $s_{i}\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}t$ for some $i\in\\{{1,\dots,n}\\}$, or 2. (ii) $t=g({t}_{1},\ldots,{t}_{m})$, $f\succ g$, $f\in\mathcal{D}$, and * – $s\mathrel{{>}_{\mathsf{pop*}}}t_{j_{0}}$ for some $j_{0}\in\operatorname{\mathsf{safe}}(g)$, and * – for all $j\neq j_{0}$ either $s\mathrel{{>}_{\mathsf{pop}}}t_{j}$, or $s\rhd t_{j}$ and $j\in\operatorname{\mathsf{safe}}(g)$, or 3. (iii) $t=g({t}_{1},\ldots,{t}_{m})$, $f\approx g$, $\operatorname{\mathsf{nrm}}(s)\mathrel{>_{\mathsf{pop*}}^{\mathsf{mul}}}\operatorname{\mathsf{nrm}}(t)$ and $\operatorname{\mathsf{safe}}(s)\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\mathsf{mul}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}\operatorname{\mathsf{safe}}(t)$. Above we set ${\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop}$}}}$}}}}\mathrel{:=}{\mathrel{{>}_{\mathsf{pop}}}}\cup{\mathrel{\text{\raisebox{-1.00006pt}{$\stackrel{{\scriptstyle\text{{\raisebox{-0.70004pt}{\tiny{$\operatorname{\mathsf{safe}}$}}}}}}{{\approx}}$}}}}$ and ${\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}\mathrel{:=}{\mathrel{{>}_{\mathsf{pop*}}}}\cup{\mathrel{\text{\raisebox{-1.00006pt}{$\stackrel{{\scriptstyle\text{{\raisebox{-0.70004pt}{\tiny{$\operatorname{\mathsf{safe}}$}}}}}}{{\approx}}$}}}}$ below. Here $\mathrel{>_{\mathsf{pop*}}^{\mathsf{mul}}}$ and $\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\mathsf{mul}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}$ refer to the strict and weak multiset extension of $\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}$ respectively. The intuition of $\mathrel{{>}_{\mathsf{pop}}}$ is to deny any recursive call, whereas $\mathrel{{>}_{\mathsf{pop*}}}$ allows predicative recursion: by the restrictions imposed by $\operatorname{\mathsf{safe}}$, recursion needs to be performed on normal arguments, while a recursively computed result must only be used in a safe argument position, compare Bellantoni and Cook (1992). Note that the alternative $s\rhd t_{j}$ for $j\in\operatorname{\mathsf{safe}}(g)$ in Definition 4.2(ii) guarantees that $\textsc{POP}^{\ast}$ characterises the class of polytime computable functions, cf. Avanzini and Moser (2008). The proof of the next theorem follows the pattern of the proof of main theorem in Avanzini and Moser (2008), but the result is stronger due to the extension to quasi-precedences. ###### Theorem 4.3. Let $\mathcal{R}$ be a constructor TRS. If $\mathcal{R}$ is compatible with $\mathrel{{>}_{\mathsf{pop*}}}$, i.e., ${\mathcal{R}}\subseteq{\mathrel{{>}_{\mathsf{pop*}}}}$, then the innermost runtime complexity $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ induced is polynomially bounded. Note that Theorem 4.3 is too weak to handle the TRS $\mathcal{R}_{\textsf{bits}}$ as the (necessary) restriction to an admissible precedence is too strong. To rectify this, we suit $\textsc{POP}^{\ast}$ so that it can be used in conjunction with weak (innermost) dependency pairs. An argument filtering (for a signature $\mathcal{F}$) is a mapping $\pi$ that assigns to every $n$-ary function symbol $f\in\mathcal{F}$ an argument position $i\in\\{1,\dots,n\\}$ or a (possibly empty) list $\\{{i}_{1},\ldots,{i}_{m}\\}$ of argument positions with $1\leqslant i_{1}<\cdots<i_{m}\leqslant n$. The signature $\mathcal{F}_{\pi}$ consists of all function symbols $f$ such that $\pi(f)$ is some list $\\{{i}_{1},\ldots,{i}_{m}\\}$, where in $\mathcal{F}_{\pi}$ the arity of $f$ is $m$. Every argument filtering $\pi$ induces a mapping from $\mathcal{T}(\mathcal{F},\mathcal{V})$ to $\mathcal{T}(\mathcal{F}_{\pi},\mathcal{V})$, also denoted by $\pi$: $\pi(t)=\begin{cases}t&\text{if $t$ is a variable}\\\ \pi(t_{i})&\text{if $t=f({t}_{1},\ldots,{t}_{n})$ and $\pi(f)=i$}\\\ f(\pi(t_{k_{1}}),\dots,\pi(t_{k_{m}}))&\text{if $t=f({t}_{1},\ldots,{t}_{n})$ and $\pi(f)=\\{{i}_{1},\ldots,{i}_{m}\\}$}\hbox to0.0pt{$\;$.\hss}\end{cases}$ ###### Definition 4.4. Let $\pi$ denote an argument filtering, and $\mathrel{{>}_{\mathsf{pop*}}}$ a polynomial path order. We define $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t$ if and only if $\pi(s)\mathrel{{>}_{\mathsf{pop*}}}\pi(t)$, and likewise $s\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}t$ if and only if $\pi(s)\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}\pi(t)$. ###### Example 4.5 (Example 3.2 continued). Let $\pi$ be defined as follows: $\pi(\mathsf{half})=1$ and $\pi(f)=\\{1,\dots,n\\}$ for each $n$-ary function symbol other than $\mathsf{half}$. Compatibility of $\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}})$ with $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$ amounts to the following set of order constraints: $\displaystyle\mathsf{half}^{\sharp}(0)$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{c_{1}}$ $\displaystyle\mathsf{bits}^{\sharp}(0)$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{c_{3}}$ $\displaystyle\mathsf{half}^{\sharp}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{half}^{\sharp}(x)$ $\displaystyle\mathsf{half}^{\sharp}(\mathsf{s}(0))$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{c_{2}}$ $\displaystyle\mathsf{bits}^{\sharp}(\mathsf{s}(0))$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{c_{4}}$ $\displaystyle\mathsf{bits}^{\sharp}(\mathsf{s}(\mathsf{s}(x)))$ $\displaystyle\mathrel{{>}_{\mathsf{pop*}}}\mathsf{bits}^{\sharp}(\mathsf{s}(x))$ In order to define a $\textsc{POP}^{\ast}$ instance $\mathrel{{>}_{\mathsf{pop*}}}$, we set $\operatorname{\mathsf{safe}}(\mathsf{bits}^{\sharp})=\operatorname{\mathsf{safe}}(\mathsf{half})=\operatorname{\mathsf{safe}}(\mathsf{half}^{\sharp})=\varnothing$ and $\operatorname{\mathsf{safe}}(\mathsf{s})=\\{{1}\\}$. Furthermore, we define an (admissible) precedence: $0\approx\mathsf{c_{1}}\approx\mathsf{c_{2}}\approx\mathsf{c_{3}}\approx\mathsf{c_{4}}$. The easy verification of $\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}})\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ is left to the reader. ## 5 Dependency Pairs and Polynomial Path Orders Motivated by Example 4.5, we show in this section that the pair ($\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}},\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$) can play the role of a _safe_ reduction pair, cf. Hirokawa and Moser (2008b, a). Let $\mathcal{R}$ be a TRS over a signature $\mathcal{F}$ that is innermost terminating. In the sequel $\mathcal{R}$ is kept fixed. Moreover, we fix some safe mapping $\operatorname{\mathsf{safe}}$, an admissible precedence $\succsim$, and an argument filtering $\pi$. We refer to the induced $\textsc{POP}^{\ast}$ instance by $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$. We adapt $\operatorname{\mathsf{safe}}$ to $\mathcal{F}_{\pi}$ in the obvious way: for each $f_{\pi}\in\mathcal{F}_{\pi}$ with corresponding $f\in\mathcal{F}$, we define $\operatorname{\mathsf{safe}}(f_{\pi})\mathrel{:=}\operatorname{\mathsf{safe}}(f)\cap\pi(f)$, and likewise $\operatorname{\mathsf{nrm}}(f_{\pi})\mathrel{:=}\operatorname{\mathsf{nrm}}(f)\cap\pi(f)$. Set ${\mathsf{Val}}_{\pi}\mathrel{:=}\mathcal{T}({\mathcal{C}}_{\pi},\mathcal{V})$. Based on $\mathcal{F}_{\pi}$ we define the _normalised signature_ $\mathcal{F}^{\operatorname{\mathsf{n}}}_{\pi}\mathrel{:=}\\{{f^{\operatorname{\mathsf{n}}}\mid f\in\mathcal{F}_{\pi}}\\}$ where the arity of $f^{\operatorname{\mathsf{n}}}$ is $\lvert{\operatorname{\mathsf{nrm}}(f)}\rvert$. We extend $\succsim$ to $\mathcal{F}^{\operatorname{\mathsf{n}}}_{\pi}$ by $f^{\operatorname{\mathsf{n}}}\succsim g^{\operatorname{\mathsf{n}}}$ if and only if $f\succsim g$. Let $\mathsf{s}$ be a fresh constant that is minimal with respect to $\succsim$. We introduce the _Buchholz norm_ of $t$ (denoted as $\lVert{t}\rVert$) a term complexity measure that fits well with the definition of $\textsc{POP}^{\ast}$. Set $\lVert{t}\rVert\mathrel{:=}1+\max\\{{n,\lVert{t_{1}}\rVert,\dots,\lVert{t_{n}}\rVert}\\}$ for $t=f({t}_{1},\ldots,{t}_{n})$ and $\lVert{t}\rVert\mathrel{:=}1$, otherwise. In the following we define an embedding from the relative rewriting relation $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}$ into $\mathrel{\blacktriangleright}_{k}$, such that $k$ depends only on TRSs $\mathcal{R}$ and $\mathcal{S}$. This embedding provides the technical tool to measure the number of root steps in a given derivation through the number of descent in $\mathrel{\blacktriangleright}_{k}$. Hence Proposition 2.3 becomes applicable to establishing our main result. This intuition is cast into the next definition. ###### Definition 5.1. A _predicative interpretation_ is a pair of mappings $(\mathsf{S}_{\pi},\mathsf{N}_{\pi})$ from terms to sequences $\operatorname{\mathcal{S}eq}(\mathcal{F}^{\operatorname{\mathsf{n}}}_{\pi}\cup\\{{\mathsf{s}}\\},\mathcal{V})$ defined as follows. We assume for $\pi(t)=f(\pi(t_{1}),\dots,\pi(t_{n}))$ that $\operatorname{\mathsf{safe}}(f)=\\{{i_{1},\dots,i_{p}}\\}$ and $\operatorname{\mathsf{nrm}}(f)=\\{{j_{1},\dots,j_{q}}\\}$. $\displaystyle\mathsf{S}_{\pi}(t)$ $\displaystyle\mathrel{:=}\begin{cases}[\,]&\text{if $\pi(t)\in{\mathsf{Val}}_{\pi}$},\\\ [f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(t_{j_{1}}),\dots,\mathsf{N}_{\pi}(t_{j_{q}}))\leavevmode\nobreak\ \mathsf{S}_{\pi}(t_{i_{1}})\leavevmode\nobreak\ \cdots\leavevmode\nobreak\ \mathsf{S}_{\pi}(t_{i_{p}})]&\text{if $\pi(t)\not\in{\mathsf{Val}}_{\pi}$.}\end{cases}$ $\displaystyle\mathsf{N}_{\pi}(t)$ $\displaystyle\mathrel{:=}\mathsf{S}_{\pi}(t)\mathrel{::}\operatorname{\mathsf{BN_{\pi}}}(t)$ Here the function $\operatorname{\mathsf{BN_{\pi}}}$ maps a term $t$ to the sequence $[\mathsf{s}\cdots\mathsf{s}]$ with $\lVert{\pi(t)}\rVert$ occurrences of the constant $\mathsf{s}$. Note that as a direct consequence of the definitions we obtain $\operatorname{\mathsf{width}}(\mathsf{N}_{\pi}(t))=\lVert{\pi(t)}\rVert+1$ for all terms $t$. ###### Lemma 5.2. There exists a polynomial $p$ such that $\mathsf{G}_{k}(\mathsf{N}_{\pi}(t))\leqslant p(\lvert{t}\rvert)$ for every basic term $t$. The polynomial $p$ depends only on $k$. ###### Proof. Suppose $t=f({v}_{1},\ldots,{v}_{n})$ is a basic term with $\operatorname{\mathsf{safe}}(f)=\\{{{i}_{1},\ldots,{i}_{p}}\\}$ and $\operatorname{\mathsf{nrm}}(f)=\\{{{j}_{1},\ldots,{j}_{q}}\\}$. The only non- trivial case is when $\pi(t)\not\in{\mathsf{Val}}_{\pi}$. Then $\mathsf{N}_{\pi}(t)=[u\leavevmode\nobreak\ \mathsf{S}_{\pi}(v_{i_{1}})\cdots\mathsf{S}_{\pi}(v_{i_{p}})]\mathrel{::}\operatorname{\mathsf{BN_{\pi}}}(t)$ where $u=f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(v_{j_{1}}),\dots,\mathsf{N}_{\pi}(v_{j_{q}}))$. Note that $\mathsf{S}_{\pi}(v_{i})=[\,]$ for $i\in\\{{{i}_{1},\ldots,{i}_{q}}\\}$. Let $\mathcal{A}$ denote a polynomial interpretation fulfilling Proposition 2.3. Using the assumption $\circ_{\mathcal{A}}({m}_{1},\ldots,{m}_{n})=\sum_{i=1}^{n}m_{i}+n$, it is easy to see that $\mathsf{G}_{k}(\mathsf{N}_{\pi}(t))$ is bounded linear in $\lVert{\pi(t)}\rVert\leqslant\lvert{t}\rvert$ and $[\alpha]_{\mathcal{A}}(u)$. As $\mathsf{N}_{\pi}(v_{j})=[[]\leavevmode\nobreak\ \mathsf{s}\cdots\mathsf{s}]$ with $\lVert{\pi(v_{j})}\rVert\leqslant\lvert{t}\rvert$ occurrences of $\mathsf{s}$, $\mathsf{G}_{k}(\mathsf{N}_{\pi}(v_{j}))$ is linear in $\lvert{t}\rvert$. Hence from Proposition 2.3 we conclude that $\mathsf{G}_{k}(\mathsf{N}_{\pi}(t))$ is polynomially bounded in $\lvert{t}\rvert$. ∎ The next sequence of lemmas shows that the relative rewriting relation $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}$ is embeddable into $\mathrel{\blacktriangleright}_{k}$. ###### Lemma 5.3. Suppose $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t$ such that $\pi(s\sigma)\in{\mathsf{Val}}_{\pi}$. Then $\mathsf{S}_{\pi}(s\sigma)=[\,]=\mathsf{S}_{\pi}(t\sigma)$ and $\mathsf{N}_{\pi}(s\sigma)\mathrel{\blacktriangleright}_{1}\mathsf{N}_{\pi}(t\sigma)$. ###### Proof. Let $\pi(s\sigma)\in{\mathsf{Val}}_{\pi}$, and suppose $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t$, i.e., $\pi(s)\mathrel{{>}_{\mathsf{pop*}}}\pi(t)$ holds. Observe that since $\pi(s)\in{\mathsf{Val}}_{\pi}$ and due to our assumptions on safe mappings, only clause $(1)$ from the definition of $\mathrel{{>}_{\mathsf{pop*}}}$ (or respectively $\mathrel{{>}_{\mathsf{pop}}}$) is applicable. And thus $\pi(t)$ is a subterm of $\pi(s)$ modulo the equivalence $\approx$. We conclude $\pi(t\sigma)\in{\mathsf{Val}}_{\pi}$, and hence $\mathsf{S}_{\pi}(s\sigma)=[\,]=\mathsf{S}_{\pi}(t\sigma)$. Finally, notice that $\lVert{\pi(s\sigma)}\rVert>\lVert{\pi(t\sigma)}\rVert$ as $\pi(t\sigma)$ is a subterm of $\pi(s\sigma)$. Thus $\mathsf{N}_{\pi}(s\sigma)\mathrel{\blacktriangleright}_{1}\mathsf{N}_{\pi}(t\sigma)$ follows as well. ∎ To improve the clarity of the exposition, we concentrate on the curcial cases in the proofs of the following lemma. The interested reader is kindly referred to Avanzini (2009) for the full proof. ###### Lemma 5.4. Suppose $s\mathrel{{>}^{\pi}_{\mathsf{pop}}}t$ such that $\pi(s\sigma)=f(\pi(s_{1}\sigma),\dots,\pi(s_{n}\sigma))$ with $\pi(s_{i}\sigma)\in{\mathsf{Val}}_{\pi}$ for $i\in\\{{1,\dots,n}\\}$. Moreover suppose $\operatorname{\mathsf{nrm}}(f)=\\{{j_{1},\dots,j_{q}}\\}$. Then $f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(s_{j_{1}}\sigma),\dots,\mathsf{N}_{\pi}(s_{j_{q}}\sigma))\mathrel{\gtrdot}_{3\cdot\lVert{\pi(t)}\rVert}\mathsf{N}_{\pi}(t\sigma)$ holds. ###### Proof. Note that the assumption implies that the argument filtering $\pi$ does not collapse $f$. We show the lemma by induction on $\mathrel{{>}^{\pi}_{\mathsf{pop}}}$. We consider the subcase that $s\mathrel{{>}^{\pi}_{\mathsf{pop}}}t$ follows as $t=g({t}_{1},\ldots,{t}_{m})$, $\pi$ does not collapse on $g$, $f\succ g$, and $s\mathrel{{>}^{\pi}_{\mathsf{pop}}}t_{j}$ for all $j\in\pi(g)$, cf. Definition 4.1(ii). We set $u\mathrel{:=}f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(s_{j_{1}}\sigma),\dots,\mathsf{N}_{\pi}(s_{j_{q}}\sigma))$ and $k\mathrel{:=}3\cdot\lVert{\pi(t)}\rVert$ and first prove $u\mathrel{\gtrdot}_{k-1}\mathsf{S}_{\pi}(t\sigma)$. If $\pi(t\sigma)\in{\mathsf{Val}}_{\pi}$, then $\mathsf{S}_{\pi}(t\sigma)=[\,]$ is minimal with respect to $\mathrel{\gtrdot}_{k-1}$. Thus we are done. Hence suppose $\operatorname{\mathsf{nrm}}(g)=\\{{j^{\prime}_{1},\dots,j^{\prime}_{q}}\\}$, $\operatorname{\mathsf{safe}}(g)=\\{{i^{\prime}_{1},\dots,i^{\prime}_{p}}\\}$ and let $\mathsf{S}_{\pi}(t\sigma)=[g^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(t_{j^{\prime}_{1}}\sigma),\dots,\mathsf{N}_{\pi}(t_{j^{\prime}_{q}}\sigma))\leavevmode\nobreak\ \mathsf{S}_{\pi}(t_{i^{\prime}_{1}}\sigma)\cdots\mathsf{S}_{\pi}(t_{i^{\prime}_{p}}\sigma)]\hbox to0.0pt{$\;$.\hss}$ We set $v\mathrel{:=}g^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(t_{j^{\prime}_{1}}\sigma),\dots,\mathsf{N}_{\pi}(t_{j^{\prime}_{q}}\sigma))$. It suffices to show $u\mathrel{\gtrdot}_{k-2}v$ and $u\mathrel{\gtrdot}_{k-2}\mathsf{S}_{\pi}(t_{j}\sigma)$ for $j\in\operatorname{\mathsf{safe}}(g)$. Both assertions follow from the induction hypothesis. Now consider $\mathsf{N}_{\pi}(t\sigma)=[\mathsf{S}_{\pi}(t\sigma)\leavevmode\nobreak\ \mathsf{s}\cdots\mathsf{s}]$ with $\lVert{\pi(t\sigma)}\rVert$ occurrences of the constant $\mathsf{s}$. Recall that $\operatorname{\mathsf{width}}(\mathsf{N}_{\pi}(t\sigma))=\lVert{\pi(t\sigma)}\rVert+1$. Observe that $f^{\operatorname{\mathsf{n}}}\succ\mathsf{s}$. Hence to prove $u\mathrel{\gtrdot}_{k}\mathsf{S}_{\pi}(t\sigma)$ it suffices to observe that $\operatorname{\mathsf{width}}(u)+k>\lVert{\pi(t\sigma)}\rVert+1$ holds. For that note that $\lVert{\pi(t\sigma)}\rVert$ is either $\lVert{\pi(t_{j}\sigma)}\rVert+1$ for some $j\in\pi(g)$ or less than $k$. In the latter case, we are done. Otherwise $\lVert{\pi(t\sigma)}\rVert=\lVert{\pi(t_{j}\sigma)}\rVert+1$. Then from the definition of $\mathrel{\gtrdot}_{k}$ and the induction hypothesis $u\mathrel{\gtrdot}_{3\cdot\lVert{\pi(t_{j})}\rVert}\mathsf{N}_{\pi}(t_{j}\sigma)$ we can conclude $\operatorname{\mathsf{width}}(u)+3\cdot\lVert{\pi(t_{j})}\rVert>\operatorname{\mathsf{width}}(\mathsf{N}_{\pi}(t_{j}\sigma))=\lVert{\pi(t_{j}\sigma)}\rVert+1$. Since $k\geqslant 3\cdot(\lVert{\pi(t_{j})}\rVert+1)$, $\operatorname{\mathsf{width}}(u)+k>\lVert{\pi(t\sigma)}\rVert+1$ follows. ∎ ###### Lemma 5.5. Suppose $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t$ such that $\pi(s\sigma)=f(\pi(s_{1}\sigma),\dots,\pi(s_{n}\sigma))$ with $\pi(s_{i}\sigma)\in{\mathsf{Val}}_{\pi}$ for $i\in\\{{1,\dots,n}\\}$. Then for $\operatorname{\mathsf{nrm}}(f)=\\{{j_{1},\dots,j_{q}}\\}$, 1. (i) $f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(s_{j_{1}}\sigma),\dots,\mathsf{N}_{\pi}(s_{j_{q}}\sigma))\mathrel{\blacktriangleright}_{3\cdot\lVert{\pi(t)}\rVert}\mathsf{S}_{\pi}(t\sigma)$, and 2. (ii) $f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(s_{j_{1}}\sigma),\dots,\mathsf{N}_{\pi}(s_{j_{q}}\sigma))\mathrel{::}\operatorname{\mathsf{BN_{\pi}}}(s\sigma)\mathrel{\blacktriangleright}_{3\cdot\lVert{\pi(t)}\rVert}\mathsf{N}_{\pi}(t\sigma)$. ###### Proof. The lemma is shown by induction on the definition of $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$. For the following, we set $u=f^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(s_{j_{1}}\sigma),\dots,\mathsf{N}_{\pi}(s_{j_{q}}\sigma))$. Suppose $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t$ follows due to Definition 4.2(ii). We set $k\mathrel{:=}3\cdot\lVert{\pi(t)}\rVert$. Let $\operatorname{\mathsf{nrm}}(g)=\\{{j^{\prime}_{1},\dots,j^{\prime}_{q}}\\}$ and let $\operatorname{\mathsf{safe}}(g)=\\{{i^{\prime}_{1},\dots,i^{\prime}_{p}}\\}$. Property $(\ref{en:embed:hlp:a})$ is immediate for $\pi(t\sigma)\in{\mathsf{Val}}_{\pi}$, so assume otherwise. We see that $s\mathrel{{>}^{\pi}_{\mathsf{pop}}}t_{j}$ for all $j\in\operatorname{\mathsf{nrm}}(g)$ and obtain $u\mathrel{\gtrdot}_{k-1}g^{\operatorname{\mathsf{n}}}(\mathsf{N}_{\pi}(t_{j^{\prime}_{1}}\sigma),\dots,\mathsf{N}_{\pi}(t_{j^{\prime}_{q}}\sigma))$ as in Lemma 5.4. Furthermore, $s\mathrel{{>}^{\pi}_{\mathsf{pop*}}}t_{j_{0}}$ for some $j_{0}\in\operatorname{\mathsf{safe}}(g)$ and by induction hypothesis: $u\mathrel{\blacktriangleright}_{k-1}\mathsf{S}_{\pi}(t_{j_{0}}\sigma)$. To conclude property $(\ref{en:embed:hlp:a})$, it remains to verify $u\mathrel{\gtrdot}_{k-1}\mathsf{S}_{\pi}(t_{j}\sigma)$ for the remaining $j\in\operatorname{\mathsf{safe}}(g)$. We either have $s\mathrel{{>}^{\pi}_{\mathsf{pop}}}t_{j}$ or $\pi(s_{i})\mathrel{\unrhd}\pi(t_{j})$ (for some $i$). In the former subcase we proceed as in the claim, and for the latter we observe $\pi(t_{j}\sigma)\in{\mathsf{Val}}_{\pi}$, and thus $\mathsf{S}_{\pi}(t_{j}\sigma)=[\,]$ follows. This establishes property $(\ref{en:embed:hlp:a})$. To conclude property $(\ref{en:embed:hlp:b})$, it suffices to show $\operatorname{\mathsf{width}}(u\mathrel{::}\operatorname{\mathsf{BN_{\pi}}}(s\sigma))+k>\operatorname{\mathsf{width}}(\mathsf{N}_{\pi}(t\sigma))$, or equivalently $\lVert{\pi(s\sigma)}\rVert+1+k>\lVert{\pi(t\sigma)}\rVert$. The latter can be shown, if we proceed similar as in the claim. ∎ Recall the definition of $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{Q}$}}}_{\mathcal{R}}}$ from Section 2 and define $\mathcal{Q}\mathrel{:=}\\{f({x}_{1},\ldots,{x}_{n})\to\bot\mid f\in\mathcal{D}\\}$, and set $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}\mathrel{:=}{\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{Q}$}}}_{\mathcal{R}}}}$. As the normal forms of $\mathcal{Q}$ coincide with $\mathsf{Val}$, $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}$ is the restriction of $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}$, where arguments need to be values instead of normal forms of $\mathcal{R}$. From Lemma 5.3 and 5.5 we derive an embedding of root steps $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}}}$. Suppose the step $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}t$ takes place below the root. Observe that $\pi(s)\not=\pi(t)$ need not hold in general. Thus we cannot hope to prove $\mathsf{N}_{\pi}(s)\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}(t)$. However, we have the following stronger result. ###### Lemma 5.6. There exists a uniform $k\in\mathbb{N}$ (depending only on $\mathcal{R}$) such that if $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds then ${s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}}}t}$ implies ${\mathsf{N}_{\pi}(s)\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}(t)}$. Moreover, if $\mathcal{R}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ holds then ${s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}t}$ implies ${\mathsf{N}_{\pi}(s)\mathrel{\not{\gtrsim}}_{k}\mathsf{N}_{\pi}(t)}$. ###### Proof. We consider the first half of the assertion. Suppose $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}}}t$, that is for some rule ${f({l}_{1},\ldots,{l}_{n})\to r}\in\mathcal{R}$ and substitution $\sigma\,\colon\,\mathcal{V}\to\mathsf{Val}$ we have $s=f(l_{1}\sigma,\dots,l_{n}\sigma)$ and $t=r\sigma$. Depending on whether $\pi$ collapses $f$, the property either directly follows from Lemma 5.3 or is a consequence of Lemma $\ref{l:embed:hlp}(\ref{en:embed:hlp:b})$. In order to conclude the second half of the assertion, one performs induction on the rewrite context. In addition, one shows that for the special case $\mathsf{S}_{\pi}(s)\approx\mathsf{S}_{\pi}(t)$, still $\lVert{\pi(s)}\rVert\geqslant\lVert{\pi(t)}\rVert$ holds. From this the lemma follows. ∎ For constructor TRSs, we can simulate $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}$ using $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}$. We extend $\mathcal{R}$ with suitable rules $\Phi(\mathcal{R})$, which replace normal forms that are not values by some constructor symbol. To simplfy the argument we re-use the symbol $\bot$ from above. We define the TRS $\Phi(\mathcal{R})$ as $\Phi(\mathcal{R})\mathrel{:=}\\{{f({t}_{1},\ldots,{t}_{n})\to\bot\mid f({t}_{1},\ldots,{t}_{n})\in{\operatorname{\mathsf{NF}}(\mathcal{R})\cap\mathcal{T}(\mathcal{F})}\text{ and }f\in\mathcal{D}}\\}\hbox to0.0pt{$\;$.\hss}$ Moreover, we define $\phi_{\mathcal{R}}(t)\mathrel{:=}t{\downarrow}_{\Phi(\mathcal{R})}$. Observe that $\phi_{\mathcal{R}}(\cdot)$ is well-defined since $\Phi(\mathcal{R})$ is confluent and terminating. ###### Lemma 5.7. Let $\mathcal{R}\cup\mathcal{S}$ be a constructor TRS. Define $\mathcal{S}^{\prime}\mathrel{:=}\mathcal{S}\cup\Phi(\mathcal{R}\cup\mathcal{S})$. For $s\in\mathcal{T}(\mathcal{F})$, ${s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}t}\quad\text{implies}\quad{\phi_{\mathcal{R}\cup\mathcal{S}}(s)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}^{\prime}}}\phi_{\mathcal{R}\cup\mathcal{S}}(t)}\hbox to0.0pt{$\;$,\hss}$ where ${\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}/\mathcal{S}^{\prime}}}}$ abbreviates ${\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}^{\prime}}}\cdot\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}\cdot\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}^{\prime}}}}$. ###### Proof. It is easy to see that ${s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}t}$ implies $\phi_{\mathcal{R}}(s)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{R}}}\cdot\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{!}_{\Phi(\mathcal{R})}}\phi_{\mathcal{R}}(t)$. Suppose $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}t$, then there exist ground terms $u$ and $v$ such that $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{S}}}u\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}}}v\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{S}}}t$. Let $\phi(t)\mathrel{:=}\phi_{\mathcal{R}\cup\mathcal{S}}(t)$. From the above, $\phi(s)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}^{\prime}}}\phi(u)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}}}\cdot\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}^{\prime}}}\phi(v)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}^{\prime}}}\phi(t)$ follows as desired. ∎ Suppose $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{S}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ holds. Together with Lemma 5.6, the above simulation establishes the promised embedding of $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}$ into $\mathrel{\blacktriangleright}_{k}$. ###### Lemma 5.8. Let $\mathcal{R}\cup\mathcal{S}$ be a constructor TRS, and suppose $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and ${\mathcal{S}}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ hold. Then for $k$ depending only on $\mathcal{R}$ and $\mathcal{S}$ and $s\in\mathcal{T}(\mathcal{F})$, we have ${s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}t}\quad\text{implies}\quad{\mathsf{N}_{\pi}(\phi(s))\mathrel{\blacktriangleright}_{k}^{+}\mathsf{N}_{\pi}(\phi(t))}\hbox to0.0pt{$\;$.\hss}$ ###### Proof. Consider a step $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}}t$ and set $\phi(t)\mathrel{:=}\phi_{\mathcal{R}\cup\mathcal{S}}(t)$. By Lemma 5.7 there exist terms $u$ and $v$ such that $\phi(s)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}\cup\Phi(\mathcal{R}\cup\mathcal{S})}}u\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\varepsilon}_{\mathcal{R}}}v\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}\cup\Phi(\mathcal{R}\cup\mathcal{S})}}\phi(t)$. Since $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds, by Lemma 5.6 $\mathsf{N}_{\pi}(u)\mathrel{\blacktriangleright}_{k_{1}}\mathsf{N}_{\pi}(v)$ follows. Moreover from $\mathcal{S}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ together with Lemma 5.6 we conclude that $r_{1}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{S}\cup\Phi(\mathcal{R}\cup\mathcal{S})}}r_{2}$ implies $\mathsf{N}_{\pi}(r_{1})\mathrel{\not{\gtrsim}}_{k_{2}}\mathsf{N}_{\pi}(r_{2})$. Here it suffices to see that steps from $\mathcal{V}(\mathcal{R}\cup\mathcal{S})$ are easy to embed into $\mathrel{\not{\gtrsim}}_{k_{2}}$ using the predicative interpretation $\mathsf{N}_{\pi}$ independent of $k_{2}$. In both cases $k_{1}$ and $k_{2}$ depend only on $\mathcal{R}$ and $\mathcal{S}$ respectively; set $k\mathrel{:=}\max\\{{k_{1},k_{2}}\\}$. In sum we have $\mathsf{N}_{\pi}(\phi(s))\mathrel{\not{\gtrsim}}_{k}^{*}\mathsf{N}_{\pi}(u)\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}(v)\mathrel{\not{\gtrsim}}_{k}^{*}\mathsf{N}_{\pi}(\phi(t))$, employing ${\mathrel{\blacktriangleright}_{l_{1}}}\subseteq{\mathrel{\blacktriangleright}_{l_{2}}}$ for $l_{1}\leqslant l_{2}$. It is an easy exercise to show that ${{\mathrel{\blacktriangleright}_{k}}\cdot{\approx}}\subseteq{\mathrel{\blacktriangleright}_{k}}$ and likewise ${{\approx}\cdot{\mathrel{\blacktriangleright}_{k}}}\subseteq{\mathrel{\blacktriangleright}_{k}}$ holds. Hence the lemma follows. ∎ ###### Theorem 5.9. Let $\mathcal{R}\cup\mathcal{S}$ be a constructor TRS, and suppose $\mathcal{R}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and ${\mathcal{S}}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ holds. Then there exists a polynomial $p$ depending only on $\mathcal{R}\cup\mathcal{S}$ such that for any basic and ground term $t$, $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}})\leqslant p(\lvert{t}\rvert)$. ###### Proof. Assume $t\not\in\operatorname{\mathsf{NF}}(\mathcal{R}\cup\mathcal{S})$, otherwise $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}})$ is trivially bounded. Moreover $t$ is a basic term, hence $\phi_{\mathcal{R}\cup\mathcal{S}}(t)=t$. From Lemma 5.8 we infer that $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}/\mathcal{S}}})\leqslant\mathsf{G}_{k}(\mathsf{N}_{\pi}(\phi_{\mathcal{R}\cup\mathcal{S}}(t)))=\mathsf{G}_{k}(\mathsf{N}_{\pi}({t}))$ for some $k$, where the latter is polynomially bounded in $\lvert{t}\rvert$ and the polynomial only depends on $k$, cf. Lemma 5.2. Finally $k$ depends only on $\mathcal{R}\cup\mathcal{S}$. ∎ Suppose $\mathcal{R}$ is a constructor TRS, and let $\mathcal{P}$ denote the set of weak innermost dependency pairs. For the moment, suppose that all compound symbols of $\mathcal{P}$ are nullary. Provided that $\mathcal{P}$ is non-duplicating and compatible with some SLI, as a consequence of the above theorem paired with Proposition 3.4, the inclusions $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ certify that $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is polynomially bounded. Observe that for the application of $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$ and $\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}$ in the context of $\mathcal{P}$ and $\mathcal{U}(\mathcal{P})$, we alter Definitions 4.1 and 4.2 such that $f\in\mathcal{D}^{\sharp}$ is demanded. ###### Example 5.10 (Example 4.5 continued). Reconsider the TRS $\mathcal{R}_{\textsf{bits}}$, and let $\mathcal{P}$ denote $\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}})$ as drawn in Example 3.2. By taking the SLI $\mathcal{A}$ with $0_{\mathcal{A}}=0$, $\mathsf{s}_{\mathcal{A}}(x)=x+1$ and $\mathsf{half}_{\mathcal{A}}(x)=x+1$ we obtain $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{>_{\mathcal{A}}}}$ and moreover, observe that $\mathcal{P}$ is both non-duplicating and contains only nullary compound symbols. In Example 4.5 we have seen that $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds. Similar, $\mathcal{U}(\mathsf{WIDP}(\mathcal{R}_{\textsf{bits}}))\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ can easily be shown. From the above observation we thus conclude a polynomial runtime-complexity of $\mathcal{R}_{\textsf{bits}}$. The assumption that all compound symbols from $\mathcal{P}$ need to be nullary is straightforward to lift, but technical. Hence, we do not provide a complete proof here, but only indicate the necessary changes. The formal construction can be found in the Appendix. Note that in the general case, it does not suffice to embed root steps of $\mathcal{P}$ into $\mathrel{\blacktriangleright}_{k}$, rather we have to embed steps of form $C[s_{1}^{\sharp},\dots,s_{i}^{\sharp},\dots,s_{n}^{\sharp}]\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}}}C[s_{1}^{\sharp},\dots,t_{i}^{\sharp},\dots,s_{n}^{\sharp}]$ with $C$ being a context built from compound symbols. As first measure we require that the argument filtering $\pi$ is _safe_ Hirokawa and Moser (2008b), that is $\pi(c)=[1,\dots,n]$ for each compound symbol $\mathsf{c}$ of arity $n$. Secondly, we adapt the predicative interpretation $\mathsf{N}_{\pi}$ in such a way that compound symbols are interpreted as sequences, and their arguments by the interpretation $\mathsf{N}_{\pi}$. This way, a proper embedding using $\mathsf{N}_{\pi}$ requires $\mathsf{N}_{\pi}(s_{i}^{\sharp})\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}(t_{i}^{\sharp})$ instead of $\mathsf{S}_{\pi}(s_{i}^{\sharp})\mathrel{\blacktriangleright}_{k}\mathsf{S}_{\pi}(t_{i}^{\sharp})$. ###### Theorem 5.11. Let $\mathcal{R}$ be a constructor TRS, and let $\mathcal{P}$ denote the set of weak innermost dependency pairs. Assume $\mathcal{P}$ is non-duplicating, and suppose ${\mathcal{U}(\mathcal{P})}\subseteq{>_{\mathcal{A}}}$ for some SLI $\mathcal{A}$. Let $\pi$ be a safe argument filtering. If $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ then $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is polynomially bounded. Above it is essential that $\mathcal{R}$ is a constructor TRS. This even holds when $\textsc{POP}^{\ast}$ is applied directly. ###### Example 5.12. Consider the TRS $\mathcal{R}_{\operatorname{\mathsf{exp}}}$ below: $\begin{array}[]{c}\operatorname{\mathsf{exp}}(x)\to\mathsf{e}(\mathsf{g}(x))\qquad\mathsf{e}(\mathsf{g}(\mathsf{s}(x)))\to\operatorname{\mathsf{dp}}_{1}(\mathsf{g}(x))\qquad\mathsf{g}(\mathsf{0})\to\mathsf{0}\rule[-7.74998pt]{0.0pt}{0.0pt}\\\ \operatorname{\mathsf{dp}}_{1}(x)\to\operatorname{\mathsf{dp}}_{2}(\mathsf{e}(x),x)\qquad\qquad\operatorname{\mathsf{dp}}_{2}(x,y)\to\operatorname{\mathsf{pr}}(x,\mathsf{e}(y))\end{array}$ The above rules are oriented (directly) by $\mathrel{{>}_{\mathsf{pop*}}}$ induced by $\operatorname{\mathsf{safe}}$ and $\succsim$ such that: (i) the argument position of $\mathsf{g}$ and $\operatorname{\mathsf{exp}}$ are normal, the remaining argument positions are safe, and (ii) $\operatorname{\mathsf{exp}}\succ\mathsf{g}\succ\operatorname{\mathsf{dp}}_{1}\succ\operatorname{\mathsf{dp}}_{2}\succ\mathsf{e}\succ\operatorname{\mathsf{pr}}\succ\mathsf{0}$. On the other hand, $\mathcal{R}_{\operatorname{\mathsf{exp}}}$ admits at least exponential innermost runtime-complexity, as for instance $\operatorname{\mathsf{exp}}(s^{n}(\mathsf{0}))$ normalizes in exponentially (in $n$) many innermost rewrite steps. To overcome this obstacle, we adapt the definition of $\mathrel{{>}_{\mathsf{pop*}}}$ in the sense that we refine the notion of defined function symbols as follows. Let $\mathcal{G}_{\mathcal{C}}$ denote the least set containing $\mathcal{C}$ and all symbols appearing in arguments to left-hand sides in $\mathcal{R}$. Moreover, set $\mathcal{G}_{\mathcal{D}}\mathrel{:=}\mathcal{F}\setminus\mathcal{G}_{\mathcal{C}}$ and set $\mathsf{Val}\mathrel{:=}\mathcal{T}(\mathcal{G}_{\mathcal{C}},\mathcal{V})$. Then in order to extend Theorem 5.11 to non-constructor TRS it suffices to replace $\mathcal{D}$ by $\mathcal{G}_{\mathcal{D}}$ and $\mathcal{C}$ by $\mathcal{G}_{\mathcal{C}}$ in all above given definitions and arguments (see Avanzini (2009) for the formal construction). Thus the next theorem follows easily from combining Proposition 3.6 and Theorem 5.11. Note that this theorem can be easily extended so that in each path different termination techniques (inducing polynomial runtime complexity) are employed, see Hirokawa and Moser (2008a) and Section 6. ###### Theorem 5.13. Let $\mathcal{R}$ be a TRS. Let $\mathcal{G}$ denote the weak innermost dependency graph, and let $\mathcal{F}=\mathcal{G}_{\mathcal{D}}\uplus\mathcal{G}_{\mathcal{C}}$ be separated as above. Suppose for every path $(\mathcal{P}_{1},\ldots,\mathcal{P}_{n})$ in ${\mathcal{G}}/_{\\!\equiv}$ there exists an SLI $\mathcal{A}$ and a pair $(\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}},\mathrel{{>}^{\pi}_{\mathsf{pop*}}})$ based on a safe argument filtering $\pi$ such that (i) $\mathcal{U}(\mathcal{P}_{1}\cup\cdots\cup\mathcal{P}_{n})\subseteq{>_{\mathcal{A}}}$ (ii) $\mathcal{P}_{1}\cup\cdots\cup\mathcal{P}_{n-1}\cup\mathcal{U}(\mathcal{P}_{1}\cup\cdots\cup\mathcal{P}_{n})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$, and (iii) $\mathcal{P}_{n}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds. Then $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is polynomially bounded. The next theorem establishes that $\textsc{POP}^{\ast}$ in conjunction with (weak innermost) dependency pairs induces polytime computability of the function described through the analysed TRS. We kindly refer the reader to the Appendix for the proof. ###### Theorem 5.14. Let $\mathcal{R}$ be an orthogonal, $S$-sorted and completely defined constructor TRS such that the underlying signature is simple. Let $\mathcal{P}$ denote the set of weak innermost dependency pairs. Assume $\mathcal{P}$ is non-duplicating, and suppose ${\mathcal{U}(\mathcal{P})}\subseteq{>_{\mathcal{A}}}$ for some SLI $\mathcal{A}$. If $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ then the functions computed by $\mathcal{R}$ are computable in polynomial time. Here _simple_ signature Marion (2003) essentially means that the size of any constructor term depends polynomially on its depth. Such a restriction is always necessary in this context. A detailed account is given in the Appendix (see alo Marion (2003)). This restriction is also responsible for the introduction of sorts. ## 6 Experimental Results All described techniques have been incorporated into the _Tyrolean Complexity Tool_ T​C​T, an open source complexity analyser222Available at http://cl- informatik.uibk.ac.at/software/tct.. We performed tests on two testbeds: T constitutes of the $1394$ examples from the Termination Problem Database Version 5.0.2 that were used in the runtime-complexity category of the termination competition 2008333See http://termcomp.uibk.ac.at.. Moreover, testbed C is the restriction of testbed T to constructor TRSs ($638$ in total). All experiments were conducted on a machine that is identical to the official competition server ($8$ AMD Opteron${}^{\text{\textregistered}}$ 885 dual-core processors with 2.8GHz, $8\text{x}8$ GB memory). As timeout we use 5 seconds. We orient TRSs using $\mathrel{{>}^{\pi}_{\mathsf{pop*}}}$ by encoding the constraints on precedence and so forth in _propositional logic_ (cf. Avanzini (2009) for details), employing $\mathsf{MiniSat}$ Eén and Sörensson (2003) for finding satisfying assignments. In a similar spirit, we check compatibility with SLIs via translations to SAT. In order to derive an estimated dependency graph, we use the function $\mathsf{ICAP}$ (cf. Giesl et al. (2005)). Experimental findings are summarised in Table 1.444See http://cl- informatik.uibk.ac.at/~zini/rta09 for extended results. In each column, we highlight the total on yes-, maybe- and timeout-instances. Furthermore, we annotate average times in seconds. In the first three columns we contrast $\textsc{POP}^{\ast}$ as direct technique to $\textsc{POP}^{\ast}$ as base to (weak innermost) dependency pairs. I.e., the columns WIDP and WIDG show results concerning Proposition 3.4 together with Theorem 5.11 or Theorem 5.13 respectively. In the remaining four columns we assess the power of Proposition 3.4 and 3.6 in conjunction with different base orders, thus verifying that the use of $\textsc{POP}^{\ast}$ in this context is independent to existing techniques. Column P asserts that the different paths are handled by _linear and quadratic restricted interpretations_ Hirokawa and Moser (2008b). In column PP, in addition $\textsc{POP}^{\ast}$ is employed. Similar, in column M _restricted matrix interpretations_ (that is matrix interpretations Endrullis et al. (2008), where constructors are interpreted by triangular matrices) are used to handle different paths. Again column MP extends column M with $\textsc{POP}^{\ast}$. Note that all methods induce polynomial innermost runtime complexity. | polynomial path orders | dependency graphs mixed ---|---|--- | DIRECT | WIDP | WIDG | P | PP | M | MP T | Yes | 46 | /0.03 | 69 | /0.09 | 80 | /0.07 | 198 | /0.54 | 198 | /0.51 | 200 | /0.63 | 207 | /0.48 | Maybe | 1348 | /0.04 | 1322 | /0.10 | 1302 | /0.14 | 167 | /0.77 | 170 | /0.82 | 142 | /0.61 | 142 | /0.63 | Timeout | 0 | | 3 | | 12 | | 1029 | | 1026 | | 1052 | | 1045 | C | Yes | 40 | /0.03 | 48 | /0.08 | 55 | /0.05 | 99 | /0.40 | 100 | /0.38 | 98 | /0.26 | 105 | /0.23 | Maybe | 598 | /0.05 | 587 | /0.10 | 576 | /0.13 | 143 | /0.72 | 146 | /0.77 | 119 | /0.51 | 119 | /0.54 | Timeout | 0 | | 3 | | 7 | | 396 | | 392 | | 421 | | 414 | Table 1: Experimental Results Table 1 reflects that the integration of $\textsc{POP}^{\ast}$ in the context of (weak) dependency pairs, significantly extends the direct approach. Worthy of note, the extension of Avanzini and Moser (2008) with quasi-precedences alone gives 5 additional examples. As advertised, $\textsc{POP}^{\ast}$ is incredibly fast in all settings. Consequently, as evident from the table, polynomial path orders team well with existing techniques, without affecting overall performance: notice that due to the additional of $\textsc{POP}^{\ast}$ the number of timeouts is reduced. ## 7 Conclusion In this paper we study the runtime complexity of rewrite systems. We combine two recently developed techniques in the context of complexity analysis: weak innermost dependency pairs and polynomial path orders. If the conditions of our main result are met, we can conclude the innermost polynomial runtime complexity of the studied term rewrite system. And we obtain that the function defined are _polytime computable_. We have implemented the technique and experimental evidence clearly indicates the power and in particular the efficiency of the new method. ## Appendix A Appendix Below we present the missing proofs of Theorem 5.11 and Theorem 5.14 respectively. As mentioned in Section 5, we now introduce an _extended predicative interpretation_ whose purpose is to interpret compound symbols as sequences, and their arguments via the interpretation $\mathsf{N}_{\pi}$. ###### Definition A.1. The _extended predicative interpretation_ $\mathsf{N}_{\pi}^{\mathsf{s}}$ from terms $\mathcal{T}(\mathcal{F},\mathcal{V})$ to sequences $\operatorname{\mathcal{S}eq}(\mathcal{F}^{\operatorname{\mathsf{n}}}_{\pi}\cup\\{{\mathsf{s}}\\},\mathcal{V})$ is defined as follows: if $t=\mathsf{c}({t}_{1},\ldots,{t}_{n})$ and $\mathsf{c}\in{\mathcal{C}}_{\text{\tiny{$com$}}}$ then $\mathsf{N}_{\pi}^{\mathsf{s}}(t)\mathrel{:=}[\mathsf{N}_{\pi}^{\mathsf{s}}(t_{1})\leavevmode\nobreak\ \cdots\leavevmode\nobreak\ \mathsf{N}_{\pi}^{\mathsf{s}}(t_{n})]$, and otherwise $\mathsf{N}_{\pi}^{\mathsf{s}}(t)\mathrel{:=}[\mathsf{N}_{\pi}(t)]$. Following (Terese, 2003, Section 6.5), we briefly recall _typed rewriting_. Let $S$ be a finite set representing the set of _types_ or _sorts_. An _$S$ -sorted set $A$_ is a family of sets $\\{{A_{s}\mid s\in S}\\}$ such that all sets $A_{s}$ are pairwise disjoint. In the following, we suppose that $\mathcal{V}$ denotes an $S$-sorted set of variables. An _$S$ -sorted signature $\mathcal{F}$_ is like a signature, but the _arity_ of $f\in\mathcal{F}$ is defined by $\operatorname{\mathsf{ar}}(f)=(s_{1},\dots,s_{n})$ for $s_{1},\dots,s_{n}\in S$. Additionally, each symbol $f\in\mathcal{F}$ is associated with a sort $s\in S$, called the _type of $f$_ and denoted by $\operatorname{\mathsf{st}}(f)$. We adopt the usual notion and write $f\,\colon\,(s_{1},\dots,s_{n})\to s$ when $\operatorname{\mathsf{ar}}(f)=(s_{1},\dots,s_{n})$ and $\operatorname{\mathsf{st}}(f)=s$. The _$S$ -sorted set of terms $\mathcal{T}(\mathcal{F},\mathcal{V})_{S}$_ consists of the sets $\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ for $s\in S$, where $\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ is inductively defined by (i) $\mathcal{V}_{s}\subseteq\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$, and (ii) $f({t}_{1},\ldots,{t}_{n})\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ for all function symbols $f\in\mathcal{F}$, $f\,\colon\,(s_{1},\dots,s_{n})\to s$ and terms $t_{i}\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s_{i}}$ for $i\in\\{{1,\dots,n}\\}$. We say that a term $t$ is _well-typed_ if $t\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ for some sort $s$. An $S$-sorted term rewrite system $\mathcal{R}$ is a TRS such that for ${l\to r}\in\mathcal{R}$, it holds that $l,r\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ for some sort $s\in S$. As a consequence, for $s\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$ and $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathcal{R}}}t$, we have that $t\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$. ###### Example A.2. Let $S=\\{{\mathsf{Bool},\mathsf{List},\mathsf{Nat},\mathsf{Pair}}\\}$. The $S$-sorted rewrite system $\mathcal{R}_{\mathsf{Lst}}$ is given by the following rules: $\displaystyle\mathsf{f}(\mathsf{s}(x))$ $\displaystyle\to\mathsf{cons}(\mathsf{pair}(x,\mathsf{g}(x)),\mathsf{f}(x))$ $\displaystyle\hskip 12.91663pt\mathsf{g}(\mathsf{s}(x))$ $\displaystyle\to\mathsf{g}(x)$ $\displaystyle\mathsf{f}(0)$ $\displaystyle\to\mathsf{nil}$ $\displaystyle\mathsf{g}(0)$ $\displaystyle\to\mathsf{tt}$ Here we assign arities and sorts as follows: for the constructors we set $0\,\colon\,\mathsf{Nat}$, $\mathsf{s}\,\colon\,\mathsf{Nat}\to\mathsf{Nat}$, $\mathsf{pair}\,\colon\,(\mathsf{Nat},\mathsf{Bool})\to\mathsf{Pair}$, $\mathsf{tt}\,\colon\,\mathsf{Bool}$, $\mathsf{nil}\,\colon\,\mathsf{List}$, $\mathsf{cons}\,\colon\,(\mathsf{Pair},\mathsf{List})\to\mathsf{List}$; for the defined symbols we set $\mathsf{f}\,\colon\,\mathsf{Nat}\to\mathsf{List}$ and $\mathsf{g}\,\colon\,\mathsf{Nat}\to\mathsf{Bool}$. A _simple_ signature Marion (2003) is a sorted signature such that each sort has a finite _rank_ $r$ in the following sense: the sort $s$ has rank $r$ if for every constructor $c\,\colon\,({s}_{1},\ldots,{s}_{n})\to s$, the rank of each sort $s_{i}$ is less than the rank of $s$, except for at most one sort which can be of rank $r$. Simple signatures allow the definition of enumerated datatypes and inductive datatypes like words and lists but prohibit for instance the definition of tree structures. Observe that the signature underlying $\mathcal{R}_{\mathsf{Lst}}$ from Example A.2 is simple. A crucial insight is that sizes of values formed from a simple signature can be estimated polynomially in their depth. The easy proof of the following proposition can be found in (Marion, 2003, Proposition 17). ###### Proposition A.3. Let $\mathcal{C}$ be a set of constructors from a simple signature $\mathcal{F}$. There exists a constant $d\in\mathbb{N}$ such that for each term $t\in\mathcal{T}(\mathcal{C},\mathcal{V})_{S}$ whose rank is $r$, $\lvert{t}\rvert\leqslant d^{r}\cdot\operatorname{\mathsf{dp}}(t)^{r+1}$. In order to give a polytime algorithm for the functions computed by a TRS, it is essential that sizes of reducts do not exceed a polynomial bound with respect to the size of the start term. Recall that approximations $\mathrel{\blacktriangleright}_{k}$ tightly control the size growth of terms. For simple signatures, we can exploit this property for a space-complexity analysis. Although predicative interpretations remove values, by the above proposition sizes of those can be estimated based on the Buchholz-norm record in $\mathsf{N}_{\pi}$. And so we derive the following Lemma, essential for the proof of Theorem 5.14. ###### Lemma A.4. Let $\mathcal{F}$ be a simple signature. There exists a (monotone) polynomial $p$ depending only on $\mathcal{F}$ such that for each well-typed term $t\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$, $\lvert{t}\rvert\leqslant p(\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(t)))$. ###### Proof. The Lemma follows as: (i) for all sequences $s\in\operatorname{\mathcal{S}eq}$, $\lvert{s}\rvert\leqslant\mathsf{G}_{k}(s)+1$, and (ii) for all terms $t\in\mathcal{T}(\mathcal{F},\mathcal{V})_{s}$, $\lvert{t}\rvert\leqslant c\cdot\lvert{\mathsf{N}^{\mathsf{s}}(t)}\rvert^{d}$ for some uniform constants $0<c,d\in\mathbb{N}$. These properties are simple to verify: property (i) follows from induction on $s$ where we employ for the inductive step that $f({s}_{1},\ldots,{s}_{n})\mathrel{\blacktriangleright}_{k}[{s}_{1}\cdots{s}_{n}]$ and $\mathsf{G}_{k}([{s}_{1}\cdots{s}_{n}])=\sum_{i=1}^{n}\mathsf{G}_{k}(s_{i})+n$. For property (ii), set $d=r+2$ where $r$ is the maximal rank of a symbol in $\mathcal{C}$, and set $c=e^{r}$ where $e$ is as given from Proposition A.3. First one shows by a straight forward induction on $t$ that $\lvert{t}\rvert\leqslant c\cdot(\lvert{\mathsf{S}(t)}\rvert\cdot\lVert{t}\rVert^{r+1})$ (employing Proposition A.3 and $\operatorname{\mathsf{dp}}(t)\leqslant\lVert{t}\rVert$). As $\lvert{\mathsf{S}(t)}\rvert<\lvert{\mathsf{N}(t)}\rvert$ and $\lVert{t}\rVert<\lvert{\mathsf{N}(t)}\rvert$, we derive $\lvert{t}\rvert<c\cdot\lvert{\mathsf{N}(t)}\rvert^{d}$. By induction on the definition of $\mathsf{N}^{\mathsf{s}}$ we finally obtain property (ii). ∎ Let $\mathcal{R}$ be a (not necessarily $S$-sorted) TRS that is innermost terminating. In the sequel, we keep $\mathcal{R}$ fixed. In order to exploit Lemma A.4 for an analysis by means of weak innermost dependency pairs, we introduce the notion of _type preserving weak innermost dependency pairs_. ###### Definition A.5. If $l\to r\in\mathcal{R}$ and $r=C\langle{u}_{1},\ldots,{u}_{n}\rangle_{\mathcal{D}}$ then $l^{\sharp}\to\mathsf{c}(u_{1}^{\sharp},\ldots,u_{n}^{\sharp})$ is called a _type preserving weak innermost dependency pair_ of $\mathcal{R}$. Here, the _compound symbol_ $\mathsf{c}$ is supposed to be fresh. We set $\mathsf{repr}(\mathsf{c})\mathrel{:=}C$ and say that $\mathsf{c}$ _represents_ the context $C$. The set of all type preserving weak innermost dependency pairs is denoted by $\mathsf{WIDP}(\mathcal{R})$. We collect all compound symbols appearing in $\mathsf{TPWIDP}(\mathcal{R})$ in the set ${\mathcal{C}}_{\text{\tiny{$com$}}}$. ###### Example A.6 (Example A.2 continued). Reconsider the rewrite system $\mathcal{R}_{\mathsf{Lst}}$ given in Example A.2. The set $\mathsf{TPWIDP}(\mathcal{R}_{\mathsf{Lst}})$ is given by $\displaystyle\mathsf{f}^{\sharp}(\mathsf{s}(x))$ $\displaystyle\to\mathsf{c}_{1}(\mathsf{g}^{\sharp}(x),\mathsf{f}^{\sharp}(x))$ $\displaystyle\hskip 12.91663pt\mathsf{g}^{\sharp}(\mathsf{s}(x))$ $\displaystyle\to\mathsf{c}_{3}(\mathsf{g}^{\sharp}(x))$ $\displaystyle\mathsf{f}^{\sharp}(0)$ $\displaystyle\to\mathsf{c}_{2}$ $\displaystyle\mathsf{g}^{\sharp}(0)$ $\displaystyle\to\mathsf{c}_{4}$ The constant $\mathsf{c}_{3}$ represents for instance the empty context, and the constant $\mathsf{c}_{1}$ represents the context $\mathsf{repr}(\mathsf{c}_{1})=\mathsf{cons}(\mathsf{pair}(x,\Box),\Box)$. ###### Lemma A.7. Let $\mathcal{R}$ be an $S$-sorted TRS such that the underlying signature $\mathcal{F}$ is simple. Then $\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$ is an $S$-sorted TRS, and the underlying signature $\mathcal{F}^{\sharp}\cup{\mathcal{C}}_{\text{\tiny{$com$}}}$ a simple signature. ###### Proof. To conclude the claim, it suffices to type the marked and compound symbols appropriately. For each rule ${f^{\sharp}({l}_{1},\ldots,{l}_{n})\to\mathsf{c}(r_{1}^{\sharp},\dots,r_{n}^{\sharp})}\in\mathsf{TPWIDP}(\mathcal{R})$ we proceed as follows: we set $\operatorname{\mathsf{ar}}(f^{\sharp})\mathrel{:=}\operatorname{\mathsf{ar}}(f)$ and $\operatorname{\mathsf{st}}(f^{\sharp})\mathrel{:=}\operatorname{\mathsf{st}}(f)$. Moreover, we set $\operatorname{\mathsf{ar}}(\mathsf{c})\mathrel{:=}({\operatorname{\mathsf{st}}}({r}_{1}),\ldots,{\operatorname{\mathsf{st}}}({r}_{m}))$ and $\operatorname{\mathsf{st}}(\mathsf{c})\mathrel{:=}\operatorname{\mathsf{st}}(f)$. It is easy to see that since $\mathcal{R}$ is $S$-sorted, $\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{TPWIDP}(\mathcal{R}))$ is $S$-sorted too. ∎ Note that the above lemma fails for weak innermost dependency pairs: consider the rule $\mathsf{f}(x)\to\mathsf{d}(\mathsf{g}(x))$, where $\mathsf{f}$ and $\mathsf{g}$ are defined symbols and $\mathsf{d}$ is a constructor. Moreover, suppose $\mathsf{f}\,\colon\,\mathsf{s_{2}}\to\mathsf{s_{1}}$, $\mathsf{g}\,\colon\,\mathsf{s_{2}}\to\mathsf{s_{3}}$ and $\mathsf{d}\,\colon\,\mathsf{s_{3}}\to\mathsf{s_{1}}$. Then we cannot type the corresponding weak innermost dependency pair $\mathsf{f}^{\sharp}(x)\to\mathsf{g}^{\sharp}(x)$ as above because (return-)types of $\mathsf{f}^{\sharp}$ and $\mathsf{g}^{\sharp}$ differ. As for practical all termination techniques, compatibility of weak innermost dependency pairs with polynomial path orders also yield compatibility of type preserving weak innermost dependency pairs. Moreover, from the definition we immediately see that $\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{TPWIDP}(\mathcal{R})/\mathcal{U}}})=\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{WIDP}(\mathcal{R})/\mathcal{U}}})$ with $\mathcal{U}=\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$ and basic term $t$. And so it is clear that in order to proof Theorem 5.11 and Theorem 5.14, $\mathsf{WIDP}(\mathcal{R})$ can safely be replaced by $\mathsf{TPWIDP}(\mathcal{R})$. We continue with the proof of Theorem 5.11. ### A.1 Proof of Theorem 5.11 Let $\mathsf{ComCtx}$ abbreviate the set of contexts $\mathcal{T}({\mathcal{C}}_{\text{\tiny{$com$}}}\cup\\{{\Box}\\},\mathcal{V})$ build from compound symbols. Set $\mathcal{P}=\mathsf{TPWIDP}(\mathcal{R})$ and $\mathcal{U}=\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$. In order to highlight the correspondence between $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}$ and $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}}}$, we extend the notion of _representatives_. ###### Definition A.8. Let $C\in\mathsf{ComCtx}$. We define $\mathsf{reprs}(C)$ as the least set of (ground) contexts such that (i) if $C=\Box$ then $\Box\in\mathsf{reprs}(C)$, and (ii) if $C=\mathsf{c}({C}_{1},\ldots,{C}_{n})$, $C^{\prime}_{i}\in\mathsf{reprs}(C_{i})$ and $\sigma$ is a substitution from all variables in $\mathsf{repr}(\mathsf{c})$ to ground normal forms of $\mathcal{R}$ then $(\mathsf{repr}(\mathsf{c})\sigma)[C^{\prime}_{1},\dots,C^{\prime}_{n}]\in\mathsf{reprs}(C)$. ###### Example A.9 (Example A.6 continued). Reconsider the TRS $\mathcal{R}_{\mathsf{Lst}}$ from Example A.2, together with $\mathsf{TPWIDP}(\mathcal{R}_{\mathsf{Lst}})$ as given in Example A.6. Consider the step $\mathsf{f}(\mathsf{s}(0))\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathcal{R}_{\mathsf{Lst}}}}\mathsf{cons}(\mathsf{pair}(0,\mathsf{g}(0)),\mathsf{f}(0))$ and the corresponding dependency pair step $\mathsf{f}^{\sharp}(\mathsf{s}(0))\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathsf{TPWIDP}(\mathcal{R}_{\mathsf{Lst}})}}\mathsf{c}_{1}(\mathsf{g}^{\sharp}(0),\mathsf{f}^{\sharp}(0))\hbox to0.0pt{$\;$.\hss}$ Let $C=\mathsf{c}_{1}(\Box,\Box)$, remember that $\mathsf{repr}(\mathsf{c}_{1})=\mathsf{cons}(\mathsf{pair}(x,\Box),\Box)$, $\mathsf{reprs}(\Box)=\Box$ and observe that $C^{\prime}=\mathsf{cons}(\mathsf{pair}(0,\Box),\Box)\in\mathsf{reprs}(C)$ by taking the substitution $\sigma=\\{{x\mapsto 0}\\}$. And hence we can reformulate the above two steps as $\mathsf{f}(\mathsf{s}(0))\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathcal{R}_{\mathsf{Lst}}}}C^{\prime}[\mathsf{g}(0),\mathsf{f}(0)]$ and likewise $\mathsf{f}^{\sharp}(\mathsf{s}(0))\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}_{\mathsf{TPWIDP}(\mathcal{R}_{\mathsf{Lst}})}}C[\mathsf{g}^{\sharp}(0),\mathsf{f}^{\sharp}(0)]$. We manifest the above observation in the following lemma. ###### Lemma A.10. Let $s\in\mathcal{T}_{\mathsf{b}}$ be a ground and basic term. Suppose $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{R}}}t$. Let $\mathcal{P}=\mathsf{TPWIDP}(\mathcal{R})$ and let $\mathcal{U}=\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$. Then there exists contexts $C^{\prime}\in\mathsf{ComCtx}$, $C\in\mathsf{reprs}(C^{\prime})$ and terms ${t}_{1},\ldots,{t}_{n}$ such that $t=C[{t}_{1},\ldots,{t}_{n}]$ and moreover, $s^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{P}\cup\mathcal{U}}}C^{\prime}[t_{1}^{\sharp},\dots,t_{n}^{\sharp}]$. ###### Proof. We proof the lemma by induction on the length of the rewrite sequence $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{n}_{\mathcal{R}}}t$. The base case $n=0$ is trivial, we set $C=C^{\prime}=\Box$. So suppose $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{n}_{\mathcal{R}}}t\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}u$ and the property holds for $n$. And thus we can find contexts $C^{\prime}_{t}\in\mathsf{ComCtx}$, $C_{t}\in\mathsf{reprs}(C^{\prime}_{t})$ and terms ${t}_{1},\ldots,{t}_{n}$ such that $t=C_{t}[{t}_{1},\ldots,{t}_{n}]$ and moreover, $s^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{P}\cup\mathcal{U}}}C^{\prime}_{t}[t_{1}^{\sharp},\dots,t_{n}^{\sharp}]$. Without loss of generality we can assume $u=C_{t}[t_{1},\dots,u_{i},\dots,t_{n}]$ with $t_{i}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}u_{i}$, as the context $C_{t}$ is solely build from constructors and normal forms of $\mathcal{R}$. First, suppose $t_{i}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\varepsilon}_{\mathcal{R}}}u_{i}$, and hence $t_{i}={l\sigma}$ for ${l\to r}\in\mathcal{R}$ and substitution $\sigma\,\colon\,\mathcal{V}\to\operatorname{\mathsf{NF}}(\mathcal{R})\cap\mathcal{T}(\mathcal{F})$. Moreover ${l^{\sharp}\to\mathsf{c}(r_{1}^{\sharp},\dots,r_{m}^{\sharp})}\in\mathcal{P}$ such that $u_{i}=(\mathsf{repr}(\mathsf{c})\sigma)[r_{1}\sigma,\dots,r_{m}\sigma]$. We set $C^{\prime}$ as the context obtained from replacing the $i$-th hole of $C^{\prime}_{t}$ by $\mathsf{c}(\Box,\dots,\Box)$, likewise we set $C$ as the context obtained from replacing the $i$-th hole of $C_{t}$ by $\mathsf{repr}(\mathsf{c})\sigma$. Note that $C\in\mathsf{reprs}(C^{\prime})$. We conclude $s^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{P}\cup\mathcal{U}}}C^{\prime}[t_{1}^{\sharp},\dots,{r_{1}^{\sharp}\sigma,\dots,r_{m}^{\sharp}\sigma},\dots,t_{n}^{\sharp}]$ and $u=C[t_{1},\dots,r_{1}\sigma,\dots,r_{m}\sigma,\dots,t_{n}]$ which establishes the lemma for this case. Now suppose $t_{i}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}u_{i}$ is a step below the root. Thus we have also $t_{i}^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}u_{i}^{\sharp}$. As shown in (Hirokawa and Moser, 2008b, Lemma 16), the latter can be strengthened to $t_{i}^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\mathcal{P}\cup\mathcal{U}$}}}_{\mathcal{U}}}u_{i}^{\sharp}$. We conclude $s^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{P}\cup\mathcal{U}}}C^{\prime}_{t}[t_{1}^{\sharp},\dots,u_{i}^{\sharp},\dots,t_{n}^{\sharp}]$, and the lemma follows by setting $C^{\prime}=C^{\prime}_{t}$ and $C=C_{t}$. ∎ Suppose $\mathsf{WIDP}(\mathcal{R})$ contains non-nullary compound symbols. In order to establish an embedding in the sense of Lemma 5.6 for that case, by the above lemma we see that it suffices to consider only terms of shape $s=C[{s_{1}^{\sharp},\dots,s_{n}^{\sharp}}]$ with $C\in\mathsf{ComCtx}$. With this insight, we adjust Lemma 5.6 as below. Observe that due to the definition of $\mathsf{N}_{\pi}^{\mathsf{s}}$, we cannot simply apply Lemma 5.6 together with closure under context of $\mathrel{\blacktriangleright}_{k}$ here. ###### Lemma A.11. Let $s=C[s_{1}^{\sharp},\dots,s_{n}^{\sharp}]$ for $C\in\mathsf{ComCtx}$ and ${s}_{1},\ldots,{s}_{n}\in\mathcal{T}(\mathcal{F},\mathcal{V})$. Let $\mathcal{P}=\mathsf{TPWIDP}(\mathcal{R})$ and $\mathcal{U}=\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$. There exists a uniform constant $k\in\mathbb{N}$ depending only on $\mathcal{R}$ such that if $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds then $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}}}t$ implies $\mathsf{N}_{\pi}^{\mathsf{s}}(s)\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}^{\mathsf{s}}(t)$. Moreover, if ${\mathcal{U}}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ holds then $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{U}}}t$ implies $\mathsf{N}_{\pi}^{\mathsf{s}}(s)\mathrel{\not{\gtrsim}}_{k}\mathsf{N}_{\pi}^{\mathsf{s}}(t)$. ###### Proof. We proof the lemma for $k\mathrel{:=}\max\\{{3\cdot\lVert{r}\rVert\mid{l\to r}\in\mathcal{P}\cup\mathcal{U}}\\}$. Suppose $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}}}t$ or $s\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{U}}}t$ respectively, and thus $t=C[s_{1}^{\sharp},\dots,t_{i},\dots,s_{n}^{\sharp}]$ for some term $t_{i}$. There exists a context $C^{\prime}$ (over sequences) such that $\mathsf{N}_{\pi}^{\mathsf{s}}(s)=C^{\prime}[\mathsf{N}_{\pi}^{\mathsf{s}}(s_{i}^{\sharp})]$ and $\mathsf{N}_{\pi}^{\mathsf{s}}(t)=C^{\prime}[\mathsf{N}_{\pi}^{\mathsf{s}}(t_{i}^{\sharp})]$. First assume $s_{i}^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}}}t_{i}$, and thus $\mathsf{N}_{\pi}^{\mathsf{s}}(s_{i}^{\sharp})=[\mathsf{N}_{\pi}(l^{\sharp}\sigma)]$ and $\mathsf{N}_{\pi}^{\mathsf{s}}(t_{i})=[[\mathsf{N}_{\pi}(r_{1}^{\sharp}\sigma)],\dots,[\mathsf{N}_{\pi}(r_{m}^{\sharp}\sigma)]]$ for ${l\to\mathsf{c}(r_{1}^{\sharp},\dots,r_{m}^{\sharp})}\in\mathcal{P}$. To verify $\mathsf{N}_{\pi}^{\mathsf{s}}(s)\mathrel{\blacktriangleright}_{k}\mathsf{N}_{\pi}^{\mathsf{s}}(t)$, by Definition 2.2(ii) and Definition 2.2(iv), it suffices to verify $\mathsf{N}_{\pi}(l^{\sharp}\sigma)\mathrel{\blacktriangleright}_{k-1}\mathsf{N}_{\pi}(r_{j}^{\sharp}\sigma)$ for all $j\in\\{{1,\dots,m}\\}$. The latter is an easy consequence of Lemma 5.6, where we employ that (i) $l^{\sharp}\mathrel{{>}^{\pi}_{\mathsf{pop*}}}r_{j}^{\sharp}$ follows from the assumption $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$, and (ii) $\lVert{\pi(r)}\rVert>\lVert{\pi(r_{j})}\rVert$. Both properties are straight forward to verify since $\pi$ is safe. For $s_{i}^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{U}}}t$ we have $\mathsf{N}_{\pi}^{\mathsf{s}}(s_{i}^{\sharp})=[\mathsf{N}_{\pi}(s_{i}^{\sharp})]$ and $\mathsf{N}_{\pi}^{\mathsf{s}}(t_{i}^{\sharp})=[\mathsf{N}_{\pi}(t_{i}^{\sharp})]$ for ${l\to r}\in\mathcal{U}$. From Lemma 5.6 we obtain $\mathsf{N}_{\pi}(s_{i}^{\sharp})\mathrel{\not{\gtrsim}}_{k}\mathsf{N}_{\pi}(t_{i}^{\sharp})$ which establishes the lemma. ∎ The proof of Theorem 5.11 is now easily obtained by incorporating the above lemma into Theorem 5.9. ###### Theorem. Let $\mathcal{R}$ be a constructor TRS, and let $\mathcal{P}$ denote the set of weak innermost dependency pairs. Assume $\mathcal{P}$ is non-duplicating, and suppose ${\mathcal{U}(\mathcal{P})}\subseteq{>_{\mathcal{A}}}$ for some SLI $\mathcal{A}$. Let $\pi$ be a safe argument filtering. If $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ then $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is polynomially bounded. ###### Proof. According to Proposition 3.4 we need to find a polynomial $p$ such that $\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{WIDP}(\mathcal{R})/\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}})\leqslant p(\lvert{t^{\sharp}}\rvert)\hbox to0.0pt{$\;$.\hss}$ We set $\mathcal{P}=\mathsf{TPWIDP}(\mathcal{R})$ and likewise $\mathcal{U}=\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$. Clearly, it suffices to show $\operatorname{dl}(t^{\sharp},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{TPWIDP}(\mathcal{R})/\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}})\leqslant p(\lvert{t^{\sharp}}\rvert)$ for that. Consider a sequence $t^{\sharp}=t_{0}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}}}t_{1}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}}}\dots\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}}}t_{\ell}\hbox to0.0pt{$\;$,\hss}$ and pick a relative step $t_{i}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{P}/\mathcal{U}}}t_{i+1}$. Define $\mathcal{U}^{\prime}=\mathcal{U}\cup\mathcal{V}(\mathcal{P}\cup\mathcal{U})$ and $\phi(t)=\phi_{\mathcal{P}\cup\mathcal{U}}(t)$. Clearly Lemma 5.7 can be extended to account for steps of $\mathcal{P}$ below the root, and thus $\phi(t_{i})\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}/\mathcal{U}^{\prime}}}\phi(t_{i+1})$ follows. Hence for some terms $u$ and $v$, $\phi(t_{i})\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{U}^{\prime}}}u\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}_{\mathcal{P}}}v\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{U}^{\prime}}}\phi(t_{i+1})$. As shown in Lemma A.10, all involved terms in the above sequence have the shape $C[s_{1}^{\sharp},\dots,s_{n}^{\sharp}]$, $C\in\mathsf{ComCtx}$. As $\mathsf{WIDP}(\mathcal{R})\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$, and since $\pi$ is safe, it is easy to infer that $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ holds (we just set every compound symbol from $\mathcal{P}$ minimal in the precedence). And hence Lemma A.11 translates the above relative step to $\mathsf{N}_{\pi}^{\mathsf{s}}(\phi(s))\mathrel{\blacktriangleright}^{+}_{k}\mathsf{N}_{\pi}^{\mathsf{s}}(\phi(t))$ for some uniform constant $k$. As a consequence, $\operatorname{dl}(t,\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{WIDP}(\mathcal{R})/\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}})\leqslant\mathsf{G}_{k}(\mathsf{N}_{\pi}^{\mathsf{s}}(\phi(t)))$ for all terms $t$. Fix some reducible and basic term $t\in\mathcal{T}_{\mathsf{b}}$. Observe $\mathsf{N}_{\pi}^{\mathsf{s}}(\phi(t^{\sharp}))=[\mathsf{N}_{\pi}(t^{\sharp})]$ and so from Lemma 5.1 we see that $\mathsf{G}_{k}(\mathsf{N}_{\pi}^{\mathsf{s}}(\phi(t^{\sharp})))$ is bounded polynomially in the size of $t$. The polynomial depends only on $k$. We conclude the theorem. ∎ ### A.2 Proof of Theorem 5.14 We now proceed with the proof Theorem 5.14, which is essentially an extension to Theorem 5.11. We first precisely state what it means that a TRS _computes_ some function. For this, let $\ulcorner{\cdot}\urcorner\,\colon\,\Sigma^{\ast}\to\mathcal{T}(\mathcal{C})$ denote an _encoding function_ that represents words over the alphabet $\Sigma$ as ground values. We call an encoding $\ulcorner{\cdot}\urcorner$ _reasonable_ if it is bijective and there exists a constant $c$ such that $\lvert{u}\rvert\leqslant\lvert{\ulcorner{u}\urcorner}\rvert\leqslant c\cdot\lvert{u}\rvert$ for every $u\in\Sigma^{*}$. Let $\ulcorner{\cdot}\urcorner$ denote a reasonable encoding function, and let $\mathcal{R}$ be a completely defined, orthogonal and terminating TRS. We say that an $n$-ary function $f\colon(\Sigma^{\ast})^{n}\to\Sigma^{*}$ is _computable_ by $\mathcal{R}$ if there exists a defined function symbol $\mathsf{f}$ such that for all $w_{1},\dots,w_{n},v\in\Sigma^{\ast}$ $\mathsf{f}(\ulcorner{w_{1}}\urcorner,\dots,\ulcorner{w_{n}}\urcorner)\to^{!}\ulcorner{v}\urcorner\Longleftrightarrow f(w_{1},\dots,w_{n})=v$. On the other hand the TRS $\mathcal{R}$ _computes_ $f$, if the function $f\colon(\Sigma^{\ast})^{n}\to\Sigma^{*}$ is defined by the above equation. Below we abbreviate $\mathsf{Q}_{\pi}$ as $\mathsf{Q}$ for predicative interpretation $\mathsf{Q}\in\\{{\mathsf{S},\mathsf{N},\mathsf{N}^{\mathsf{s}}}\\}$ and the particular argument filtering $\pi$ that induces the identity function on terms. Consider the following lemma. ###### Lemma A.12. Let $\mathcal{R}$ be an $S$-sorted and completely defined constructor TRS such that the underlying signature is simple. If ${\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ then there exists a polynomial $p$ such that for all ground and well-typed basic terms $t\in\mathcal{T}_{\mathsf{b}}$, $t^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}}s$ implies $\lvert{s}\rvert\leqslant p(\lvert{t}\rvert)$. ###### Proof. Let $\mathcal{S}=\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))$. Suppose $t^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{S}}}s$, or equivalently $t^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{v}}$}}}^{\ast}_{\mathcal{S}}}s$ since $\mathcal{R}$ is completely defined. By Lemma A.11 we derive $\mathsf{N}^{\mathsf{s}}(t^{\sharp})\mathrel{\not{\gtrsim}}_{k}^{*}\mathsf{N}^{\mathsf{s}}(s)$ for some uniform $k\in\mathbb{N}$. And thus $\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(s))\leqslant\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(t^{\sharp}))$. As $\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(t^{\sharp}))=\mathsf{G}_{k}([\mathsf{N}(t^{\sharp})])$ is bounded polynomially in the size of $t$ according to Lemma 5.2, we see that there exists a polynomial $p$ such that $\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(s))\leqslant\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(t^{\sharp}))\leqslant p(\lvert{t}\rvert)$. Since $\mathcal{R}$ is and $S$-sorted TRS over a simple signature, the same holds for $\mathcal{S}$ due to Lemma A.7. And thus since $t^{\sharp}$ is well-typed and $t^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{S}}}s$ holds, also $s$ is well-typed. Let $q$ be the polynomial as given from Lemma A.4 with $\lvert{s}\rvert\leqslant q(\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(s)))$. Summing up, we derive $\lvert{s}\rvert\leqslant q(\mathsf{G}_{k}(\mathsf{N}^{\mathsf{s}}(s)))\leqslant q(p(\lvert{t}\rvert))$ as desired. ∎ The above lemma has established that sizes of reducts with respect to the relation $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathsf{TPWIDP}(\mathcal{R})\cup\mathcal{U}(\mathsf{WIDP}(\mathcal{R}))}}$ are bounded polynomially in the size of the start term, provided we can orient dependency pairs and usable rules. It remains to verify that this is indeed sufficient to appropriately estimate sizes of reducts with respect to $\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}$. The fact is established in the final Theorem. ###### Theorem. Let $\mathcal{R}$ be an orthogonal $S$-sorted and completely defined constructor TRS such that the underlying signature is simple. Let $\mathcal{P}$ denote the set of weak innermost dependency pairs. Assume $\mathcal{P}$ is non-duplicating, and suppose ${\mathcal{U}(\mathcal{P})}\subseteq{>_{\mathcal{A}}}$ for some SLI $\mathcal{A}$. If $\mathcal{P}\subseteq{\mathrel{{>}^{\pi}_{\mathsf{pop*}}}}$ and $\mathcal{U}(\mathcal{P})\subseteq{\mathrel{\text{\raisebox{0.0pt}{${\not{>}}^{\pi}_{\text{\raisebox{2.0pt}{$\mathsf{pop*}$}}}$}}}}$ then the functions computed by $\mathcal{R}$ are computable in polynomial- time. ###### Proof. We single out one of the defined symbols $\mathsf{f}\in\mathcal{D}$ and consider the corresponding function $f\colon(\Sigma^{\ast})^{n}\to\Sigma^{\ast}$ computed by $\mathcal{R}$. Under the assumptions, $\mathcal{R}$ is terminating, but moreover $\operatorname{rc}^{\text{\scriptsize$\operatorname{\mathsf{i}}$}}_{\mathcal{R}}$ is polynomially bounded according to Theorem 5.11. Additionally, from orthogonality (and hence confluence) of $\mathcal{R}$, normal forms are unique and so the function $f$ is well-defined. Suppose $\mathsf{f}(\ulcorner{w_{1}}\urcorner,\dots,\ulcorner{w_{n}}\urcorner)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$$}}}^{!}_{\mathcal{R}}}\ulcorner{v}\urcorner$ for words $w_{1},\dots,w_{n},v$. In particular, from confluence we see that $\mathsf{f}(\ulcorner{w_{1}}\urcorner,\dots,\ulcorner{w_{n}}\urcorner)\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}t_{1}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}\cdots\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}t_{\ell}=\ulcorner{v}\urcorner\hbox to0.0pt{$\;$.\hss}$ It is folklore that there exists a polytime algorithm performing one rewrite step. Hence to conclude the existence of a polytime algorithm for $f$ it suffices to bound the size of terms $t_{i}$ for $1\leqslant i\leqslant\ell$ polynomially in $\sum_{i}\lvert{w_{i}}\rvert$. And as we suppose that the encoding $\ulcorner{\cdot}\urcorner$ is reasonable, it thus suffice to bound the sizes of $t_{i}$ for $i\in\\{{1,\dots,\ell}\\}$ polynomially in the size of $t_{0}=\mathsf{f}(\ulcorner{w_{1}}\urcorner,\dots,\ulcorner{w_{n}}\urcorner)$. Consider a term $t_{i}$. Without loss of generality, we can assume $t_{i}$ is ground. According to Lemma A.10 there exists contexts $C^{\prime}_{i}\in\mathsf{ComCtx}$, $C_{i}\in\mathsf{reprs}(C^{\prime}_{i})$ and terms ${u}_{1},\ldots,{u}_{n}$ such that $t_{i}=C_{i}[{u}_{1},\ldots,{u}_{n}]$ and moreover, $t_{0}^{\sharp}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{P}\cup\mathcal{U}}}C^{\prime}_{i}[u_{1}^{\sharp},\dots,u_{n}^{\sharp}]$ for all $i\in\\{{1,\dots,\ell}\\}$. From the assumption $\mathsf{WIDP}(\mathcal{R})\subseteq{\mathrel{{>}_{\mathsf{pop*}}}}$ we see $\mathsf{TPWIDP}(\mathcal{R})\subseteq{\mathrel{{>}_{\mathsf{pop*}}}}$. Thus by Lemma A.12 there exists a polynomial $p$ such that $\lvert{C^{\prime}_{i}[u_{1}^{\sharp},\dots,u_{n}^{\sharp}]}\rvert\leqslant p(\lvert{t_{0}}\rvert)$. And so, clearly $\sum_{j=0}^{n}\lvert{u_{j}}\rvert\leqslant p(\lvert{t_{0}}\rvert)$. It remains to bound the sizes of contexts $C_{i}$ polynomially in $\lvert{t_{0}}\rvert$. Recall Definition A.8, and recall that $C_{i}\in\mathsf{reprs}(C^{\prime}_{i})$. Thus $C_{i}$ is a context build from constructors and variables, where the latter are replaced by normal forms of $\mathcal{R}$. Since $\mathcal{R}$ is completely defined, $\operatorname{\mathsf{NF}}(\mathcal{R})$ coincides with values. We conclude that $C_{i}\in\mathcal{T}(\mathcal{C}\cup\\{{\Box_{s}\mid s\in S}\\})$. Here $\Box_{s}$ denotes the hole of sort $s$. Moreover since $\mathcal{R}$ is $S$-sorted, and $t_{0}\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}^{\ast}_{\mathcal{R}}}C_{i}[{u}_{1},\ldots,{u}_{n}]$, we see that $C_{i}$ is well-typed. We define $\triangle_{\mathcal{R}}=\max\\{{\operatorname{\mathsf{dp}}(r)\mid{l\to r}\in\mathcal{R}}\\}$. By a straight forward induction it follows that $\operatorname{\mathsf{dp}}(t_{i})\leqslant\operatorname{\mathsf{dp}}(t_{0})+\triangle_{\mathcal{R}}\cdot i\leqslant\lvert{t_{0}}\rvert+\triangle_{\mathcal{R}}\cdot\operatorname{dl}(t_{0},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})$. As a consequence, $\operatorname{\mathsf{dp}}({C_{i}})\leqslant\lvert{t_{0}}\rvert+\triangle_{\mathcal{R}}\cdot\operatorname{dl}(t_{0},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})$, and thus by Proposition A.3 there exists constants $c,d\in\mathbb{N}$ such that $\lvert{C_{i}}\rvert\leqslant c\cdot\operatorname{\mathsf{dp}}(C_{i})^{d}\leqslant c\cdot(\lvert{t_{0}}\rvert+\triangle_{\mathcal{R}}\cdot\operatorname{dl}(t_{0},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}}))^{d}$. As we have that $\operatorname{dl}(t_{0},\mathrel{\xrightarrow{\raisebox{-2.0pt}[0.0pt][0.0pt]{\text{\scriptsize$\operatorname{\mathsf{i}}$}}}_{\mathcal{R}}})$ is polynomially bounded in the size of $t_{0}$, it follows that $\lvert{C_{i}}\rvert\leqslant q(\lvert{t_{0}}\rvert)$ for some polynomial $q$. Summing up, we conclude that for all $i\in\\{{1,\dots,\ell}\\}$, $\lvert{t_{i}}\rvert\leqslant p(\lvert{t_{0}}\rvert)+q(\lvert{t_{0}}\rvert)$ for the polynomials $p$ and $q$ from above. This concludes the theorem. ∎ ## References * Arai and Moser (2005) Toshiyasu Arai and Georg Moser. Proofs of termination of rewrite systems for polytime functions. In _Proc. 25th FSTTCS_ , volume 3821 of _LNCS_ , pages 529–540, 2005. * Arts and Giesl (2000) Thomas Arts and Jürgen Giesl. Termination of term rewriting using dependency pairs. _TCS_ , 236(1–2):133–178, 2000. * Avanzini (2009) Martin Avanzini. Automation of polynomial path orders. Master’s thesis, University of Innsbruck, Faculty for Computer Science., 2009. Available at http://cl-informatik.uibk.ac.at/~zini/MT.pdf. * Avanzini and Moser (2008) Martin Avanzini and Georg Moser. Complexity analysis by rewriting. In _Proc. 9th FLOPS_ , volume 4989 of _LNCS_ , pages 130–146, 2008. * Avanzini et al. (2008) Martin Avanzini, Georg Moser, and Andreas Schnabl. Automated implicit computational complexity analysis (system description). In _Proc. 4th IJCAR_ , volume 5195 of _LNCS_ , pages 132–138, 2008. * Baader and Nipkow (1998) Franz Baader and Tobias Nipkow. _Term Rewriting and All That_. Cambridge University Press, 1998. * Bellantoni and Cook (1992) Stephen Bellantoni and Stephen Cook. A new recursion-theoretic characterization of the polytime functions. _CC_ , 2(2):97–110, 1992. * Bonfante et al. (2009) G. Bonfante, J.-Y. Marion, and J.-Y. Moyen. Quasi-interpretations: A way to control resources. _TCS_ , 2009. To appear. * Eén and Sörensson (2003) Niklas Eén and Niklas Sörensson. An extensible SAT-solver. In _Proc. 6th SAT_ , volume 2919 of _LNCS_ , pages 502–518, 2003\. * Endrullis et al. (2008) Jörg Endrullis, Johannes Waldmann, and Hans Zantema. Matrix interpretations for proving termination of term rewriting. _JAR_ , 40(2–3):195–220, 2008. * Fuhs et al. (2007) Carsten Fuhs, Jürgen Giesl, Aart Middeldorp, Peter Schneider-Kamp, René Thiemann, and Harald Zankl. SAT solving for termination analysis with polynomial interpretations. In _Proc. 10th SAT_ , volume 4501 of _LNCS_ , pages 340–354, 2007\. * Geser (1990) Alfons Geser. _Relative Termination_. PhD thesis, University of Passau, Faculty for Mathematics and Computer Science, 1990. * Giesl et al. (2005) Jürgen Giesl, René Thiemann, and Peter Schneider-Kamp. Proving and disproving termination of higher-order functions. In _Proc. 5th FroCoS_ , volume 4501 of _LNCS_ , pages 340–354, 2005. * Hirokawa and Moser (2008a) Nao Hirokawa and Georg Moser. Complexity, graphs, and the dependency pair method. In _Proc. 15th LPAR_ , volume 5330 of _LNCS_ , pages 667–681, 2008a. * Hirokawa and Moser (2008b) Nao Hirokawa and Georg Moser. Automated complexity analysis based on the dependency pair method. In _Proc. 4th IJCAR_ , volume 5195 of _LNCS_ , pages 364–380, 2008b. * Hofbauer and Lautemann (1989) D. Hofbauer and C. Lautemann. Termination proofs and the length of derivations. In _Proc. 3rd RTA_ , volume 355 of _LNCS_ , pages 167–177, 1989\. * Marion and Péchoux (2008) J.-Y. Marion and R. Péchoux. Characterizations of polynomial complexity classes with a better intensionality. In _Proc. 10th PPDP_ , pages 79–88. ACM, 2008. * Marion (2003) Jean-Yves Marion. Analysing the implicit complexity of programs. _IC_ , 183:2–18, 2003. * Simmons (1988) Harold Simmons. The realm of primitive recursion. _ARCH_ , 27:177–188, 1988. * Terese (2003) Terese. _Term Rewriting Systems_ , volume 55 of _Cambridge Tracts in Theoretical Computer Science_. Cambridge University Press, 2003. * Thiemann (2007) René Thiemann. _The DP Framework for Proving Termination of Term Rewriting_. PhD thesis, University of Aachen, Department of Computer Science, 2007\.
arxiv-papers
2009-04-06T18:10:53
2024-09-04T02:49:01.745525
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Martin Avanzini and Georg Moser", "submitter": "Martin Avanzini", "url": "https://arxiv.org/abs/0904.0981" }
0904.1040
# Locating critical point of QCD phase transition basing on finite-size scaling Chen Lizhu Institute of Particle Physics, Hua-Zhong Normal University, Wuhan 430079, China X.S. Chen Institute of Theoretial Physics, Chinese Academy of Sciences, Beijing 100190, China Wu Yuanfang Institute of Particle Physics, Hua-Zhong Normal University, Wuhan 430079, China Key Laboratory of Quark $\&$ Lepton Physics (Huazhong Normal University), Ministry of Education, China ###### Abstract It is argued that in relativistic heavy ion collisions, due to limited size of the formed matter, the reliable criterion of critical point is finite-size scaling, rather than non-monotonous behavior of observable. How to locate critical point by finite-size scaling is proposed. The data of $p_{\rm t}$ correlation from RHIC/STAR are analyzed. Critical points are likely observed around $\sqrt{s}=62$ and $200$ GeV. They could be, respectively, the transition of deconfinement and chiral symmetry restoration predicted by lattice-QCD. Further confirmation with other observable and energies is suggested. ###### pacs: 12.38.Mh, 25.75.Nq, 25.75.Gz Lattice-QCD simulations have shown that the transition of deconfinement in quantum chromodynamics (QCD) at vanishing baryon chemical potential $\mu_{\rm B}$ is crossover lattice-1 . There has been much speculation that the crossover becomes a true first-order phase transition for larger values of $\mu_{\rm B}$. This suggests that the QCD phase diagram can exhibit a critical endpoint where the line of first order transition matches that of second order or analytical crossover 1st . Chiral symmetry restoration is another QCD originated phase transition. It has been shown that the transition for $\mu_{\rm B}=0$ is crossover c-crossover . So there could also be a chiral critical endpoint in phase diagram. But it is unclear if the critical temperature of chiral symmetry restoration is above karsch-h , or equal to karsch-s , or below quarkyonic that of the deconfinement. Locating the critical endpoints of QCD phase transitions by lattice calculation is still a formidable challenge. But if the critical endpoint is in the region accessible to current relativistic heavy ion collisions, it should be discovered experimentally. Most of the current signatures for finding the critical point are focused on the anomalous, or non-monotonous, behavior of the observable at various incident energies ebye-t . The argument is that in infinite system, the correlation length $\xi$ diverges when approaching the critical point. The contribution of this singularity to the observable is supposed to be proportional to $\xi^{2}$. However, the data from RHIC and SPS in more than a decade accumulation show no sign of anomalous behavior as a function of $\sqrt{s}$ ebye-e . In relativistic heavy ion collisions, two nuclei move with relativistic velocity and collide as two contracted pancakes. More central collision makes overlapped area larger. It is just because the large number of strongly interacting nucleons in more central nuclear collisions make the transition between hadron and quark-gluon plasma possible. The centrality (or the system size) dependence of the observable is noticeable starprc . Due to the finite size of system, no divergence can be practically observed at critical point. The physical quantities, which are divergent in infinite system, become finite and have a maximum, i.e., so called non-monotonous behavior. However, the position of the maximum changes with system size and deviates from the true critical point. The appearance of non-monotonous behavior is not always associated with critical point. Taking one-dimensional Ising model as an example, there is no critical point in this model, but its specific heat in a finite system has non-monotonous behavior. Moreover, the absence of non-monotonous behavior does not mean no critical point. The physical quantities like order parameter, which are finite in infinite system, have a monotonous behavior near critical point in a finite system chen1996 . Therefore, non-monotonous behavior is not a reliable criterion for the critical point of finite system. An effective identification of critical point of finite system is the finite- size scaling, which was proposed from phenomenological fss-1 and renormalization-group fss-RG theories, and was approved by the Monte Carlo results of finite systems in different universal classes fss-2 . In this letter, we first propose how to locate critical point by finite-size scaling. Then the data of $p_{\rm t}$ correlation at 6 centralities and 4 incident energies from RHIC/STAR are analyzed. The behavior of critical point is likely observed around $\sqrt{s}=62$ and $200$ GeV. Finally, we suggest how to confirm the findings and precisely locate the critical point in coming experimental study. The main points of finite-size scaling can be described as the following. An observable $Q$ of finite system is a function of temperature $T$ and system size $L$. When $L$ is much larger than the microscopic length scale and $T$ is in the vicinity of critical point $T_{c}$, the observable $Q(T,L)$ can be written in a finite-size scaling form fss-1 ; fss-RG ; fss-2 , $Q(T,L)=L^{\lambda/\nu}F_{Q}(tL^{1/\nu}).$ (1) $t=(T-T_{c})/T_{c}$ is the reduced temperature and $\lambda$ is the critical exponent of the observable. $\nu$ is the critical exponent of the correlation length $\xi=\xi_{0}t^{-\nu}$. Finite-size scaling not only characterizes the scaling behavior of thermodynamic quantities of finite system near critical point, but also provides criterion for locating the critical point. At critical point $T=T_{c}$, the finite-size scaling function $F_{Q}$ in Eq. (1) becomes $F_{Q}(0)=Q(T_{c},L)L^{-\lambda/\nu},$ (2) which is constant and independent of system size $L$. In the plot of $Q(T,L)L^{-\lambda/\nu}$ vs $T$, the critical point [$T_{c}$, $F_{Q}(0)$] is a fixed point, where all curves of different system sizes converges to. Reversely, the appearance of fixed point indicates the existence of a critical point. If the critical exponent $\lambda=0$, like Binder cumulant ratio binder1981 , the fixed point can be obtained directly from the temperature dependence of this observable at different system sizes. This is why Binder cumulant ratio has been used very widely in determining critical point of finite-size system. If the critical exponent $\lambda\neq 0$ and is unknown, the fixed point can be found by investigating the temperature dependence of $Q(T,L)L^{-a}$ at different system sizes. When a fixed point is observed at a certain parameter $a_{0}$, it indicates the existence of a critical point and the parameter $a_{0}$ is related to the ratio of critical exponents, i.e., $\lambda/\nu=a_{0}$. The critical point can also be found directly from the system size dependence of the observable. Taking logarithm in the both sides of Eq. (1), it becomes $\ln Q(T,L)=\lambda/\nu\ln L+\ln F_{Q}(tL^{1/\nu}).$ (3) At critical point $t=0$, the second term of Eq. (3) becomes a constant and $\ln Q(T_{c},L)$ becomes a straight line with respect to $\ln L$. If system is away from the critical point, the second term of Eq. (3) is no longer a constant. It gives an additional size dependent contribution to the observable and makes $\ln Q(T,L)$ deviate from the straight line with respect to $\ln L$. It is found recently that the finite-size scaling holds not only for thermodynamic quantities like order-parameter, susceptibility, and so on, but also for various cluster sizes liangsheng and their fluctuations lizhu-ising . Therefore, the finite-size scaling of various critical related observable could be used to identify critical point and its critical exponents. In relativistic heavy ion collision, correlation and fluctuation of final state particles is regarded as critical related observable lattice-corr . Although much attention have been drawn in measuring them, but influence of system size has been neglected. The available data for system size study is very few. The $p_{\rm t}$ correlation at Au+ Au collisions from RHIC/STAR starprc is the only data which can be used for the analysis, where the centrality dependence of $p_{\rm t}$ correlation at 4 incident energies are well presented starprc . But the errors of the data at $\sqrt{s}=20$ GeV are much larger than that at other collision energies. The $p_{\rm t}$ correlation is defined as $\displaystyle P(\sqrt{s},L)=\frac{1}{N_{\rm e}}\sum\limits_{k=1}^{N_{\rm e}}\frac{\sum\limits_{i=1}^{N_{k}}\sum\limits_{j=1,i\not=j}^{N_{k}}(p_{{\rm t},i}-\langle p_{\rm t}\rangle)(p_{{\rm t},j}-\langle p_{\rm t}\rangle)}{N_{k}(N_{k}-1)}.$ (4) $N_{\rm e}$ is the number of event, $p_{{\rm t},i}$ is the transverse-momentum of the $i$th particle in each event, and $N_{k}$ is the number of particles in the $k$th event. $\langle\ldots\rangle$ is the average over event sample. Collision energy is the controllable condition. Here we let it play the role of temperature in the analysis of finite-size scaling. The size of the formed matter is mainly limited by the size of overlapping transverse region, which is proportional to the number of participant nucleons and is quantified as centrality. So the initial mean size of the formed matter can be approximately estimated by the square root of participants, $\sqrt{N_{\rm part}}$. We choose dimensionless (or relative) size, $\displaystyle L=\sqrt{N_{\rm part}}/\sqrt{2N_{\rm A}},$ (5) as scaled mean size of initial system, where $N_{\rm A}$ is the number of nucleons of incident nucleus. The system size at transition should be a monotonically increasing function of $L$. The position of critical point is insensitive to the concrete form of this function, but only the critical exponents changes with it. As the first step, the system size at transition is assumed to be proportional to $L$. In the case of a few critical points, the finite-size scaling of $p_{\rm t}$ correlation in the vicinity of each critical collision energy $\sqrt{s_{c,i}}(i=1,2,...)$ can be written as $\displaystyle P(\sqrt{s},L)=L^{\lambda_{i}/\nu_{i}}F_{P,i}[e_{i}L^{1/\nu_{i}}].$ (6) $e_{i}=(\sqrt{s}-\sqrt{s_{c,i}})/\sqrt{s_{c,i}}$ is the reduced collision energy at $i$th critical point, which is unknown in priori. $\lambda_{i}$ is the $i$th critical exponent of $p_{\rm t}$ correlation. In the following, we demonstrate how to locate the critical point by the data of $p_{\rm t}$ correlation from RHIC/STAR. Figure 1: (a) The energy dependence of $p_{\rm t}$ correlations at different sizes $L$ (or centralities). Data come from RHIC/STAR starprc . (b), (c) and (d) are $p_{\rm t}$ correlation multiplied by the factor, $L^{-a}$, with $-a=1.0$, 2.09 and 4, respectively . Firstly, we change the centrality dependence of $p_{\rm t}$ correlation at different collision energies in Ref. starprc to the collision energy dependence at different sizes (or centralities). The results are shown in Fig. 1(a). Since in the most peripheral collisions, the size of the formed matter is too small to be inside the asymptotic region of finite-size scaling, we choose six centralities at mid-central and central collisions to do the analysis. The sizes corresponding to the 6 centralities are indicated in the legend of Fig. 1(a). It is clear that at a given collision energy, the correlation strength increases with the decrease of system size. The influence of finite size is obvious. If critical collision energy of QCD phase transition is in the range of incident energy at RHIC, the behavior of fixed point should be observable. So we multiply $P(\sqrt{s},L)$ by a size factor $L^{-a}$ with different $a$ to see how it changes with the system size $L$. Varying $-a$ from small to large, it is interesting to see that at collision energy $\sqrt{s}=62$ GeV, all points of different sizes move firstly toward each other, then well converge at $-a_{0,1}=2.09$, and finally move again apart from each other. The corresponding steps and typical $a$ values are presented in Fig. 1(b), (c), and (d) respectively, where the errors in each sub-figures come from the measure of $P(\sqrt{s},L)$ only, and the errors of $N_{\rm part}$ are not included. At $\sqrt{s}=200$ GeV, the points of different sizes show the same behavior and best converge at $-a_{0,2}=2.08$. While in the whole process, the points of different sizes at energies $\sqrt{s}=20$ (or 130) GeV never move close to each other as those at $\sqrt{s}=62$ (or 200) GeV do. So there are likely two fixed points around $\sqrt{s}=62$ and 200 GeV. In order to confirm the position of fixed points, we study the $\ln L$ dependence of $\ln P(\sqrt{s},L)$ for four incident energies, respectively. A parabola fit, $c_{2}(\ln L)^{2}+c_{1}\ln L+c_{0}$, is used at each collision energy. The better straight-line behavior results in smaller $|c_{2}|$ and larger ratio of $|c_{1}/c_{2}|$. The fit parameters, $c_{2}$ and $c_{1}$, for 4 collision energies are listed in Tab. 1. It shows that the better straight- line behavior happen to be at $\sqrt{s}=62$ and 200 GeV, which are the same collision energies of fixed points found above. The data at these two energies can be well fitted, respectively, by the straight lines with slopes $a_{0,1}$ and $a_{0,2}$ obtained above by the fixed points. The results are shown in Fig. 2(a). While, the data at $\sqrt{s}=20$ and 130 GeV are better fitted by parabola as shown in Fig. 2(b). Table 1: Parameters of parabola fits. $\sqrt{s}$(GeV) | | 20 | | 62 | | 130 | | 200 ---|---|---|---|---|---|---|---|--- $|c_{2}|$ | | 1.86$\pm$ 0.93 | | 0.6 $\pm$ 0.09 | | 1.56$\pm$ 0.41 | | 0.77$\pm$ 0.1 $|c_{1}|$ | | 3.9$\pm$0.89 | | 2.59$\pm$ 0.09 | | 3.43$\pm$ 0.41 | | 2.74$\pm$0.1 Figure 2: Double-log plots of $p_{\rm t}$ correlation with respect to size, (a): straight-line fits with slopes $a_{0,1}$ and $a_{0,2}$ obtained by fixed points, and (b): parabola fits. The same analysis has also been applied to the $p_{\rm t}$ correlation normalized by the average $p_{\rm t}$ over the whole sample starprc . The analysis for normalized $p_{\rm t}$ correlation at $\sqrt{s}=62$ and $200$ GeV show exactly the same behavior of fixed points and straight lines as what $p_{\rm t}$ correlation demonstrates above. The critical exponents of normalized $p_{\rm t}$ correlation (about 1.1) are smaller than that of $p_{\rm t}$ correlation. So the critical collision energies are most probably around $\sqrt{s}=62$ and $200$ GeV, rather than near $\sqrt{s}=20$ and 130 GeV. The same analysis for other critical related observable, such as the fluctuations of mean $p_{\rm t}$ per event, the moments of multiplicity, the ratio of $K$ to $\pi$, and so on, will be greatly helpful in confirming the observed results. Therefore, the incident energy and centrality dependence of those observable are called for. If there were additional collisions around $\sqrt{s}=62$ and $200$ GeV, we could determine the finite-size scaling function defined in Eq. (6). This is impossible at present since there are only two collision energies in addition to the critical ones, and they could be outside of the asymptotic region where finite-size scaling holds. The findings of the two critical points may imply that deconfinement and chiral symmetry restoration occur at different temperatures. Which one is at the lower or higher temperature (energy) has to be confirmed finally from theoretical calculation. Two critical collision energies, $\sqrt{s}=62$ and $200$ GeV, are both within the range estimated by lattice calculation hTc . The similar ratios of critical exponents at two critical points is consistent with current theoretical estimation, which shows that all critical exponents of the deconfinement transition, in the same university as the $3$-dimensional Ising model 3d-ising , are very close to that of chiral symmetry restoration, in the same university as the $3$-dimensional O$(4)$ model with spin symmetry 3d-o4 . To the summary, we argue in this letter that finite-size effects of the formed matter in relativistic heavy ion collisions is not negligible. The finite-size scaling, rather than non-monotonous behavior of observable is a reliable criterion of the existence of critical point. Then we propose how to locate critical point by finite-size scaling. As an application, we analyze the data of $p_{\rm t}$ correlation and its normalized one at 6 centralities and 4 incident energies from RHIC/STAR. Two fixed points, and therefore two critical points, are likely observed around $\sqrt{s}=62$ and 200GeV. They could be, respectively, related to the transition of deconfinement and chiral symmetry restoration predicted by lattice-QCD. The ratios of critical exponents at these two critical points are similar, in consistence with current theoretical estimation. The confirmation of this observation requires the efforts from both theoretical and experimental sides. From experimental side, it is proposed to get more and better data on other critical related observable at current collision energies, and a few additional collisions around $\sqrt{s}=62$ and 200 GeV. Then we can more precisely determine the critical endpoints and critical exponents. The authors are grateful to Dr. Li Liangsheng, Prof. Liu Lianshou and Prof. Dr. Hou Defu for very helpful discussions. This work is supported in part by the NSFC of China with project No. 10835005 and MOE of China with project No. IRT0624 and No. B08033. ## References * (1) Y. Aoki, G. Endrodi, Z. Fodor, S.D. Katz, and K.K. Szabo, Nature 443, 675(2006). * (2) Z. Fodor and S. D. Katz, J. High Energy Phys., 050(2004); Z. Fodor, S.D. Katz, and K.K. Szabo, Phys. Lett. B 568. 73(2003). * (3) Y. Aoki, G. Endrodi, Z. Fodor, S. D. Katz, K.K. Szabo, Nature 443, 675(2006); Y. Aoki, Z. Fodor, S.D. Katz, K.K. Szabo, Phys. Lett. B 643, 46(2006). * (4) Karsch F. And Lutgemeier M., Nucl. Phys. B550, 449(1999). Ágnes Mócsy, Francesco Sannino and Kimmo Tuominen, J. Phys. G 30, S1255(2004). * (5) Karsch F., Lecture Notes Phys. 583, 209(2002), hep-lat/0106019; Y. Aoki, Z. Fodor, S.D. Katza, and K.K. Szabo, Phys. Lett. B 643, 46(2006). * (6) L. McLerran, R. D. Pisarski, Nucl. Phys. A 796, 83-100(2007); L. McLerran, K. Redlich, C. Sasaki, arXiv:0812.3585; * (7) M. A. Stephanov, Phys. Rev. Lett. 102, 032301(2009); M. A. Stephanov, K. Rajagopal, and E. Shuyak, Phys. Rev. Lett. 81, 4816(1998); ibid, Phys. Rev. D 60, 114028(1999). * (8) Stanisław Mrówczyński, arXiv:0902.0825; T. Nayak, Int. J. Mod. Phys. E 16, 3303(2008); J. T. Mitchell, PoS CFRNC2006, 015(2006); D. Adamová, et. al., (CERES Collaboration.), Nucl. Phys A 727, 97(2003). * (9) J. Adams, et. al.(STAR collaboration), Phys. Rev. C 72, 044902(2005). * (10) A. Esser, V. Dohm, and X.S. Chen, Physica A 222, 355 (1995). * (11) M. E. Fisher, in Critical Phenomena, Proceedings of the International School of Physics Enrico Fermi, Course 51, edited by M. S. Green (Academic, New York, 1971). * (12) E. Brézin, J. Phys. (Paris) 43, 15 (1982). * (13) X. S. Chen, V. Dohm, and A. L. Talapov, Physica A 232, 375 (1996); X. S. Chen, V. Dohm, and N. Schultka, Phys. Rev. Lett.77, 3641(1996). * (14) K. Binder, Z. Phys. B43, 119 (1981). * (15) Li Liangsheng and X.S. Chen (to be published). * (16) Chen Lizhu, Li Liangsheng, X.S. Chen and Wu Yuanfang (to be published). * (17) H. Heiselberg, Phys. Rept. 351, 161(2001); M. Stephanov, J. of Phys. 27, 144(2005). * (18) Y. Aoki, Z. Fodor, S.D. Katza, and K.K. Szabo, Phys. Lett. B643, 46(2006); F. Karsch, PoS CFRNC2007, arXiv:0711.0661; M. Stephanov, arXiv:hep-lat:0701002. * (19) Jorge Garcá, Julio A. Gonzalo, Physica A 326, 464(2003). * (20) Jens Braun1 and Bertram Klein, Phys. Rev.D77, 096008(2008).
arxiv-papers
2009-04-07T01:21:15
2024-09-04T02:49:01.761007
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Chen Lizhu, X.S. Chen, Wu Yuanfang", "submitter": "Yuanfang Wu", "url": "https://arxiv.org/abs/0904.1040" }
0904.1147
# On the Construction for Quantum Code $((n,K,d))_{p}$ via Logic Function over ${\rm{\mathbb{F}}}_{p}$ Shuqin Zhong, Zhi Ma, Yajie Xu and Xin L$\ddot{u}$ Zhengzhou Information Science and Technology Institute Zhengzhou, 450002, China Email: lavenderzhong@live.cn ###### Abstract This paper studies the construction for quantum codes with parameters $((n,K,d))_{p}$ by use of an n-variable logic function with APC distance $d^{\prime}\geq 2$ over ${\rm{\mathbb{F}}}_{p}$, where $d$ is related to $d^{\prime}$. We obtain $d\leq d^{\prime}$ and the maximal $K$ for all $d=d^{\prime}-k$, $0\leq k\leq d^{\prime}-2$. We also discuss the basic states and the equivalent conditions of saturating quantum Singleton bound. ## I Introduction Quantum error correcting code [1], [2], [3], [4] has become an indispensable element in many quantum information tasks such as the fault-tolerant quantum computation [5] the quantum key distribution [6] and the entanglement purification [7], [8], to fight the noises. Early in 1998, Calderbank [9] presented systematic mathematical methods to construct binary quantum codes (stabilizer codes) from classical error correcting codes over ${\rm{\mathbb{F}}}_{2}$ or ${\rm{\mathbb{F}}}_{4}$. A series of good binary quantum codes were constructed by using classical codes (BCH codes, Reed-Muller codes, AG codes, etc.). Schlingemann and Werner [10] proposed a new way to construct quantum stabilizer codes by finding certain graphs (or matrices) with special properties. Using this method they constructed several new non-binary quantum codes. In particular, they gave a new proof on the existence of quantum code $[[5,1,3]]_{p}$ for all odd primes $p$ (the first proof was given by Rain [11]). It seems that this method can be used to obtain many quantum codes saturating quantum Singleton bound (For any code $[[n,k,d]]_{p}$ , the quantum Singleton bound says that $n\geq k+2d-2$, see [3] for $p=2$ and [11] for $p\geq 3$). We call this kind of quantum codes quantum MDS codes. At the same time, Feng Keqin [12] showed there existed quantum codes $[[6,2,3]]_{p}$ and $[[7,3,3]]_{p}$ for any prime number $p$. Liu Tailin [13] proved the existence of quantum codes $[[8,2,4]]_{p}$ and $[[n,n-2,2]]_{p}$ for all odd prime numbers $p$. In the correspondence, researchers made use of Boolean functions and projection operators [14] to find quantum error correcting codes. In Ref [15], the author constructed quantum code with parameters $[[n,0,d]]_{p}$, where $d$ is the APC distance of a Boolean function. Xu [16] generalized the definition of APC distance for Boolean functions to logic functions over ${\rm{\mathbb{F}}}_{p}$, then constructed quantum code $((n,K,d))_{p}$, where $d$ is related to APC distance of an n-variable function over ${\rm{\mathbb{F}}}_{p}$. Before talking further more about the ideas and results of this paper, we need to introduce the logic construction of Ref [16] which will be used in this paper. For $d^{\prime}\geq 2$, let $f(x)$ be a function with $n$ variables and APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$. $\beta_{i}=\left(\beta_{i1},\cdots,\beta_{in}\right)\in\rm{\mathbb{F}}_{p}^{n}$ for all $1\leq i\leq K$. ###### Lemma 1 [16] The space spanned by $\\{|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)+\beta_{i}x}|x\rangle|1\leq i\leq K\\}$ is a quantum code with parameters $((n,K,d))_{p}$ satisfying: $d=min\\{W_{s}(u,v)|\exists 1\leq i\leq j\leq K,W_{s}(u,v-\beta_{i}+\beta_{j})\geq d^{\prime}\\},$ where $\zeta$ is a primitive element in $\mathbb{F}_{p}$. This result was proved by Xu in [16]. Following the work of Xu, we discussed the parameters and basic states of the constructed quantum code. The main results proved in this paper are: ###### Theorem 1 Quantum code $((n,K,d))_{p}$ spanned by $\\{|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)+\beta_{i}x}|x\rangle|1\leq i\leq K\\}$ is with following properties: 1. 1. $d\leq d^{\prime}$, 2. 2. $\beta_{1}=\cdots=\beta_{K}=0\;$ for $d=d^{\prime}$, 3. 3. $W_{H}\left(\beta_{i},\beta_{j}\right)\leq k$ for all $d^{\prime}=d-k$ if $0<k\leq d^{\prime}-2$. ###### Theorem 2 If quantum code $((n,K,d))_{p}$ is spanned by $\\{|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)+\beta_{i}x}|x\rangle|1\leq i\leq K\\}.$ Then, $K=\left\\{\begin{array}[]{l}{1\;,\;\;\;\;\;\;d=d^{\prime}}\\\ {\leq p,\;\;\;d=d^{\prime}-1}\\\ {\leq\max p^{k-2}(1+n(p-1),p^{2})\;\;,\;d=d^{\prime}-k}\end{array}\right.,$ where $2\leq k\leq d^{\prime}-2$. We state the logic description of quantum codes in Section II and the proof of our main results in Section III . Section IV is largely devoted to the basic states and equivalent conditions of constructing quantum codes saturating quantum Singleton Bound. Conclusions are drawn in Section V. ## II A Logic Description of Quantum Codes The logic description of quantum codes given by [16] can be stated in following element way. Let $f(x)$ be a function of $n$ variables over ${\rm{\mathbb{F}}}_{p}$, the quantum state $|\psi_{f}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)}|x\rangle$ is called logic state corresponding to $f(x)$, where $\zeta$ is a primitive element in ${\rm{\mathbb{F}}}_{p}$. Specially, $|\psi_{f}\rangle$ is called Boolean state corresponding to Boolean function $f(x)$ if $p=2$. Denote quantum error as $E_{\left(a,b\right)}=X\left(a\right)Z\left(b\right)$. Then, $E(a,b)\left|{\psi_{f}}\right\rangle=p^{-\frac{n}{2}}\sum\limits_{x\in\mathbb{F}_{p}^{n}}{\xi^{f(x-a)+b(x-a)}}$ (1) where $\xi$ is a primitive element in ${\rm{\mathbb{F}}}_{p}$, $a=(a_{1},\cdots,a_{n})\in\mathbb{F}_{p}^{n}$ and $b=(b_{1},\cdots,b_{n})\in\mathbb{F}_{p}^{n}$, namely, $\left|{\psi_{f}}\right\rangle\to E(a,b)\left|{\psi_{f}}\right\rangle\Leftrightarrow f(x)\to f(x-a)+b(x-a)$ (2) Let ${\rm{\mathbb{F}}}_{p}^{n}$ be the vector space of dimension $n$ over ${\rm{\mathbb{F}}}_{p}$ with the following inner product ( , ) defined by $\left(a,b\right)=\sum_{i=1}^{n}a_{i}b_{i}$ (3) for any $a=\left(a_{1},\cdots,a_{n}\right)$, $b=\left(b_{1},\cdots,b_{n}\right)$$\in{\rm{\mathbb{F}}}_{p}^{n}$. For convenience, denote $\left(a,b\right)$ as $a\cdot b$ . For $K$ different vectors $\beta_{1},\cdots,\beta_{K}$ and an n-variable function $f(x)$, $g_{i}(x)=f(x)+\beta_{i}\cdot x$, $1\leq i\leq K$ are $K$ different functions. Further more, $|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{g_{i}(x)}|x\rangle,1\leq i\leq K$ (4) are $K$ different logical states. Since, $\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)-f(x)+(\beta_{i}-\beta_{j})\cdot x}=0,$ (5) we have $\langle\psi_{i}|\psi_{j}\rangle=0$, namely, $|\psi_{i}\rangle,1\leq i\leq K$ are co-orthonogal. ###### Definition 1 The symmetrical distance between $a$ and $b$ is defined by $W_{s}(a,b)=\\#\\{i|1\leq i\leq n,(a_{i},b_{i})\neq(0,0)\\},$ (6) where $a=\left(a_{1},\cdots,a_{n}\right),b=\left(b_{1},\cdots,b_{n}\right)\in{\rm{\mathbb{F}}}_{p}^{n}$. ###### Definition 2 [15] Let $f(x)$ be an n-variable Boolean function. The APC distance of $f(x)$ is the minimum $W_{s}(a,b)$, where $a=\left(a_{1},\cdots,a_{n}\right),b=\left(b_{1},\cdots,b_{n}\right)\in{\rm{\mathbb{F}}}_{2}^{n}$ satisfying: $\sum_{x\in{\rm{\mathbb{F}}}_{2}^{n}}\left(-1\right)^{f(x)-f(x-a)-b\cdot x}\neq 0.$ (7) Xu [16] generalized the definition of APC distance for a Boolean function to logic function over ${\rm{\mathbb{F}}}_{p}$ as following. ###### Definition 3 [16] Let $f(x)$ be an n-variable function over ${\rm{\mathbb{F}}}_{p}$. The APC distance of $f(x)$ is defined by the minimum $W_{s}(a,b)$, where $a=\left(a_{1},\cdots,a_{n}\right),b=\left(b_{1},\cdots,b_{n}\right)\in F_{p}^{n}$ satisfying: $\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x-a)+b\cdot x-f\left(x\right)}\neq 0,$ (8) where $\zeta$ is a primitive element in ${\rm{\mathbb{F}}}_{p}$. ###### Definition 4 The Hamming distance between $a$ and $b$ is defined by $W_{H}(a,b)=\\#\\{i|1\leq i\leq n,a_{i}\neq b_{i}\\}$ (9) with $a=\left(a_{1},\cdots,a_{n}\right),b=\left(b_{1},\cdots,b_{n}\right)\in{\rm{\mathbb{F}}}_{p}^{n}$. ## III Proof of Main Results In this section, let $f(x)$ be an n-variable function with APC distance $d^{\prime}\geq 2$ over ${\rm{\mathbb{F}}}_{p}$ and $\beta_{i}=\left({\beta_{i1},\cdots,\beta_{in}}\right)\in{\mathbb{F}}_{p}^{n}$ for all $1\leq i\leq K$. For function $f(x)$ over ${\rm{\mathbb{F}}}_{p}$, constructing quantum code $((n,K,d))_{p}$ by Lemma 1 is to find a group of vectors, $\beta_{1},\cdots,\beta_{K}$, with special properties.The following theorem tells the properties of $\beta_{1},\cdots,\beta_{K}$. ###### Theorem 1 Quantum code $((n,K,d))_{p}$ spanned by $\\{|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)+\beta_{i}x}|x\rangle|1\leq i\leq K\\}$ is with following properties: 1. 1. $d\leq d^{\prime}$, 2. 2. $\beta_{1}=\cdots=\beta_{K}=0\;$ for $d=d^{\prime}$, 3. 3. $W_{H}\left(\beta_{i},\beta_{j}\right)\leq k$ for all $d^{\prime}=d-k$ if $0<k\leq d^{\prime}-2$. ###### Proof: We prove $d\leq d^{\prime}$ in two separate way firstly. Case 1: $\exists 1\leq i_{0}<j_{0}\leq K$ satisfying $W_{H}\left(\beta_{i_{0}},\beta_{j_{0}}\right)=t>0$. Then it is reasonable to suppose $\beta_{2i}-\beta_{1i}\neq 0$ for all $1\leq i\leq t$ and $\beta_{2i}=\beta_{1i}$ for all $t+1\leq i\leq n$. If $t\geq d^{\prime}$, set $u_{0}=(1,\underbrace{0,\cdots,0}_{n-1}),v_{0}=0$. Thus, $W_{s}\left(u_{0},v_{0}-\beta_{i_{0}}+\beta_{j_{0}}\right)=t\geq d^{\prime}.$ $d=\min\left\\{W_{s}\left(u,v\right)|\exists 1\leq i\leq j\leq K,W_{s}\left(u,v-\beta_{i}+\beta_{j}\right)\geq d^{\prime}\right\\}$ $\leq W_{s}\left(u_{0},v_{0}\right)<d^{\prime}.$ If $t<d^{\prime}$, set $u_{0}=(\underbrace{0,\cdots,0}_{t},\underbrace{1,\cdots,1}_{d^{\prime}-t},0,\cdots,0)$, $v_{0}=0$. Then, $W_{s}\left(u_{0},v_{0}-\beta_{1}+\beta_{2}\right)=d^{\prime}$ $d\leq W_{s}\left(u_{0},v_{0}\right)=d^{\prime}-t<d^{\prime}$ Therefore, $d\leq d^{\prime}$ if $\exists 1\leq i_{0}<j_{0}\leq K$ satisfying $W_{H}\left(\beta_{i_{0}},\beta_{j_{0}}\right)=t>0$. Case 2: $\beta_{i}=\beta_{j}$ for all $1\leq i<j\leq K$. Suppose $W_{H}\left(\beta_{i}\right)=t$. If $t\geq d^{\prime}$, set $u_{0}=(1,\underbrace{0,\cdots,0}_{n-1}),v_{0}=0$. Accordingly, $W_{s}\left(u_{0},v_{0}-\beta_{1}+\beta_{2}\right)=t\geq d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)<d^{\prime}.$ If $t<d^{\prime}$, set $u_{0}=(\underbrace{0,\cdots,0}_{t},\underbrace{1,\cdots,1}_{d^{\prime}-t},0,\cdots,0)$, $v_{0}=0$. As a result, $W_{s}\left(u_{0},v_{0}-\beta_{1}\right)=d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)=d^{\prime}-t\leq d^{\prime}.$ Therefore, $d\leq d^{\prime}$ if $\beta_{i}=\beta_{j}$ for all $1\leq i<j\leq K$. We now prove $\beta_{1}=\cdots=\beta_{K}=0$ if $d=d^{\prime}$. First, we prove $\beta_{1}=\cdots=\beta_{K}$. Suppose $\exists 1\leq i_{0}<j_{0}\leq K$ satisfying $W_{H}\left(\beta_{i_{0}},\beta_{j_{0}}\right)=t>0$. Hence, it is reasonable to suppose $i_{0}=1,j_{0}=2$ and $\beta_{2i}-\beta_{1i}\neq 0$ for all $1\leq i\leq t$, $\beta_{2i}-\beta_{1i}=0$ for all $t+1\leq i\leq n$. If $t\geq d^{\prime}$, set $u_{0}=(1,\underbrace{0,\cdots,0}_{n-1}),v_{0}=0$. Consequently, $W_{s}\left(u_{0},v_{0}-\beta_{1}+\beta_{2}\right)=t>d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)=1<d^{\prime}.$ If $t<d^{\prime}$, set $u_{0}=(\underbrace{0,\cdots,0}_{t},\underbrace{1,\cdots,1}_{d^{\prime}-t},0,\cdots,0)$, $v_{0}=0$. Hence, $W_{s}\left(u_{0},v_{0}-\beta_{1}+\beta_{2}\right)=d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)=d^{\prime}-t<d^{\prime}.$ A contradiction, therefore $W_{H}\left(\beta_{i},\beta_{j}\right)=0$ for all $1\leq i<j\leq n$. Hence, $\beta_{1}=\cdots=\beta_{K}$. Denote $\beta_{1},\cdots,\beta_{K}$ as $\beta_{1}$. Second, we prove $\beta_{1}=0$. Suppose $W_{H}\left(\beta_{1}\right)=t>0$, thus, it is reasonable to suppose $\beta_{1i}\neq 0$ for all $1\leq i\leq t$ and $\beta_{2i}-\beta_{1i}=0$ for all $t+1\leq i\leq n$. If $t\geq d^{\prime}$, set $u_{0}=(1,\underbrace{0,\cdots,0}_{n-1}),v_{0}=0$. As a result, $W_{s}\left(u_{0},v_{0}-\beta_{1}\right)=t,$ $d=\min\left\\{W_{s}\left(u,v\right)|W_{s}\left(u,v-\beta_{1}\right)\geq d^{\prime}\right\\}$ $\leq W_{s}\left(u_{0},v_{0}\right)<d^{\prime}.$ If $t<d^{\prime}$, set $u_{0}=(\underbrace{0,\cdots,0}_{t},\underbrace{1,\cdots,1}_{d^{\prime}-t},0,\cdots,0)$, $v_{0}=0$. Consequently, $W_{s}\left(u_{0},v_{0}-\beta_{1}\right)=d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)=d^{\prime}-t<d^{\prime}.$ A contradiction, therefore, $W_{H}\left(\beta_{1}\right)=0$. This completes the proof of property $2)$. We now prove property $3)$. Suppose $\exists 1\leq i_{0}<j_{0}\leq K$ satisfying $W_{H}\left(\beta_{i_{0}},\beta_{j_{0}}\right)\geq k+1$. Then it is reasonable to suppose $i_{0}=1,j_{0}=2$. Denote $W_{H}\left(\beta_{1},\beta_{2}\right)=t$, where $t\geq k+1$. Thus it is reasonable to suppose $\beta_{1i}\neq\beta_{2i}$ for all $1\leq i\leq t$ and $\beta_{2i}-\beta_{1i}=0$ for all $t+1\leq i\leq n$. If $t\geq d^{\prime}$, set $u_{0}=(1,\underbrace{0,\cdots,0}_{n-1}),v_{0}=0$. Hence, $W_{s}\left({u_{0},v_{0}-\beta_{1}+\beta_{2}}\right)=t\geq d^{\prime}.$ $d\leq W_{s}(u_{0},v_{0})<d^{\prime}-k.$ If $t<d^{\prime}$, set $u_{0}=(\underbrace{0,\cdots,0}_{t},\underbrace{1,\cdots,1}_{d^{\prime}-t},0,\cdots,0),v_{0}=0$. Accordingly, $W_{s}\left(u_{0},v_{0}-\beta_{1}+\beta_{2}\right)=t\geq d^{\prime},$ $d\leq W_{s}\left(u_{0},v_{0}\right)=d^{\prime}-t\leq d^{\prime}-k-1.$ A contradiction, therefore $W_{H}\left(\beta_{i},\beta_{j}\right)\leq k$ for all $1\leq i<j\leq K$ if $0<k\leq d^{\prime}-2$. This completes the proof of Theorem $1$. ∎ ###### Remark 1 It can be easily seem from Theorem $1$ that if the following conditions satisfy: 1. 1. There exists an n-variable function with APC distance $d^{\prime}\geq 2$ over ${\rm{\mathbb{F}}}_{p}$, 2. 2. A group of vectors $\beta_{1},\cdots,\beta_{K}$ over ${\rm{\mathbb{F}}}_{p}^{n}$ satisfy $W_{H}\left(\beta_{i},\beta_{j}\right)\leq k$ for all $1\leq i<j\leq K$. Quantum code $((n,K,d^{\prime}-k))_{p}$ can be constructed by Lemma $1$. In the following theorem, we are going to deal with the parameter $K$. ###### Theorem 2 If quantum code $((n,K,d))_{p}$ is spanned by $\\{|\psi_{i}\rangle=p^{-\frac{n}{2}}\sum_{x\in{\rm{\mathbb{F}}}_{p}^{n}}\zeta^{f(x)+\beta_{i}x}|x\rangle|1\leq i\leq K\\}$. Then $K=\left\\{\begin{array}[]{l}{1\;,\;\;\;\;\;\;d=d^{\prime}}\\\ {\leq p,\;\;\;d=d^{\prime}-1}\\\ {\leq\max p^{k-2}(1+n(p-1),p^{2})\;\;,\;d=d^{\prime}-k}\end{array}\right.,$ where $2\leq k\leq d^{\prime}-2$. ###### Proof: 1. 1. For $d=d^{\prime}$, it can be deduced from Theorem 1 that $\beta_{1}=\cdots=\beta_{K}=0.$ Thus, $\textit{K}=1.$ 2. 2. For $d=d^{\prime}-1$, let $W_{ij}=W_{H}(\beta_{i},\beta_{j})$ for all $1\leq i<j\leq n$. Suppose $K>p$. Then there exists $1\leq i_{0}<j_{0}\leq K$ satisfying $W_{i_{0}j_{0}}\geq 2$, a contradiction, thus $K\leq p.$ 3. 3. Denote $C_{n}^{t}$ as the number of vectors where the Hamming distance between each other is no more than $t$. For $k=2$, since $W_{H}(\beta_{i},\beta_{j})\leq 2$ for all $1\leq i<j\leq K$ by Theorem $2$. Case 1: If $\beta_{1},\cdots,\beta_{K}$ are the same in $n-2$ bits. It can be deduced that $\beta_{1},\cdots,\beta_{K}$ are different in at most 2 bits, hence, $K\leq p^{2}.$ Case 2: If that $\beta_{1},\cdots,\beta_{K}$ are the same in $n-2$ bits doesn’t satisfy, then, K is the maximal when the different bits are all n bits. Thus, $K\leq(p-1)n+1$ Therefore, $K\leq\max\\{p^{2},(p-1)n+1\\}$ for $d=d^{\prime}-2$. For $3\leq k\leq d^{\prime}-2$, since $W_{H}(\beta_{i},\beta_{j})\leq k$ by Theorem $1$ for all $1\leq i<j\leq K$. Thus, $K=C_{n}^{k}\leq pC_{n-1}^{k-1}\leq\cdots\leq p^{k-2}C_{n-k+2}^{2}$ $\leq\max p^{k-2}\\{1+(n-k+2)(p-1),p^{2}\\}$ This completes the proof of Theorem $2$. ∎ ###### Remark 2 It can be inferred from Theorem $1$ and Theorem $2$ that for an n-variable function with APC distance $d^{\prime}\geq 2$ over ${\rm{\mathbb{F}}}_{p}$, quantum code with parameters $((n,K,d))_{p}$ can be constructed by Lemma $1$ where $d\leq d^{\prime}$. Furthermore, if $d=d^{\prime}-k,0\leq k\leq d^{\prime}-2$, then $\beta_{1},\cdots,\beta_{K}$ should satisfy $W_{H}(\beta_{i},\beta_{j})\leq t$ for all $1\leq i<j\leq K$. At the same time, we obtain the maximal $K$. ## IV Basic States and Equivalent Conditions of Constructing Quantum MDS Codes ### IV-A The basic states of the constructed quantum code In this subsection, denote $\beta_{i}$ as $\beta_{i}=\left({\beta_{i1},\cdots,\beta_{in}}\right)$. For an n-variable function with APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$ and $\beta_{1},\cdots,\beta_{K}$, quantum code $((n,K,d))_{p}$ can be constructed by Lemma $1$. The basic states of the constructed quantum code can be stated as following: If $p\geq n-k+1$, then $p^{k}\geq p^{k-2}+p^{k-2}(p-1)(n-k+2).$ Let $K=p^{k}.$ At this time, we set $\beta_{1},\cdots,\beta_{K}$ be vectors that the first $k$ bits run all over ${\rm{\mathbb{F}}}_{p}^{k}$ and the last $n-k$ bits are zeros. Namely, $\beta_{ij}\in\mathbb{F}_{p}~{}for~{}1\leq j\leq k$ (10) $\beta_{ij}=0~{}for~{}k+1\leq j\leq n$ (11) where $1\leq i\leq p^{k}$. It can be checked that $W_{H}(\beta_{i},\beta_{j})\leq k$ for all $1\leq i<j\leq p^{k}$, thus, the space spanned by formula $(4)$ corresponding to $\beta_{1},\cdots,\beta_{K}$ satisfying formula (10) and (11) is a quantum code with parameters ${\rm((}n,K,d^{\prime}-k{\rm))}_{p}$. If $p<n-k+1$, then $p^{k-2}+p^{k-2}\left(n-k+2\right)(p-1)+1>p^{k}$. Let $K=p^{k-2}+p^{k-2}\left(n-k+2\right)(p-1).$ At this time, we set $\beta_{1},\cdots,\beta_{K}$ be vectors that the first $k-2$ bits run all over ${\rm{\mathbb{F}}}_{p}^{k-2}$ , the $k+l-2$ -th bit run all over ${\rm{\mathbb{F}}}_{p}\backslash\left\\{0\right\\}$, $1\leq l\leq n-k+2$. Namely, $\beta_{ij}\in\mathbb{F}_{p}~{}for~{}1\leq j\leq k-2$ (12) $\beta_{i~{}k+l-2}\in\mathbb{F}_{p}\backslash\\{0\\}~{}for~{}1\leq l\leq n-k+2$ (13) and the rest bits are all zeros. It can be easily checked that $W_{H}(\beta_{i},\beta_{j})\leq k-2+2=k$ for all $1\leq i<j\leq K$, thus, the space spanned by formula $(4)$ corresponding to $\beta_{1},\cdots,\beta_{K}$ satisfying formula (12) and formula (13) is a quantum code with parameters $((n,p^{k-2}+p^{k-2}(p-1)(n-k+2),d^{\prime}-k))_{p}.$ ### IV-B The equivalent conditions of constructing quantum MDS codes Theory of quantum code has quantum singleton bound as classical code. Quantum codes saturating quantum Singleton Bound are quantum MDS codes. The following theorem presents the equivalent conditions of quantum MDS codes constructed by Lemma 1. ###### Theorem 3 Quantum code ${\rm((}n,K,d^{\prime}-k{\rm))}_{p}$ is constructed by Lemma 1, where $d^{\prime}-k\leq\frac{n}{2}+1$. Then it saturates quantum Singleton Bound if and only if the following conditions satisfy: 1. 1. If $k=0$, then there exists an n-variable function over ${\rm{\mathbb{F}}}_{p}$ with APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$, where $d^{\prime}=\frac{n}{2}+1$ and $n$ is even, 2. 2. If $k=1$, then there exists an n-variable function with APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$, where $d^{\prime}=\frac{n}{2}+1$, 3. 3. If $2\leq k\leq d^{\prime}$ and $p\geq n-k+1$, then there exists an n-variable function with APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$, where $2d^{\prime}=n+k+2$, 4. 4. If $2\leq k\leq d^{\prime}$and$p<n-k+1$, then there exists an n-variable function with APC distance $d^{\prime}$ over ${\rm{\mathbb{F}}}_{p}$, where $p^{k-2}+p^{k-2}\left(n-k+2\right)(p-1)=p^{n-2(d^{\prime}-k)+2}$. ###### Proof: Let quantum code $((n,K,d^{\prime}-k))_{p}$ be constructed by Lemma $1$. 1. 1. If $k=0$, then $K=1$ by Theorem 2. Thus, the quantum code saturates Quantum Singleton Bound if and only if $n-2d^{\prime}+2=0.$ 2. 2. If $k=1$, we get $K\leq n(p-1)+1$ by Theorem 2. Thus, the quantum code saturates Quantum Singleton Bound if and only if $n(p-1)+1=p^{n-2d^{\prime}+4}.$ 3. 3. If $2\leq k\leq d^{\prime}$ and $p\geq n-k+1$, $K\leq p^{k}$ by Theorem 2. Thus, the quantum code saturates Quantum Singleton Bound if and only if $k=n-2\left(d^{\prime}-k\right)+2\Leftrightarrow 2d^{\prime}=n+k+2.$ 4. 4. If $2\leq k\leq d^{\prime}$ and $p<n-k+1$, $K<p^{k-2}+p^{k-2}\left(n-k+2\right)(p-1)$ by Theorem 2. Thus, the quantum code saturates Quantum Singleton Bound if and only if $p^{k-2}+p^{k-2}\left(n-k+2\right)(p-1)=p^{n-2(d^{\prime}-k)+2}.$ This completes the proof of this Theorem . ∎ ## V Conclusion Ref. [16] presented a new way to construct quantum error correcting codes. Quantum error correcting codes can be constructed by use of logic functions with n variables and APC distance $d^{\prime}\geq 2$ over ${\rm{\mathbb{F}}}_{p}$. The minimum distance of the constructed quantum code is $d=d^{\prime}-t(0\leq t\leq d^{\prime}-2)$. We can also get the maximal dimension of the corresponding space. In this paper, we also give the basic states and the equivalent conditions for existence of quantum MDS codes. It can be seem that logic functions with favorable APC distance play a key role in logic construction for quantum codes. The presented paper is to re- cast the construction of QECCs as a problem of construction logic function with favorable APC distance. Ref [17] proposed a quadratic residue construction for Boolean function with favorable APC distance. For an n-variable function over ${\rm{\mathbb{F}}}_{p}$, how to compute the APC distance fast is still a problem to be researched. ## Acknowledgment This work is supported by the NFS of China under Grant number 60403004 and the Outstanding Youth Foundation of Henan Province under Grant No.0612000500. ## References * [1] P. W. Shor, “ Scheme for Reducing Decoherence in Quantum Computer Memory,” _Phys. Rev. A._ 54 (2), pp. 1098–1105, 1995. * [2] C. H. Bennettt, D. P. DiVincenco, J. A. Smolin and W. K. Wootters, “ Mixed state entanglement and quantum error correction,” _Phys. Rev._ 54 (5), pp. 3824–3851, 1996. * [3] E. Knill and R. Laflamme, “ A Theory of quantum error-correcting code saturating quantum Hamming Bound,” _Phys. Rev. A._ 55, pp. 900–911, 1997. * [4] A. M. Steane, “ Simple quantum error correcting codes,” _Phys. Rev. Lett._ 77, pp. 793–797, 1996. * [5] D. Gottesman, “ Theory of fault-tolerant quantum computation,” _Phys. Rev. A._ 57, pp. 127–137, 1998. * [6] C. H. Bennett and G. Brassard, “ Quantum cryptography: public key distribution and coin tossing,” _Proceedings of IEEE International Conference on Computers, Systems, and Sig-nal Processing,_ pp. 175–179, 1984. * [7] S. Glancy, E. Knill and H. M. Vasconcelos,“ Entanglement purification of any stabilizer state,” _Phys. Rev. A._ 74, no. 032319, 2006. * [8] A. Ambainis and D. Gottesman, “The minimum distance problem for two-way entanglement purification,” _IEEE Trans. Inform. Theory._ 52, pp. 748–753, 2006. * [9] A. R. Calderbank, E. M. Rains, P. W. Shor and N. J. A. Sloane, “ Quantum error correction via codes over $\mathbb{F}_{4}$,” _IEEE Trans. Inform Theory_ 44, pp. 1369–1387, 1998. * [10] D. Schlingemann and R. F. Werner,“Quantum error correcting codes associated with graphs,” _Phys. Rev. A._ 65, 012308, 2002. * [11] E. M. Rain, “ Nonbinary quantum code,” _IEEE Trans. Inform Theory_ 45, pp. 1827–1832, 1999. * [12] K. Q. Feng, “ Quantum codes $[[6,2,3]]_{p}$ and $[[7,3,3]]_{p}$ ($p\geq 3$) exist,” _IEEE Trans. Inform Theory_ 48 (8), pp. 2384–2391, 2002. * [13] T. L. Liu, “ On construction for nonbinary cyclic quantum code via graph,” _China Science Inform Theory. E._ 35 (6), pp. 588–596, 2005. * [14] V. Aggarwal and R. Calderbank, “ Boolean functions, projection operators and quantum error correction codes,” _IEEE Trans. Inform Theory._ , 54 (4) PP. 1700–1707, 2008\. * [15] L. E. Danielsen, “ On self-dual quantum codes, graphs, and Boolean functions,” http://arxiv.org/abs/quant-ph/0503236, 2005.12. * [16] Y. J. Xu, “Logic function and quantum code,” http://arxiv.org/abs/quant-ph/0712.3605v4, 2008.01. * [17] L. E. Danielsen, “ Aperiodic Propagation Criteria for Boolean Functions,” _In Information and Computation_ 204 (5), pp. 741–770, 2006.
arxiv-papers
2009-04-07T14:14:55
2024-09-04T02:49:01.767945
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Shuqin Zhong, Zhi Ma, Yajie Xu and Xing Lv", "submitter": "Xin L\\\"u", "url": "https://arxiv.org/abs/0904.1147" }
0904.1301
# Differential graded Lie algebras controlling infinitesimal deformations of coherent sheaves Domenico Fiorenza Dipartimento di Matematica “Guido Castelnuovo”, Sapienza Università di Roma, P.le Aldo Moro 5, I-00185 Roma Italy. fiorenza@mat.uniroma1.it www.mat.uniroma1.it/~fiorenza/ , Donatella Iacono Max-Planck Institut für Mathematik, Vivatsgasse 7, D 53111 Bonn Germany iacono@mpim-bonn.mpg.de and Elena Martinengo Dipartimento di Matematica “Guido Castelnuovo”, Sapienza Università di Roma, P.le Aldo Moro 5, I-00185 Roma Italy. martinengo@mat.uniroma1.it www.mat.uniroma1.it/dottorato/ ###### Abstract. We use the Thom-Whitney construction to show that infinitesimal deformations of a coherent sheaf ${\mathcal{F}}$ are controlled by the differential graded Lie algebra of global sections of an acyclic resolution of the sheaf $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$, where $\mathcal{E}^{\cdot}$ is any locally free resolution of ${\mathcal{F}}$. In particular, one recovers the well known fact that the tangent space to $\operatorname{Def}_{\mathcal{F}}$ is $\operatorname{Ext}^{1}({\mathcal{F}},{\mathcal{F}})$, and obstructions are contained in $\operatorname{Ext}^{2}({\mathcal{F}},{\mathcal{F}})$. The main tool is the identification of the deformation functor associated with the Thom-Whitney DGLA of a semicosimplicial DGLA ${\mathfrak{g}}^{\Delta}$, whose cohomology is concentrated in nonnegative degrees, with a noncommutative Čech cohomology-type functor $H^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})$. ###### Key words and phrases: Differential graded Lie algebras, functors of Artin rings ###### 1991 Mathematics Subject Classification: 18G30, 18G50, 18G55, 13D10, 17B70 ## Introduction The classical approach to deformation theory, starting with Kodaira and Spencer’s studies on deformations of complex manifolds, consists in deforming the objects locally and then glue back together these local deformations. During the last thirty years, another approach to deformation problems has been developed. The philosophy underlying it, essentially due to Quillen, Deligne, Drinfeld and Kontsevich, is that, in characteristic zero, every deformation problem is controlled by a differential graded Lie algebra, via solutions of Maurer-Cartan equation modulo gauge equivalence. The aim of this paper is to exhibit an explicit equivalence between the two approaches for the problem of infinitesimal deformations of coherent sheaves. In the particular case of a locally free sheaf $\mathcal{E}$ of ${\mathcal{O}}_{X}$-modules on a complex manifold $X$, the Kodaira-Spencer’s description of deformations of $\mathcal{E}$ is given in terms of the Čech functor $H^{1}(X;\exp\mathcal{E}nd(\mathcal{E}))$, where $\mathcal{E}nd(\mathcal{E})$ is the sheaf of endomorphism of $\mathcal{E}$. Indeed, a locally free sheaf has only trivial local deformations and so a deformation of $\mathcal{E}$ is reduced to a deformation of the gluing data of its local charts, and the compatibility conditions these gluing data have to satisfy is precisely expressed by the cocycle condition in the Čech functor. On the other hand, it is well known that deformations of $\mathcal{E}$ are controlled by the DGLA of global sections of an acyclic resolution of $\mathcal{E}nd(\mathcal{E})$, e.g., by the DGLA $A^{0,*}_{X}(\mathcal{E}nd(\mathcal{E}))$ of $(0,*)$-forms on $X$ with values in the sheaf of endomorphisms of the sheaf $\mathcal{E}$. The equivalence between these two descriptions is best understood by moving from set-valued to groupoid-valued deformation functors; see, e.g., [9, 20]. Associating with any open set $U$ in $X$ the groupoid $\operatorname{Def}_{\mathcal{E}|_{U}}$ of infinitesimal deformations of $\mathcal{E}$ over $U$ (over a fixed base $\operatorname{Spec}A$, for some local Artin ring $A$) defines a stack over ${\bf{Top}}_{X}$; this is just a one-word way of saying that global deformations of $\mathcal{E}$ are the same thing as the descent data for its local deformations: $\operatorname{Def}_{\mathcal{E}}\simeq\displaystyle\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\operatorname{Def}_{\mathcal{E}|_{U}},$ where $\Delta_{\mathcal{U}}$ is the semisimplicial object in ${\bf{Top}}_{X}$ associated with an open cover $\mathcal{U}$ of $X$. Next, one sees that locally the groupoid of deformations of $\mathcal{E}|_{U}$ is equivalent to the Deligne groupoid of $\mathcal{E}nd(\mathcal{E})(U)$; since these equivalences are compatible with restriction maps, one has an equivalence of semicosimplicial groupoids. Finally, Deligne groupoid commutes with homotopy limits of DGLA concentrated in positive degree (see [9]), so that $\operatorname{Def}_{\mathcal{E}}\simeq\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\operatorname{Del}_{\mathcal{E}nd(\mathcal{E})(U)}\simeq\operatorname{Del}_{\begin{subarray}{c}{\mathop{\rm holim}\mathcal{E}nd(\mathcal{E})(U)}\\\ {\scriptscriptstyle{U\in\Delta_{\mathcal{U}}\phantom{mmmmmi}}}\end{subarray}}.$ This shows that the problem of infinitesimal deformations of $\mathcal{E}$ is controlled by the DGLA $\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\mathcal{E}nd(\mathcal{E})(U)$. It is now a simple exercise in homological algebra showing that there is a quasi- isomorphism of DGLAs $\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\mathcal{E}nd(\mathcal{E})(U)\simeq A^{0,*}_{X}(\mathcal{E}nd(\mathcal{E})).$ The reader who prefers to not leave the peaceful realm of set-valued deformation functors can found a direct (but less enlightening) proof of the equivalence between the Kodaira-Spencer’s and the DGLA approach to infinitesimal deformation of locally free sheaves in [7], where the explicit Thom-Whitney model for $\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\mathcal{E}nd(\mathcal{E})(U)$ is used. We now turn our attention to deformations of a coherent sheaf $\mathcal{F}$ of $\mathcal{O}_{X}$-modules on a complex manifold or an algebraic variety $X$. The classical approach to this deformation problem is based on a locally free resolution $\mathcal{E}^{\cdot}\to\mathcal{F}$ of $\mathcal{F}$; then, the data of a deformation of $\mathcal{F}$ are the data of local deformations of $\mathcal{E}^{\cdot}$ with appropriate gluing conditions. More precisely, the sheaf of differential graded Lie algebras $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$ of the endomorphisms of the resolution $\mathcal{E}^{\cdot}$ controls infinitesimal deformations of $\mathcal{F}$ via the Čech-type functor $H^{1}_{\rm Ho}(X;\exp\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$; the subscript ${\rm Ho}$ refers to the fact that cocycle conditions hold only up to homotopy. The functor $H^{1}_{\rm Ho}(X;\exp\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$ is actually independent of the particular resolution chosen. And again, on the DGLA side, one proves that infinitesimal deformations of ${\mathcal{F}}$ are controlled by the DGLA of global sections of an acyclic resolution of $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$; in particular, one recovers the well known fact that the tangent space to $\operatorname{Def}_{\mathcal{F}}$ is $\operatorname{Ext}^{1}({\mathcal{F}},{\mathcal{F}})$, and obstructions are contained in $\operatorname{Ext}^{2}({\mathcal{F}},{\mathcal{F}})$. To see why such a result should hold, one has to make a further step and go from groupoid-valued to $\infty$-groupoid-valued deformation functors, and to think the whole problem in terms of $\infty$-stacks [10, 16, 24]. Indeed, due to the presence of negative degree components in $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$, the groupoids $\operatorname{Def}_{\mathcal{F}|_{U}}$ are no more equivalent to the Deligne groupoids $\operatorname{Del}_{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(U)}$; yet from the $\infty$-groupoid point of view it is natural to expect that the stack $\operatorname{Def}_{\mathcal{F}}$ is locally homotopy equivalent to the $\infty$-stack $\operatorname{MC}_{\bullet}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$. Then one reasons as in the locally free sheaf case, using the fact that the Kan complexes-valued functor $\operatorname{MC}_{\bullet}$ commutes with homotopy limits of DGLAs whose cohomology is concentrated in positive degree [8]: $\operatorname{Def}_{\mathcal{F}}\simeq\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\operatorname{Def}_{\mathcal{F}|_{U}}\simeq\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}{\operatorname{MC}_{\bullet}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(U))}\simeq{\operatorname{MC}_{\bullet}}(\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(U)).$ As above, the homotopy limit $\mathop{\rm holim}_{U\in\Delta_{\mathcal{U}}}\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(U)$ is quasiisomorphic to the DGLA of global sections of an acyclic resolution of $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$, which therefore controls the infinitesimal deformations of ${\mathcal{F}}$. The aim of this paper is to give a direct proof of this fact at the level of set-valued deformation functors. The proof closely follows the argument in [7] and does not rely on the conjectural homotopy equivalence between $\operatorname{Def}_{\mathcal{F}|_{U}}$ and $\operatorname{MC}_{\bullet}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(U))$. More precisely, we associate with any semicosimplicial DGLA ${\mathfrak{g}}^{\Delta}$ a set-valued functor of Artin rings $Z^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})$ together with an equivalence relation $\sim$ on it, such that the quotient functor $H^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})=Z^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})/\sim$ is an abstract version of $H^{1}_{\rm Ho}(X;\exp\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$. The latter is obtained, as a particular case, by considering the Čech semicosimplicial Lie algebra ${\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}})(\mathcal{U})$ $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 35.97528pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&\crcr}}}\ignorespaces{\hbox{\kern-35.97528pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i}{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}})(U_{i})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 59.97528pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 59.97528pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 59.97528pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j}{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}})(U_{ij})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 165.53476pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 165.53476pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 165.53476pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 165.53476pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j<k}{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}})(U_{ijk})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 281.63312pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 281.63312pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 281.63312pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 281.63312pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 281.63312pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\cdots}$}}}}}}}\ignorespaces}}}}\ignorespaces.$ Namely, $H^{1}_{\rm Ho}(X;\exp\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))=\lim_{\begin{subarray}{c}\longrightarrow\\\ {\mathcal{U}}\end{subarray}}H^{1}_{\rm sc}(\exp{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}})(\mathcal{U}))$ and both sides coincide with $H^{1}_{\rm sc}(\exp\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(\mathcal{U}))$, for an $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$-acyclic cover of $X$. Next, we consider the Thom-Whitney model $\operatorname{Tot}_{TW}{\mathfrak{g}}^{\Delta}$ for $\mathop{\rm holim}{\mathfrak{g}}^{\Delta}$ and show that there exists a commutative diagram of functors $\textstyle{{\rm DGLA}^{\Delta_{\rm mon}}_{H^{\geq 0}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\operatorname{Tot}_{TW}}$$\scriptstyle{H^{1}_{\rm sc}(\exp-)}$$\textstyle{{\rm DGLA}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\phantom{mi}\text{Maurer- Cartan}/\text{gauge}}$$\textstyle{\mathbf{Set}^{{\mathbf{Art}}_{\mathbb{K}}},}$ where ${\rm DGLA}^{\Delta_{\rm mon}}_{H^{\geq 0}}$ is the category of semicosimplicial DGLAs with no negative cohomology. From the point of view of $\infty$-groupoids, this can be seen as an explicit description of the set $\pi_{\leq 0}(\operatorname{MC}_{\bullet}(\mathop{\rm holim}{\mathfrak{g}}^{\Delta}))$. The paper is organized as follows: in Section 1 we dicuss deformations of coherent sheaves from a classical perspective and show how deformation data can be conveniently encoded into a Čech cohomology group with coefficient in a sheaf of DGLAs. In Section 2, the functors $H^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})$ and $H^{1}_{\rm Ho}(X;\exp{\mathcal{L}})$ are defined; next, in Sections 3 and 4, we recall the definition of the Thom- Whitney DGLA associated with $\mathfrak{g}^{\Delta}$ and with its truncations $\mathfrak{g}^{\Delta_{[m,n]}}$. Sections 5 and 6 are rather technical; namely Section 5 is devoted to a technical lemma on Maurer-Cartan elements in the Thom-Whitney DGLAs $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})$ and $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$ and Section 6 to the proof of the isomorphism $H^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta_{[0,1]}})$ and $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}$. Finally, in Section 7, we are able to prove our main result (Theorem 7.6): under the cohomological hypotesis $H^{-1}(\mathfrak{g}_{2})=0$ there is a natural isomorphism of funtors $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\cong H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$; moreover, if $H^{j}(\mathfrak{g}_{i})=0$ for all $i\geq 0$ and $j<0$, then there is a natural isomorphism of functors $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta})}\cong H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$. In the concluding Section 8, we use this isomorphism to prove that infinitesimal deformations of a coherent sheaf ${\mathcal{F}}$ are controlled by the DGLA of global sections of an acyclic resolution of $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$, where $\mathcal{E}^{\cdot}$ is a locally free resolution of $\mathcal{F}$. While revising this paper, we became aware of [25] where a similar construction is developed and investigated. Throughout this paper we work on a fixed algebraically closed field $\mathbb{K}$ of characteristic zero; the symbol $\bf{Art}_{\mathbb{K}}$ denotes the category of local Artinian $\mathbb{K}$-algebras $(A,{\mathfrak{m}}_{A})$, with residue field $\mathbb{K}$. * Acknowledgement. We thank Marco Manetti for stimulating discussions on the subject and for useful comments and suggestions on the first version of this paper; d.i. thanks the Mathematical Department “Guido Castelnuovo”, Sapienza Università di Roma for the hospitality. ## 1\. Infinitesimal deformations and sheaves of DGLAs In this section, we study infinitesimal deformations of a coherent sheaf $\mathcal{F}$ of $\mathcal{O}_{X}$-modules on a smooth projective variety $X$ and explain how these deformations can be naturally described in terms of a sheaf of differential graded Lie algebras on $X$. An infinitesimal deformation of the coherent sheaf of $\mathcal{O}_{X}$-modules $\mathcal{F}$ over $A\in\bf{Art}_{\mathbb{K}}$ is given by a coherent sheaf $\mathcal{F}_{A}$ of $\mathcal{O}_{X}\otimes A$-modules on $X\times\operatorname{Spec}A$, flat over $A$, with a morphism of sheaves $\pi:\mathcal{F}_{A}\to\mathcal{F}$ inducing an isomorphism $\mathcal{F}_{A}\otimes_{A}\mathbb{K}\cong\mathcal{F}$. Two deformations $\mathcal{F}_{A},\mathcal{F^{\prime}}_{A}$ of the coherent sheaf $\mathcal{F}$ over $A$ are isomorphic if there exists an isomorphism of sheaves $f:\mathcal{F}_{A}\to\mathcal{F^{\prime}}_{A}$, that commutes with the morphisms to $\mathcal{F}$. We denote by $\operatorname{Def}_{\mathcal{F}}:\bf{Art}_{\mathbb{K}}\to\bf{Set}$ the functor of infinitesimal deformations of the sheaf $\mathcal{F}$. We start by studying infinitesimal deformations of a coherent sheaf ${\mathcal{F}}$ of $\mathcal{O}_{X}$-modules on an affine variety $X$. Let $X=\operatorname{Spec}R$, where $R$ is a Noetherian $\mathbb{K}$-algebra and let $\mathcal{F}$ be the coherent sheaf associated with a finitely generated $R$-module $M$; in this simple case, deformations of the sheaf $\mathcal{F}$ reduce to deformations of the $R$-module $M$. An infinitesimal deformation of the $R$-module $M$ over $A\in\bf{Art}_{\mathbb{K}}$ is given by a $R\otimes A$-module $M_{A}$, flat over $A$, with a morphism $\pi:M_{A}\to M$ inducing an isomorphism $M_{A}\otimes_{A}\mathbb{K}\cong M$. Two deformations $M_{A}$ and $M^{\prime}_{A}$ of the module $M$ over $A$ are isomorphic if there exists an isomorphism of $R\otimes A$-modules $f:M_{A}\to M^{\prime}_{A}$, that commutes with the morphisms to $M$. Next, let (1) $\cdots\stackrel{{\scriptstyle d}}{{\longrightarrow}}R^{n_{1}}\stackrel{{\scriptstyle d}}{{\longrightarrow}}R^{n_{0}}\stackrel{{\scriptstyle d}}{{\longrightarrow}}M\longrightarrow 0$ be a presentation of $M$ as $R$-module. If $M_{A}$ is a deformation of $M$ over $A$, then it is an $A$-flat $R\otimes A$-module; therefore, flatness allows to lift relations between generators and to construct the exact sequence $\cdots\stackrel{{\scriptstyle d_{A}}}{{\longrightarrow}}R^{n_{1}}\otimes A\stackrel{{\scriptstyle d_{A}}}{{\longrightarrow}}R^{n_{0}}\otimes A\stackrel{{\scriptstyle d_{A}}}{{\longrightarrow}}M_{A}\longrightarrow 0,$ that reduces to (1) when tensored by $\mathbb{K}$ over $A$. On the other hand, the datum of such an exact sequence assures flatness of the $R\otimes A$-module $M_{A}$ and so it defines a deformation of $M$ over $A$ (see [1, par. 3], or [23, Theorem A.31] for details of these correspondences). Moreover, if $M_{A}$ and $M^{\prime}_{A}$ are isomorphic deformations of $M$ over $A$, the isomorphism between them lifts to an isomorphism between the correspondent deformed complexes and viceversa. Next, we return to the global case of a coherent sheaf $\mathcal{F}$ of $\mathcal{O}_{X}$-modules on a smooth projective variety $X$. Let $0\longrightarrow\mathcal{E}^{-m}\stackrel{{\scriptstyle d}}{{\longrightarrow}}\cdots\stackrel{{\scriptstyle d}}{{\longrightarrow}}\mathcal{E}^{-1}\stackrel{{\scriptstyle d}}{{\longrightarrow}}\mathcal{E}^{0}\stackrel{{\scriptstyle d}}{{\longrightarrow}}\mathcal{F}\longrightarrow 0$ be a global syzygy for ${\mathcal{F}}$, and denote by $\mathcal{E}^{\cdot}$ the complex of locally free sheaves $(\mathcal{E}^{\cdot},d):\qquad\qquad 0\longrightarrow\mathcal{E}^{-m}\stackrel{{\scriptstyle d}}{{\longrightarrow}}\cdots\stackrel{{\scriptstyle d}}{{\longrightarrow}}\mathcal{E}^{-1}\stackrel{{\scriptstyle d}}{{\longrightarrow}}\mathcal{E}^{0}\longrightarrow 0.$ Let $\mathcal{U}=\\{U_{i}\\}_{i\in I}$ be an affine111or Stein, if we work in the complex analytic category. open cover of $X$, such that every sheaf of $\mathcal{E}^{\cdot}$ is free on each $U_{i}$. The Kodaira-Spencer approach to infinitesimal deformations of $\mathcal{F}$ consists in deforming the sheaf $\mathcal{F}$ locally in such a way that local deformations glue together to a global sheaf, or equivalently, in view of the above discussion of the affine case, in deforming the complex $(\mathcal{E}^{\cdot},d)$ on every open set $U_{i}$ in such a way that these data glue together in cohomology. Following this approach, let us make explicit the deformation data: the first datum is an element $l=\\{l_{i}\\}_{i}\in\prod_{i}{\mathcal{E}nd}^{1}(\mathcal{E}^{\cdot})(U_{i})\otimes\mathfrak{m}_{A}$ defining, on every open set $U_{i}$, a complex $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$ which is a deformation of the complex $(\mathcal{E}^{\cdot}|_{U_{i}},d)$. Note that the condition for $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$ to be a complex is the Maurer-Cartan equation: $dl_{i}+\frac{1}{2}[l_{i},l_{i}]=0,\quad\mbox{for all }i\in I.$ Also note that, by upper semicontinuity of cohomology, the complex $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$ is exact except possibly at zero level. To glue together the deformed local complexes $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$, we need to specify isomorphisms between the deformed complexes on the double intersections of open sets of the cover ${\mathcal{U}}$. Since these isomorphisms will have to be deformations of the identity, they will be of the form $e^{m_{ij}}:(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l_{j})\to(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l_{i}),$ with $m=\\{m_{ij}\\}_{i<j}\in\prod_{i<j}{\mathcal{E}nd}^{0}(\mathcal{E}^{\cdot})(U_{ij})\otimes\mathfrak{m}_{A}$. The compatibiliy with the differentials, i.e., the commutativity of the diagrams $\textstyle{\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{e^{m_{ij}}}$$\scriptstyle{d+l_{j}|_{U_{ij}}}$$\textstyle{\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{d+l_{i}|_{U_{ij}}}$$\textstyle{\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{e^{m_{ij}}}$$\textstyle{\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A}$ can be written as $d+l_{i}|_{U_{ij}}=e^{m_{ij}}(d+l_{j}|_{U_{ij}})e^{-m_{ij}}$, i.e., as $l_{i}|_{U_{ij}}=e^{m_{ij}}*l_{j}|_{U_{ij}},\quad\mbox{for all }i<j.$ Finally, the above isomorphisms have to satisfy the cocycle condition up to homotopy. Indeed, in order to obtain a deformation of ${\mathcal{F}}$, we actually do not want to glue together the complexes $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$, but rather their cohomology sheaves. In other words, we require $e^{m_{jk}}e^{-m_{ik}}e^{m_{ij}}$ to be homotopic to the identity on triple intersections. Taking logarithm, what we require is that $m_{jk}\bullet-m_{ik}\bullet m_{ij}$ is homotopy equivalent to zero, i.e., $m_{jk}|_{U_{ijk}}\bullet-m_{ik}|_{U_{ijk}}\bullet m_{ij}|_{U_{ijk}}=[d+l_{j}|_{U_{ijk}},n_{ijk}],$ for some $n=\\{n_{ijk}\\}_{ijk}\in\prod_{i<j<k}{\mathcal{E}nd}^{-1}(\mathcal{E}^{\cdot})(U_{ijk})$. This homotopy cocycle equation is conveniently rewritten as $m_{jk}|_{U_{ijk}}\bullet-m_{ik}|_{U_{ijk}}\bullet m_{ij}|_{U_{ijk}}=d_{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})}n_{ijk}+[l_{j}|_{U_{ijk}},n_{ijk}].$ Next, let explain how the data introduced above are concretely linked with deformations of the coherent sheaf $\mathcal{F}$ over $A$. As the homotopy cocycle equation is satisfied, the local $A$-flat sheaves of $\mathcal{O}_{X}|_{U_{i}}\otimes A$-modules ${\mathcal{F}}_{A,U_{i}}:={\mathcal{H}}^{*}(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$ glue together to give a global coherent sheaf ${\mathcal{F}}_{A}$ which is a deformation of ${\mathcal{F}}$. On the other hand, every deformation ${\mathcal{F}}_{A}$ of the sheaf $\mathcal{F}$ can be obtained in this way. Indeed, the resolution $(\mathcal{E}^{\cdot},d)$ locally extends to projective resolutions $(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})$ of ${\mathcal{F}}_{A}|_{U_{i}}$; these deformed local resolutions are linked each other on double intersections by isomorphisms of complexes lifting the identity of ${\mathcal{F}}_{A}$ and the compositions of these isomorphisms on triple intersections are homotopy to the identity, since they lift the identity of ${\mathcal{F}}_{A}$ and liftings are unique up to homotopy. Let now ${\mathcal{F}}_{A}$ and ${\mathcal{F}^{\prime}}_{A}$ be isomorphic deformations of the sheaf ${\mathcal{F}}$, associated with deformation data $(l,m)$ and $(l^{\prime},m^{\prime})$, respectively. The restriction to every open set $U_{i}$ of the isomorphism between ${\mathcal{F}}_{A}$ and ${\mathcal{F}^{\prime}}_{A}$ lifts to local isomorphisms between the correspondent deformed complexes. Since these isomorphisms specialize to identities of $(\mathcal{E}^{\cdot}|_{U_{i}},d)$, they are of the form $e^{a_{i}}:(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l_{i})\to(\mathcal{E}^{\cdot}|_{U_{i}}\otimes A,d+l^{\prime}_{i})$, where $a=\\{a_{i}\\}_{i}\in\prod_{i}{\mathcal{E}nd}^{0}(\mathcal{E}^{\cdot})(U_{i})\otimes\mathfrak{m}_{A}$. As above, compatibility with the differentials translates into the equations $e^{a_{i}}*l_{i}=l^{\prime}_{i},\quad\mbox{for all }i\in I.$ Finally, since the local isomorphisms $e^{a_{i}}$ lift a global isomorphism in cohomology, the diagrams $\textstyle{(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l_{j}|_{U_{ij}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{e^{m_{ij}}}$$\scriptstyle{e^{a_{j}}|_{U_{ij}}}$$\textstyle{(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l_{i}|_{U_{ij}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{e^{a_{i}}|_{U_{ij}}}$$\textstyle{(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l^{\prime}_{j}|_{U_{ij}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{e^{m^{\prime}_{ij}}}$$\textstyle{(\mathcal{E}^{\cdot}|_{U_{ij}}\otimes A,d+l^{\prime}_{i}|_{U_{ij}}),}$ expressing compatibility with the gluing morphisms, commute in cohomology. Moreover, since the compositions $e^{-m_{ij}}e^{-a_{i}}e^{m^{\prime}_{ij}}e^{a_{j}}$ lift the identity of ${\mathcal{F}}_{A}$ on double intersections and liftings are unique up to homotopy, these compositions are homotopy to identity and, reasoning as above, we find $-m_{ij}\bullet-a_{i}|_{U_{ij}}\bullet m^{\prime}_{ij}\bullet a_{j}|_{U_{ij}}=d_{\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})}b_{ij}+[l_{j}|_{U_{ij}},b_{ij}],$ for some $b=\\{b_{ij}\\}_{i<j}\in\prod_{i<j}{\mathcal{E}nd}^{-1}(\mathcal{E}^{\cdot})(U_{ij})\otimes\mathfrak{m}_{A}$. Viceversa, if for the deformation data $(l,m)$ and $(l^{\prime},m^{\prime})$ there exist $a=\\{a_{i}\\}_{i}\in\prod_{i}{\mathcal{E}nd}^{0}(\mathcal{E}^{\cdot})(U_{i})\otimes\mathfrak{m}_{A}$ and $b=\\{b_{ij}\\}_{i<j}\in\prod_{i<j}{\mathcal{E}nd}^{-1}(\mathcal{E}^{\cdot})(U_{ij})\otimes\mathfrak{m}_{A}$ that satisfy equations above, the local isomorphisms $e^{a_{i}}$ glue together in cohomology to give a global isomorphism of the correspondent deformed sheaves ${\mathcal{F}}_{A}$ and ${\mathcal{F}^{\prime}}_{A}$. Summing up, we have shown that in the Kodaira-Spencer approach, infinitesimal deformations of the coherent sheaf ${\mathcal{F}}$ are controlled by the sheaf of DGLAs ${\mathcal{E}nd}^{*}(\mathcal{E}^{\cdot})$, via the equations above. At the end of Section 7, we will apply techniques of semicosimplicial DGLAs developed in this paper to recover the classical well known fact that the functor of infinitesimal deformations of $\mathcal{F}$ has $\operatorname{Ext}^{1}({\mathcal{F}},{\mathcal{F}})$ as tangent space and its obstructions are contained in $\operatorname{Ext}^{2}({\mathcal{F}},{\mathcal{F}})$. ###### Remark 1.1. The above description of the functor of infinitesimal deformations of ${\mathcal{F}}$ is actually independent of the resolution chosen. Indeed, the DGLAs of the endomorphisms of any two locally free resolutions of ${\mathcal{F}}$ are quasi-isomorphic (see,e.g., [22, Lemma 4.4]). ###### Remark 1.2. If the sheaf $\mathcal{F}$ is locally free, then we can take its trivial resolution $0\to\mathcal{F}\to\mathcal{F}\to 0$; thus, we recover the well known fact that the infinitesimal deformations of $\mathcal{F}$ are controlled by the sheaf $\mathcal{E}nd(\mathcal{F})$ of the endomorphism of $\mathcal{F}$ , via the Čech functor $H^{1}(X,\mathcal{E}nd(\mathcal{F}))$. ###### Remark 1.3. Note that the results of this section actually hold under the hypotesis that ${\mathcal{F}}$ admists a global syzygy. This hypothesis is always satisfied, but in the general case the resolution is less obvious. Indeed, following Illusie [12, Section 1.5], for any sheaf $\mathcal{F}$ of ${\mathcal{O}}_{X}$-modules on a topological space $X$, one can construct the _standard free resolution_ of $\mathcal{F}$: $\ldots\longrightarrow{\mathcal{R}}({\mathcal{F}})^{2}\stackrel{{\scriptstyle D^{2}}}{{\longrightarrow}}{\mathcal{R}}({\mathcal{F}})^{1}\stackrel{{\scriptstyle D^{1}}}{{\longrightarrow}}{\mathcal{R}}({\mathcal{F}})^{0}\longrightarrow\mathcal{F}\longrightarrow 0.$ Its terms are defined by recurrence: ${\mathcal{R}}({\mathcal{F}})^{0}$ is the free sheaf of $\mathcal{O}_{X}$-modules associated with the presheaf $U\mapsto\mathcal{O}_{X}(U)^{{\mathcal{F}}(U)}$, given on every open set $U\subset X$ by the free $\mathcal{O}_{X}(U)$-module generated by ${\mathcal{F}}(U)$; ${\mathcal{R}}({\mathcal{F}})^{j}$ is the free sheaf of $\mathcal{O}_{X}$-modules associated with the presheaf $U\mapsto\mathcal{O}_{X}(U)^{{\mathcal{R}}({\mathcal{F}})^{j-1}(U)}$, given on every open set $U\subset X$ by the free $\mathcal{O}_{X}(U)$-module generated by ${\mathcal{R}}({\mathcal{F}})^{j-1}(U)$. To define morphisms $D^{j}$, let’s write explicitly elements in ${\mathcal{R}}({\mathcal{F}})^{j}(U)$. An element in ${\mathcal{R}}({\mathcal{F}})^{0}(U)$ is of the form $a^{i_{0}}\odot f_{i_{0}}$, where $a^{i_{0}}\in\mathcal{O}_{X}(U)$, $f_{i_{0}}\in\mathcal{F}(U)$, and we used the $\odot$ to denote the action of ${\mathcal{O}}_{X}(U)$ on the free $\mathcal{O}_{X}(U)$-module generated by $\mathcal{F}(U)$, in order to distinguish it from the action of ${\mathcal{O}}_{X}(U)$ on the $\mathcal{O}_{X}(U)$-module $\mathcal{F}(U)$. Recursively, an element in ${\mathcal{R}}({\mathcal{F}})^{j}(U)$ is of the form $a^{i_{j}}\odot a_{i_{j}}^{i_{j-1}}\odot\cdots\odot a^{i_{0}}_{i_{1}}\odot f_{i_{0}}$ where $a_{i_{k}}^{i_{k-1}}\in{\mathcal{O}}_{X}(U)$, $f_{i_{0}}\in\mathcal{F}(U)$. The differential of the resolution is defined as $D^{j}=\sum_{k=0}^{j}(-1)^{i}d^{j}_{k}$, where $d^{j}_{k}:{\mathcal{R}}({\mathcal{F}})^{j}\longrightarrow{\mathcal{R}}({\mathcal{F}})^{j-1}$ is defined by $a^{i_{j}}\odot\cdots\odot a_{i_{k+1}}^{i_{k}}\odot a_{i_{k}}^{i_{k-1}}\odot\cdots\odot a^{i_{0}}_{i_{1}}\odot f_{i_{0}}\mapsto a^{i_{j}}\odot\cdots\odot a_{i_{k+1}}^{i_{k}}a_{i_{k}}^{i_{k-1}}\odot\cdots\odot a^{i_{0}}_{i_{1}}\odot f_{i_{0}}$ The relevant fact is that the sequence of free sheaves of $\mathcal{O}_{X}$-modules $({\mathcal{R}}({\mathcal{F}})^{\cdot},D^{\cdot})\to\mathcal{F}$ is a resolution of $\mathcal{F}$ [12, Theorem 1.5.3]. This construction can be done for every sheaf $\mathcal{F}$ of $\mathcal{O}_{X}$-modules on a topological space $X$; Illusie obtains it as an example of the even more general construction of the standard simplicial resolution of a pair of adjont functors [12, Section 1.5]. ## 2\. Semicosimplicial DGLAs and the functor $H^{1}_{\rm sc}(\exp{\mathfrak{g}}^{\Delta})$ A _semicosimplicial differential graded Lie algebra_ is a covariant functor $\mathbf{\Delta}_{\operatorname{mon}}\to\mathbf{DGLA}$, from the category $\mathbf{\Delta}_{\operatorname{mon}}$, whose objects are finite ordinal sets and whose morphisms are order-preserving injective maps between them, to the category of DGLAs. Equivalently, a semicosimplicial DGLA ${\mathfrak{g}}^{\Delta}$ is a diagram $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 6.90001pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&\crcr}}}\ignorespaces{\hbox{\kern-6.90001pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{0}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 30.90001pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 30.90001pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 30.90001pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{1}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 68.70003pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{2}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 106.50005pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\cdots}$}}}}}}}\ignorespaces}}}}\ignorespaces,$ where each ${\mathfrak{g}}_{i}$ is a DGLA, and for each $i>0$ there are $i+1$ morphisms of DGLAs $\partial_{k,i}\colon{\mathfrak{g}}_{i-1}\to{\mathfrak{g}}_{i},\qquad k=0,\dots,i,$ such that $\partial_{k+1,i+1}\partial_{l,i}=\partial_{l,i+1}\partial_{k,i}$, for any $k\geq l$. A classical example is the following: given a sheaf ${\mathcal{L}}$ of DGLAs on a topological space $X$, and an open cover ${\mathcal{U}}$ of $X$, one has the Čech cosimplicial DGLA ${\mathcal{L}}({\mathcal{U}})$, $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 20.62444pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&\crcr}}}\ignorespaces{\hbox{\kern-20.62444pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i}\mathcal{L}(U_{i})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 44.62444pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 44.62444pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 44.62444pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j}\mathcal{L}(U_{ij})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 119.4822pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j<k}\mathcal{L}(U_{ijk})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 204.87886pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\cdots}$}}}}}}}\ignorespaces}}}}\ignorespaces,$ where the morphisms $\partial_{k,i}$ are the restriction maps. ###### Definition 2.1. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. The functor $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta}):\mathbf{Art}_{\mathbb{K}}\to\mathbf{Set}$ is defined, for all $A\in\mathbf{Art}_{\mathbb{K}}$, by $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)=\left\\{(l,m)\in(\mathfrak{g}_{0}^{1}\oplus\mathfrak{g}^{0}_{1})\otimes\mathfrak{m}_{A}\left|\begin{array}[]{l}dl+\frac{1}{2}[l,l]=0,\\\ \partial_{1,1}l=e^{m}*\partial_{0,1}l,\\\ {\partial_{0,2}m}\bullet{-\partial_{1,2}m}\bullet{\partial_{2,2}m}=dn+[\partial_{2,2}\partial_{0,1}l,n]\\\ \qquad\qquad\qquad\qquad\text{for some $n\in{\mathfrak{g}}_{2}^{-1}\otimes{\mathfrak{m}}_{A}$}\end{array}\right.\right\\}.$ ###### Remark 2.2. In DGLA theory, given a DGLA $L$ and a Maurer-Cartan element $x$ in $\operatorname{MC}_{L}(A)$, the set ${\rm Stab}(x)=\\{dh+[x,h]\mid h\in L^{-1}\otimes{\mathfrak{m}}_{A}\\}$ is called the _irrelevant stabilizer_ of $x$. Note that ${\rm Stab}(x)\subseteq{\rm stab}(x)$, where ${\rm stab}(x)=\\{a\in L^{0}\otimes\mathfrak{m}_{A}\mid e^{a}*x=x\\}$ is the stabilizer of $x$ under the gauge action of $L^{0}\otimes\mathfrak{m}_{A}$ on $\operatorname{MC}_{L}(A)$. Also note that, for any $a\in L^{0}\otimes\mathfrak{m}_{A}$, $e^{a}e^{{\rm Stab}(x)}e^{-a}=e^{{\rm Stab}(y)}$, with $y=e^{a}*x.$ We now introduce an equivalence relation on the set $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ as follows: we say that two elements $(l_{0},m_{0})$ and $(l_{1},m_{1})\in Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ are equivalent under the relation $\sim$ if and only if there exist elements $a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $b\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$ such that $\begin{cases}e^{a}*l_{0}=l_{1}\\\ -m_{0}\bullet-\partial_{1,1}a\bullet m_{1}\bullet\partial_{0,1}a=db+[\partial_{0,1}l_{0},b].\end{cases}$ ###### Remark 2.3. The relation $\sim$ is actually an equivalence relation on $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$. First note that the set $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ is closed under $\sim$. Indeed, let $(l_{0},m_{0})$ and $(l_{1},m_{1})\in(\mathfrak{g}_{0}^{1}\oplus\mathfrak{g}_{1}^{0})\otimes\mathfrak{m}_{A}$ be equivalent under $\sim$ via elements $a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $b\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$, and suppose that $(l_{0},m_{0})\in Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$. Then $l_{1}=e^{a}*l_{0}$ satisfies the Maurer Cartan equation and $e^{m_{1}}*\partial_{0,1}l_{1}=e^{\partial_{1,1}a\bullet m_{0}\bullet(db+[\partial_{0,1}l_{0},b])\bullet-\partial_{0,1}a}e^{\partial_{0,1}a}*\partial_{0,1}l_{0}=e^{\partial_{1,1}a}*\partial_{1,1}l_{0}=\partial_{1,1}l_{1}.$ Moreover, an easy calculation, using relations between maps $\partial_{j,k}$ and Remark 2.2, shows that ${\partial_{0,2}m_{1}}\bullet{-\partial_{1,2}m_{1}}\bullet{\partial_{2,2}m_{1}}$ is an element of the irrelevant stabilizer of $\partial_{2,2}\partial_{0,1}l_{1}$. Secondly $\sim$ is an equivalent relation. Reflexivity is trivial; for simmetry, let $(l_{0},m_{0})$ and $(l_{1},m_{1})$ be equivalent via elements $\ a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $b\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$, then $e^{-a}*l_{1}=l_{0}$ and $-m_{1}\bullet\partial_{1,1}(a)\bullet m_{0}\bullet-\partial_{0,1}(a)=\partial_{0,1}(a)\bullet-(db+[\partial_{0,1}l_{0},b])\bullet-\partial_{0,1}(a)$ is an element of the irrelevant stabilizer of $\partial_{0,1}l_{1}$, by Remark 2.2. Next, let $(l_{0},m_{0})\sim(l_{1},m_{1})$ via $a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $b\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$, and $(l_{1},m_{1})\sim(l_{2},m_{2})$ via $\alpha\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $\beta\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$; then, $e^{\alpha\bullet a}*l_{0}=l_{2}$ and $-m_{0}\bullet\partial_{1,1}(-(b\bullet a))\bullet m_{2}\bullet\partial_{0,1}(b\bullet a)=-m_{0}\bullet-\partial_{1,1}(a)\bullet-\partial_{1,1}(b)\bullet m_{2}\bullet\partial_{0,1}(b)\bullet\partial_{0,1}(a)=$ $-m_{0}\bullet-\partial_{1,1}(a)\bullet m_{1}\bullet(db+[\partial_{0,1}l_{0},b])\bullet\partial_{0,1}(a),$ by Remark 2.2, it is an element of the irrelevant stabilizer of $\partial_{0,1}l_{0}$, therefore $\sim$ is transitive. ###### Definition 2.4. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA, the functor $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta}):\mathbf{Art}_{\mathbb{K}}\to\mathbf{Set}$ is defined, for all $A\in\mathbf{Art}_{\mathbb{K}}$, by $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)=\frac{Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)}{\sim}.$ ###### Remark 2.5. Note that, if $\mathfrak{g}^{\Delta}$ is a semicosimplicial Lie algebra, i.e., if all the DGLAs ${\mathfrak{g}}_{i}$ are concentrated in degree zero, then the functor $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ reduces to the one defined in [7]. ###### Lemma 2.6. The projection $\pi:Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})\longrightarrow H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ is a smooth morphism of functors. ###### Proof. Let $\beta:B\longrightarrow A$ be a surjection in $\mathbf{Art}_{\mathbb{K}}$, we prove that the map $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)\longrightarrow H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)\times_{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)}Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A),$ induced by $\textstyle{Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\beta}$$\scriptstyle{\pi}$$\textstyle{Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi}$$\textstyle{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\beta}$$\textstyle{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A),}$ is surjective. Let $([(l,m)],(l_{0},m_{0}))\in H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)\times_{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)}Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$, then $(\beta l,\beta m)$ and $(l_{0},m_{0})$ are gauge equivalent in $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$, i.e., there exist $a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ such that $e^{a}*\beta l=l_{0}$ and $-\beta m\bullet-\partial_{1,1}a\bullet m_{0}\bullet\partial_{0,1}a=db+[\partial_{0,1}\beta l,b]$, for some $b\in{\mathfrak{g}}_{1}^{-1}\otimes\mathfrak{m}_{A}$. Let $\tilde{a}\in\mathfrak{g}^{0}_{0}\otimes m_{B}$ and $\tilde{b}\in{\mathfrak{g}}_{1}^{-1}\otimes\mathfrak{m}_{B}$ be liftings of $a$ and $b$, respectively. The element $(e^{\tilde{a}}*l,\partial_{1,1}\tilde{a}\bullet m\bullet(d\tilde{b}+[\partial_{0,1}l,\tilde{b}])\bullet-\partial_{0,1}\tilde{a})\in Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(B)$ is a pre-image of $([(l,m)],(l_{0},m_{0}))$. ∎ Next, let $\mathcal{L}$ be a sheaf of DGLAs on a topological space $X$ and $\mathcal{U}=\\{U_{i}\\}_{i\in I}$ an open cover. Considering the Čech cosimplicial DGLA ${\mathcal{L}}({\mathcal{U}})$, we can define the functor $H^{1}_{\rm sc}(\exp{\mathcal{L}}(\mathcal{U}))$. This functor depends on the cover $\mathcal{U}$, but as shown in the following Lemma, the limit over open covers is a well defined functor: $H_{\rm Ho}^{1}(X;\exp\mathcal{L})=\lim_{\begin{subarray}{c}\longrightarrow\\\ \mathcal{U}\end{subarray}}H^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U})):\mathbf{Art}\to\mathbf{Set}.$ ###### Lemma 2.7. Let $\mathcal{U}=\\{U_{\alpha}\\}_{\alpha\in I}$ and $\mathcal{U}^{\prime}=\\{U^{\prime}_{\alpha}\\}_{\alpha\in I^{\prime}}$ be open covers of $X$ with $\mathcal{U}^{\prime}$ refinement of $\mathcal{U}$ and let $\phi,\psi:I^{\prime}\to I$ two refinement maps. Then, the induced morphisms $\rho_{\phi},\rho_{\psi}:H^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}))\to H^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}^{\prime}))$ coincide. ###### Proof. Both $\phi$ and $\psi$ induce, for all $A\in\mathbf{Art}_{\mathbb{K}}$, a morphism $Z^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}))(A)\to Z^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}^{\prime}))(A)$, defined sending $(l_{i},m_{ij})$ to $\rho_{\phi}(l_{i},m_{ij})=({l_{\phi\alpha}}|_{U^{\prime}_{\alpha}},{m_{\phi\alpha,\phi\beta}}|_{U^{\prime}_{\alpha\beta}})$ and $\rho_{\psi}(l_{i},m_{ij})=({l_{\psi\alpha}}|_{U^{\prime}_{\alpha}},{m_{\psi\alpha,\psi\beta}}|_{U^{\prime}_{\alpha\beta}})$, respectively. Therefore, it remains to prove that $\rho_{\phi}(l_{i},m_{ij})\sim\rho_{\psi}(l_{i},m_{ij})$, for all $(l_{i},m_{ij})\in Z^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}))(A)$, i.e., for all $\alpha\in I^{\prime}$, there exists $a_{\alpha}\in\mathcal{L}^{0}(U^{\prime}_{\alpha})\otimes m_{A}$ such that $\begin{cases}e^{a_{\alpha}}*{l_{\phi\alpha}}|_{U^{\prime}_{\alpha}}={l_{\psi\alpha}}|_{U^{\prime}_{\alpha}}\\\ -{m_{\phi\alpha,\phi\beta}}|_{U^{\prime}_{\alpha\beta}}\bullet-{a_{\alpha}}|_{U^{\prime}_{\alpha\beta}}\bullet{m_{\psi\alpha,\psi\beta}}|_{U^{\prime}_{\alpha\beta}}\bullet{a_{\beta}}|_{U^{\prime}_{\alpha\beta}}\in{\rm Stab}(l_{\phi\beta}|_{U^{\prime}_{\alpha\beta}}).\end{cases}$ A simple computation shows that it is enough to choose ${a_{\alpha}}:={m_{\psi\alpha,\phi\alpha}}|_{U^{\prime}_{\alpha}}$, for all $\alpha$ in $I^{\prime}$. ∎ ###### Remark 2.8. Having introduced the limit $H^{1}_{\rm Ho}(\exp\mathcal{L})$, for a sheaf of DGLAs $\mathcal{L}$ on a topological space $X$, the results of Section 1 can be restated as follows: the functor of infinitesimal deformations of a coherent sheaf ${\mathcal{F}}$ on a projective manifold $X$ is $\operatorname{Def}_{\mathcal{F}}\cong H^{1}_{\rm Ho}(X;\exp{\mathcal{E}}nd^{*}(\mathcal{E}^{\cdot})),$ where $\mathcal{E}^{\cdot}$ is a locally free resolution of ${\mathcal{F}}$. The example of coherent sheaves on projective manifolds together with the DGLA approach to deformation theory suggests that the functors of Artin rings $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ could actually be isomorphic to functors $\operatorname{Def}_{L(\mathfrak{g}^{\Delta})}$ for some DGLA $L(\mathfrak{g}^{\Delta})$ canonically associated with $\mathfrak{g}^{\Delta}$. We are going to show that, under the cohomological hypothesis $H^{-1}(\mathfrak{g}_{2})=0$, it is indeed so. More precisely, we are going to prove that, if $H^{-1}(\mathfrak{g}_{2})=0$, then the functor of Artin rings $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ is isomorphic to the deformation functor associated with the Thom-Whitney DGLA of the truncation ${\mathfrak{g}}^{\Delta_{[0,2]}}$. ## 3\. The Thom-Whitney DGLA $\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$ Let ${\mathfrak{g}}^{\Delta}$ be a semicosimplicial DGLA. The maps $\partial_{i}=\partial_{0,i}-\partial_{1,i}+\cdots+(-1)^{i}\partial_{i,i}$ endow the vector space $\bigoplus_{i}{\mathfrak{g}}_{i}$ with the structure of a differential complex. Moreover, being a DGLA, each ${\mathfrak{g}}_{i}$ is in particular a differential complex ${\mathfrak{g}}_{i}=\bigoplus_{j}{\mathfrak{g}}_{i}^{j};\qquad d_{i}\colon{\mathfrak{g}}_{i}^{j}\to{\mathfrak{g}}_{i}^{j+1}$ and since the maps $\partial_{k,i}$ are morphisms of DGLAs, the space ${\mathfrak{g}}^{\bullet}_{\bullet}=\bigoplus_{i,j}{\mathfrak{g}}_{i}^{j}$ has a natural bicomplex structure. The associated total complex $({\rm Tot}({\mathfrak{g}}^{\Delta}),d_{\operatorname{Tot}})\quad\text{where}\quad{\rm Tot}({\mathfrak{g}}^{\Delta})=\bigoplus_{i}{\mathfrak{g}}_{i}[-i],\quad d_{\operatorname{Tot}}=\sum_{i,j}\partial_{i}+(-1)^{j}d_{j}$ has no natural DGLA structure. Yet there is an other bicomplex naturally associated with a semicosimplicial DGLA, whose total complex is naturally a DGLA. For every $n\geq 0$, denote by $\Omega_{n}$ the differential graded commutative algebra of polynomial differential forms on the standard $n$-simplex $\Delta^{n}$: $\Omega_{n}=\frac{{\mathbb{K}}[t_{0},\ldots,t_{n},dt_{0},\ldots,dt_{n}]}{(\sum t_{i}-1,\sum dt_{i})}.$ Denote by $\delta^{k,n}\colon\Omega_{n}\to\Omega_{n-1}$, $k=0,\ldots,n$, the face maps; then, one has natural morphisms of bigraded DGLAs $\delta^{k,n}\colon\Omega_{n}\otimes\mathfrak{g}_{n}\to\Omega_{n-1}\otimes\mathfrak{g}_{n},\qquad\partial_{k,n}\colon\Omega_{n-1}\otimes\mathfrak{g}_{n-1}\to\Omega_{n-1}\otimes\mathfrak{g}_{n},$ for every $0\leq k\leq n$. The Thom-Whitney bicomplex is defined as $C^{i,j}_{TW}(\mathfrak{g}^{\Delta})=\\{(x_{n})_{n\in{\mathbb{N}}}\in\bigoplus_{n}\Omega_{n}^{i}\otimes{\mathfrak{g}}_{n}^{j}\mid\delta^{k,n}x_{n}=\partial_{k,n}x_{n-1}\quad\forall\;0\leq k\leq n\\},$ where $\Omega_{n}^{i}$ denotes the degree $i$ component of $\Omega_{n}$. Its total complex is a DGLA, called the _Thom-Whitney DGLA_ , and it is denoted by $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta})$; denote by $d_{TW}$ the differential of the Thom-Whitney DGLA. It is a remarkable fact that the integration maps $\int_{\Delta^{n}}\otimes\operatorname{Id}\colon\Omega_{n}\otimes\mathfrak{g}_{n}\to\mathbb{K}[n]\otimes\mathfrak{g}_{n}=\mathfrak{g}_{n}[n]$ give a quasi-isomorphism of differential complexes $I\colon(\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta}),d_{TW})\to(\operatorname{Tot}({\mathfrak{g}}^{\Delta}),d_{\rm Tot}).$ Moreover, Dupont has described in [3, 4] an explicit morphism of differential complexes $E\colon\operatorname{Tot}({\mathfrak{g}}^{\Delta})\to\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$ and an explicit homotopy $h\colon\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})\to\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})[-1]$ such that $IE={\rm Id}_{{\rm Tot}({\mathfrak{g}}^{\Delta})};\qquad EI-{\rm Id}_{{\rm Tot}_{TW}({\mathfrak{g}}^{\Delta})}=[h,d_{TW}].$ We also refer to the papers [2, 8, 19] for the explicit description of $E,h$ and for the proof of the above identities. Here, we point out that $E$ and $h$ are defined in terms of integration over standard simplexes and multiplication with canonical differential forms: in particular, the construction of $\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$, $\operatorname{Tot}({\mathfrak{g}}^{\Delta})$, $I$, $E$ and $h$ is functorial in the category $\mathbf{DGLA}^{\Delta_{\operatorname{mon}}}$ of semicosimplicial DGLAs. Recall that with a DGLA $L$ there is a canonically associated deformation functor $\operatorname{Def}_{L}$, defined as the solutions of Maurer-Cartan equation modulo gauge action (or, equivalently, modulo homotopy equivalence). Moreover, the tangent space to $\operatorname{Def}_{L}$ is $H^{1}(L)$ and obstructions live in $H^{2}(L)$. Thus, with a semicosimplicial DGLA $\mathfrak{g}^{\Delta}$ is also associated the deformation functor $\operatorname{Def}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta})}$; its tangent space is $T\operatorname{Def}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta})}\cong H^{1}({\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta}))\cong H^{1}({\operatorname{Tot}}(\mathfrak{g}^{\Delta}))$ and obstructions live in $H^{2}({\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta}))\cong H^{2}({\operatorname{Tot}}(\mathfrak{g}^{\Delta})).$ Let $\mathbf{\Delta}^{+}_{\operatorname{mon}}$ the category obtained by adding the empty set $\emptyset$ to the category $\mathbf{\Delta}_{\operatorname{mon}}$. An _augmented semicosimplicial differential graded Lie algebra_ is a covariant functor $\mathbf{\Delta}^{+}_{\operatorname{mon}}\to\mathbf{DGLA}$, from the category $\mathbf{\Delta}^{+}_{\operatorname{mon}}$ to the category of DGLAs. Equivalently, an augmented semicosimplicial DGLA ${\mathfrak{g}}^{\Delta^{+}}$ is a diagram $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 7.83333pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-7.83333pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{-1}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 31.83333pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 31.83333pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{0}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 69.63335pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 69.63335pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 69.63335pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{1}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 107.43336pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 107.43336pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 107.43336pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 107.43336pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{{\mathfrak{g}}_{2}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.23338pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.23338pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.23338pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.23338pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 145.23338pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\cdots}$}}}}}}}\ignorespaces}}}}\ignorespaces,$ where the truncated diagram ${\mathfrak{g}}^{\Delta}$ $\textstyle{{{\mathfrak{g}}_{0}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{{{\mathfrak{g}}_{1}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{{{\mathfrak{g}}_{2}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\cdots}$ is a semicosimplicial DGLA and $\partial_{0,0}\colon\mathfrak{g}_{-1}\to\mathfrak{g}_{0}$ is a DGLA morphism such that $\partial_{0,1}\partial_{0,0}=\partial_{1,1}\partial_{0,0}$. ###### Remark 3.1. There is a morphism of DGLAs $\displaystyle{\mathfrak{g}}_{-1}$ $\displaystyle\to\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$ $\displaystyle x$ $\displaystyle\mapsto(\partial_{0,0}x,\ \partial_{1,1}\partial_{0,0}x,\ \partial_{2,2}\partial_{1,1}\partial_{0,0}x,\dots);$ the image of $x$ is an element in $\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$ because of equations $\partial_{1,1}\partial_{0,0}=\partial_{0,1}\partial_{0,0}$ and $\partial_{k+1,i+1}\partial_{l,i}=\partial_{l,i+1}\partial_{k,i}$, for any $k\geq l$. This morphism is obtained as the composition of the natural inclusion ${\mathfrak{g}}_{-1}\hookrightarrow\operatorname{Tot}({\mathfrak{g}}^{\Delta})$ with the morphism $E:\operatorname{Tot}({\mathfrak{g}}^{\Delta})\to\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$. The existence of the DGLA morphism ${\mathfrak{g}}_{-1}\to\operatorname{Tot}_{TW}({\mathfrak{g}}^{\Delta})$ is not surprising; indeed, it is induced by the natural morphism $\lim{\mathfrak{g}}^{\Delta}\to\mathop{\rm holim}{\mathfrak{g}}^{\Delta}$. We use augmentation to link the Thom-Whitney DGLA of the Čech semicosimplicial DGLA of a sheaf of DGLAs with the DGLA of global sections of an acyclic resolution of the sheaf. This result is a translation of Theorem 7.2 in [7] in terms of the Thom-Whitney DGLA. We recall that if ${\mathcal{L}}$ is a sheaf of DGLAs on a topological space $X$ and ${\mathcal{U}}$ is an open cover of $X$, the associated Čech semicosimplicial differential graded Lie algebra is: $\mathcal{L}(\mathcal{U}):\quad\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 20.62444pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&\crcr}}}\ignorespaces{\hbox{\kern-20.62444pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i}\mathcal{L}(U_{i})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 44.62444pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 44.62444pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 44.62444pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j}\mathcal{L}(U_{ij})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 119.4822pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 119.4822pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{{\prod_{i<j<k}\mathcal{L}(U_{ijk})}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 204.87886pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 204.87886pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\cdots}$}}}}}}}\ignorespaces}}}}\ignorespaces.$ A morphism $\varphi\colon{\mathcal{L}}\to{\mathcal{A}}$ of sheaves of DGLAs is a quasi-isomorphism if it is a quasi-isomorphism of sheaves of differential complexes, i.e., if it induces linear isomorphisms between the cohomology sheaves, ${\mathcal{H}}^{*}(\varphi)\colon{\mathcal{H}}^{*}({\mathcal{L}})\xrightarrow{\sim}{\mathcal{H}}^{*}({\mathcal{A}}).$ Moreover, if ${\mathcal{A}}^{k}$ is an acyclic sheaf for any $k$, then $\varphi\colon{\mathcal{L}}\to{\mathcal{A}}$ is called an acyclic resolution of ${\mathcal{L}}$. ###### Theorem 3.2. Let $X$ be a paracompact Hausdorff topological space, $\mathcal{L}$ a sheaf of differential graded Lie algebras on $X$, and $\varphi\colon{\mathcal{L}}\to{\mathcal{A}}$ an acyclic resolution. Also let $A={\mathcal{A}}(X)$ be the DGLA of global sections of ${\mathcal{A}}$. Then, if $\mathcal{U}$ is an open cover of $X$ which is acyclic with respect to both ${\mathcal{L}}$ and ${\mathcal{A}}$, the DGLA ${\operatorname{Tot}_{TW}}({\mathcal{L}}(\mathcal{U}))$ is naturally quasi- isomorphic to the DGLA $A$. ###### Proof. The natural inclusion $A\to\mathcal{A}(\mathcal{U})$ gives an augmented semicosimplicial DGLA, and so it induces a morphism of DGLAs $A\to\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U}))$, that is the composition of the natural inclusion $A\to\operatorname{Tot}({\mathcal{A}}({\mathcal{U}}))$ with the quasi- isomorphism $E:\operatorname{Tot}({\mathcal{A}}({\mathcal{U}}))\to\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U}))$, by Remark 3.1. Since the sheaves ${\mathcal{A}}^{k}$ are acyclic and ${\mathcal{U}}$-acyclic, and $A^{k}=H^{0}(X;\mathcal{A}^{k})$, the inclusion $A\to\operatorname{Tot}(\mathcal{A}(\mathcal{U}))$ is a quasiisomorphism. Indeed, we have a natural identification $H^{*}({\operatorname{Tot}}(\mathcal{A}(\mathcal{U})))={\mathbb{H}}^{*}(X;{\mathcal{A}})$, and the spectral sequence abutting to the hypercohomology of $X$ with coefficients in ${\mathcal{A}}$ degenerates at $E_{2}$, giving ${\mathbb{H}}^{k}(X;{\mathcal{A}})=\bigoplus_{p+q=k}E_{2}^{p,q}=E_{2}^{k,0}=H^{k}(A).$ Then, $A\to\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U}))$ is a quasi- isomorphism of DGLAs. The morphism $\varphi\colon{\mathcal{L}}\to{\mathcal{A}}$ induces a morphism of semicosimplicial DGLAs $\varphi\colon\mathcal{L}(\mathcal{U})\to\mathcal{A}(\mathcal{U}),$ and a morphism of complexes $\varphi\colon\operatorname{Tot}_{TW}(\mathcal{L}(\mathcal{U}))\to\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U})).$ Since the open cover ${\mathcal{U}}$ is ${\mathcal{L}}$-acyclic, the cohomology of the total complex $\operatorname{Tot}(\mathcal{L}(\mathcal{U}))$ is naturally identified with the hypercohomology of $X$ with coefficients in ${\mathcal{L}}$, $H^{*}(\operatorname{Tot}(\mathcal{L}(\mathcal{U})))\cong{\mathbb{H}}^{*}(X;{\mathcal{L}}),$ and the induced linear map $H^{*}(\varphi)\colon H^{*}(\operatorname{Tot}(\mathcal{L}(\mathcal{U})))\to H^{*}(\operatorname{Tot}(\mathcal{A}(\mathcal{U})))$ is identified with the linear map ${\mathbb{H}}^{*}(\varphi)\colon{\mathbb{H}}^{*}(X;{\mathcal{L}})\rightarrow{\mathbb{H}}^{*}(X;{\mathcal{A}})$ induced in hypercohomology. Since, by hypothesis, $\varphi$ is a quasi- isomorphism of sheaves of DGLAs, the induced map in hypercohomology is an isomorphism, and so the morphism $\varphi\colon\operatorname{Tot}(\mathcal{L}(\mathcal{U}))\to\operatorname{Tot}(\mathcal{A}(\mathcal{U}))$ is a quasi-isomorphism of complexes. Via the composition with quasi-isomorphisms $E$ and $I$ between the total complex and the Thom-Whitney total complex of a semicosimplicial DGLA, the morphism $\varphi$ induces a quasi-isomorphism of DGLAs $\operatorname{Tot}_{TW}(\mathcal{L}(\mathcal{U}))\to\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U})).$ Therefore, we have the chain of quasi-isomorphisms of DGLAs $\operatorname{Tot}_{TW}(\mathcal{L}(\mathcal{U}))\xrightarrow{\sim}\operatorname{Tot}_{TW}(\mathcal{A}(\mathcal{U}))\xleftarrow{\sim}A.$ ∎ ## 4\. Truncations Let $\mathfrak{g}^{\Delta}:\ \ \lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 6.90001pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-6.90001pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathfrak{g}_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 30.90001pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 30.90001pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 30.90001pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathfrak{g}_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 68.70003pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 68.70003pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathfrak{g}_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise 6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise 2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise-2.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 106.50005pt\raise-6.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 106.50005pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathfrak{g}_{3}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 144.30006pt\raise 8.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 144.30006pt\raise 4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 144.30006pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 144.30006pt\raise-4.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 144.30006pt\raise-8.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 144.30006pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\ldots}$}}}}}}}\ignorespaces}}}}\ignorespaces$ be a semicosimplicial DGLA. Let $m_{1}\in\mathbb{N}$ and $m_{2}\in\mathbb{N}\cup\\{\infty\\}$ with $m_{1}\leq m_{2}$, we denote by $\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}}$ the _truncated between levels $m_{1}$ and $m_{2}$_ semicosimplicial DGLA defined by $(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})_{n}=\begin{cases}\mathfrak{g}_{n}&\text{for }m_{1}\leq n\leq m_{2}\\\ 0&\text{otherwise},\end{cases}$ with the obvious maps $\partial_{k,i}^{[m_{1},m_{2}]}=\partial_{k,i}$, for $m_{1}<i\leq m_{2}$, and $\partial_{k,i}^{[m_{1},m_{2}]}=0$, otherwise. For any positive integers $m_{1},m_{2},r_{1},r_{2}$, such that $r_{i}\leq m_{i}$, the map $\operatorname{Id}_{[m_{1},r_{2}]}\colon\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}}\to\mathfrak{g}^{\Delta_{[r_{1},r_{2}]}}$ given by $\operatorname{Id}_{[m_{1},r_{2}]}\biggr{|}_{(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})_{n}}=\begin{cases}\operatorname{Id}_{\mathfrak{g}_{n}}&\text{if }m_{1}\leq n\leq r_{2}\\\ 0&\text{otherwise}.\end{cases}$ is a morphism of semicosimplicial DGLAs; it induces the natural morphism of complexes $\phi:\operatorname{Tot}(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})\to\operatorname{Tot}(\mathfrak{g}^{\Delta_{[r_{1},r_{2}]}})$ and the natural morphism of DGLAs $\psi:\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})\to\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[r_{1},r_{2}]}})$. Note that we have an homotopy commutative diagram of complexes $\textstyle{\operatorname{Tot}(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{E}$$\scriptstyle{\phi}$$\textstyle{\operatorname{Tot}(\mathfrak{g}^{\Delta_{[r_{1},r_{2}]}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{E}$$\textstyle{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[m_{1},m_{2}]}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\psi}$$\scriptstyle{I}$$\textstyle{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[r_{1},r_{2}]}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces.}$$\scriptstyle{I}$ ###### Proposition 4.1. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA such that $H^{j}(\mathfrak{g}_{i})=0$, for all $i\geq 0$ and $j<0$. Then, the morphism $\operatorname{Id}_{[0,2]}$ induces a natural isomorphism of functors: $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta})}\xrightarrow{\sim}\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}.$ ###### Proof. It is a well known fact (see, e.g., [17] for a proof), that a DGLA morphism which is surjective on $H^{0}$, bijective on $H^{1}$ and injective on $H^{2}$ induces an isomorphism between the associated deformation functors. Since the above homotopy commutative diagram identifies $H^{*}(\psi)$ with $H^{*}(\phi)$, it is enough to prove that $H^{0}(\phi)$ is surjective, $H^{1}(\phi)$ is bijective and $H^{2}(\phi)$ is injective. This is easily checked by looking at the spectral sequences associated with double complexes of ${\mathfrak{g}}^{\Delta}$ and ${\mathfrak{g}}^{\Delta_{[0,2]}}$. ∎ ###### Remark 4.2. Observe that, for any semicosimplicial DGLA $\mathfrak{g}^{\Delta}$, we have $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})=Z_{\rm sc}^{1}(\exp\mathfrak{g}^{\Delta_{[0,2]}})$ and $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})=H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,2]}})$. Moreover, the inclusion $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})\hookrightarrow Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$ induces an injective map $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})\hookrightarrow H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$. ###### Remark 4.3. For later use, we point out that, if $\mathfrak{g}^{\Delta}$ is a semicosimplicial DGLA with $H^{-1}(\mathfrak{g}_{2})=0$, then $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}})}$ is trivial. Indeed, $H^{1}(\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}}))=H^{-1}(\mathfrak{g}_{2})=0$. ###### Remark 4.4. Note that, by the definition of $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ it follows that, if $H^{-1}(\mathfrak{g}_{2})=0$, then $TH^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})=H^{1}({\operatorname{Tot}}(\mathfrak{g}^{\Delta_{[0,2]}})).$ Hence, the two functors of Artin rings $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ and $\operatorname{Def}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}$ have naturally isomorphic tangent spaces when $H^{-1}(\mathfrak{g}_{2})=0$. We will show in Section 7 that in this case these two functors are actually isomorphic. ## 5\. A lemma on Maurer-Cartan elements We will now give an explicit description of the solutions of Maurer-Cartan equation for the DGLAs $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})$ and $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$. Our main tool will be the following general result [6, Proposition 7.2]: ###### Lemma 5.1. Let $(L,d,[~{},~{}])$ be a differential graded Lie algebra such that: 1. (1) $L=M\oplus C\oplus D$ as graded vector spaces. 2. (2) $M$ is a differential graded subalgebra of $L$. 3. (3) $d\colon C\to D[1]$ is an isomorphism of graded vector spaces. Then, for every $A\in\mathbf{Art}_{\mathbb{K}}$ there exists a bijection $\alpha\colon\operatorname{MC}_{M}(A)\times(C^{0}\otimes\mathfrak{m}_{A}){\stackrel{{\scriptstyle\sim}}{{\longrightarrow}}}\operatorname{MC}_{L}(A),\qquad(x,c)\mapsto e^{c}\ast x.$ As almost immediate corollaries we obtain: ###### Proposition 5.2. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. Then, for every $A\in\mathbf{Art}_{\mathbb{K}}$, the solutions of the Maurer-Cartan equation for the Thom-Whitney DGLA $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})\otimes\mathfrak{m}_{A}$ are of the form $(x,e^{p(t)}*\partial_{0,1}x)$, where $x\in\operatorname{MC}_{\mathfrak{g}_{0}}(A)$ and $p(t)\in(\mathfrak{g}_{1}^{0}[t]\cdot t)\otimes\mathfrak{m}_{A}$. The elements $x,p$ are uniquely determined, and they satisfy (2) $\partial_{1,1}x=e^{p(1)}*\partial_{0,1}x.$ ###### Proof. Notice that $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})$ is a sub- DGLA of $\mathfrak{g}_{0}\oplus\Omega_{1}\otimes\mathfrak{g}_{1}$. Then, Lemma 5.1 with the decomposition of $\Omega_{1}\otimes\mathfrak{g}_{1}$ given by $M=\mathfrak{g}_{1},\qquad C=\mathfrak{g}_{1}[t]\cdot t,\qquad D=dC$ tells us that every solution of the Maurer-Cartan equation for $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})\otimes\mathfrak{m}_{A}$ is of the form specified above. ∎ ###### Proposition 5.3. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. Then, for every $A\in\mathbf{Art}_{\mathbb{K}}$, the solutions of the Maurer-Cartan equation for the Thom-Whitney DGLA $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\otimes\mathfrak{m}_{A}$ are of the form $(x,e^{p(t)}*\partial_{0,1}x,e^{q(s_{0},s_{1})+r(s_{0},s_{1},ds_{0},ds_{1})}*\partial_{0,2}\partial_{0,1}x),$ where $x\in\operatorname{MC}_{\mathfrak{g}_{0}}(A)$, $p(t)\in(\mathfrak{g}_{1}^{0}[t]\cdot t)\otimes\mathfrak{m}_{A}$, $q(s_{0},s_{1})\in(\mathfrak{g}_{2}^{0}[s_{0},s_{1}]\cdot s_{0}+\mathfrak{g}_{2}^{0}[s_{0},s_{1}]\cdot s_{1})\otimes\mathfrak{m}_{A}$ and $r(s_{0},s_{1},ds_{0},ds_{1})\in(\mathfrak{g}_{2}^{-1}[s_{0},s_{1}]\cdot s_{0}ds_{1})\otimes\mathfrak{m}_{A}$. The elements $x,p,q,r$ are uniquely determined, and they satisfy (3) $\begin{cases}\partial_{1,1}x=e^{p(1)}*\partial_{0,1}x,\\\ \partial_{0,2}p(t)=q(0,t),\\\ \partial_{1,2}p(t)=q(t,0),\\\ e^{(-\partial_{2,2}p(t))\bullet(q(t,1-t)+r(t,1-t,dt))\bullet(-q(0,1))}*\partial_{2,2}\partial_{0,1}x=\partial_{2,2}\partial_{0,1}x.\end{cases}$ ###### Proof. Since $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$ is a sub-DGLA of $\mathfrak{g}_{0}\oplus\Omega_{1}\otimes\mathfrak{g}_{1}\oplus\Omega_{2}\otimes\mathfrak{g}_{2}$, applying Lemma 5.1 with the decomposition of $\Omega_{2}\otimes\mathfrak{g}_{2}$ given by $M=\mathfrak{g}_{2},\qquad C=\mathfrak{g}_{2}[s_{0},s_{1}]\cdot s_{0}+\mathfrak{g}_{2}[s_{0},s_{1}]\cdot s_{1}+\mathfrak{g}_{2}[s_{0},s_{1}]\cdot s_{0}ds_{1},\qquad D=dC$ we obtain that every solution of the Maurer-Cartan equation for $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\otimes\mathfrak{m}_{A}$ is of the form $(x,e^{p(t)}*y,e^{q(s_{0},s_{1})+r(s_{0},s_{1},ds_{0},ds_{1})}*z),$ with the face conditions $y=\partial_{0,1}x;\qquad z=\partial_{0,2}\partial_{0,1}x.$ The first relations in (3) are a direct consequence of face conditions and uniqueness. The last one is obtained as follows. The last face condition is $\partial_{2,2}(e^{p(t)}*\partial_{0,1}x)=e^{q(t,1-t)+r(t,1-t,dt)}*\partial_{0,2}\partial_{0,1}x;$ using the other face conditions and relations between maps $\partial_{k,i}$, we obtain that $\partial_{2,2}\partial_{0,1}x=\partial_{0,2}\partial_{1,1}x=\partial_{0,2}(e^{p(1)}*\partial_{0,1}x)=e^{q(0,1)}*\partial_{0,2}\partial_{0,1}x.$ Then, the above equation becomes $e^{\partial_{2,2}p(t)}*\partial_{2,2}\partial_{0,1}x=e^{(q(t,1-t)+r(t,1-t,dt))\bullet(-q(0,1))}*\partial_{2,2}\partial_{0,1}x.$ ∎ ## 6\. The isomorphism $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})\cong\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}$ ###### Proposition 6.1. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. The map $\Phi_{[0,1]}:\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)\to(\mathfrak{g}_{0}^{1}\oplus\mathfrak{g}_{1}^{0})\otimes\mathfrak{m}_{A},$ given by $(x,e^{p(t)}*\partial_{0,1}x)\mapsto(x,p(1)),$ induces a natural transformation of functors of Artin rings $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}}).$ ###### Proof. Clearly, if $(x,e^{p(t)}*\partial_{0,1}x)\in\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$, then $(x,p(1))\in Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$. We have to show that if two elements $\eta_{0}=(x_{0},e^{p_{0}(t)}*\partial_{0,1}x_{0})$ and $\eta_{1}=(x_{1},e^{p_{1}(t)}*\partial_{0,1}x_{1})$ in $\operatorname{MC}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$ are homotopy equivalent, then $\Phi_{[0,1]}(\eta_{0})\sim\Phi_{[0,1]}(\eta_{1})$ in $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$. Let $z(\xi,d\xi)$ be an homotopy between $\eta_{0}$ and $\eta_{1}$. Therefore, $z(\xi,d\xi)$ is a Maurer-Cartan element for ${\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})[\xi,d\xi]$ and so, reasoning as in the proof of Proposition 5.2, we find $z(\xi,d\xi)=(e^{T(\xi)}*u,e^{U(t,dt;\xi)}*v),$ with $T(0)=U(t,dt;0)=0$. Since $z(0)=\eta_{0}$, we get $z(\xi,d\xi)=(e^{T(\xi)}*x_{0},e^{U(t,dt;\xi)}*e^{p_{0}(t)}*\partial_{0,1}x_{0}).$ The face conditions for $z(\xi,d\xi)$ and uniqueness imply $U(0;\xi)=\partial_{0,1}T(\xi)\quad\mbox{ }\quad U(1;\xi)=\partial_{1,1}T(\xi).$ Moreover, $z(1)=\eta_{1}$, and so $(e^{T(1)}*x_{0},e^{U(t,dt;1)}*e^{p_{0}(t)}*\partial_{0,1}x_{0})=(x_{1},e^{p_{1}(t)}*\partial_{0,1}x_{1});$ by uniqueness again, we have $e^{T(1)}*x_{0}=x_{1}.$ Furthermore, $e^{U(t,dt;1)}*e^{p_{0}(t)}*\partial_{0,1}x_{0}=e^{p_{1}(t)}*\partial_{0,1}x_{1}$, so, using the face conditions for $\eta_{0}$ and $\eta_{1}$, we obtain $\partial_{0,1}x_{0}=e^{-p_{0}(t)\bullet-U(t,dt;1)\bullet p_{1}(t)\bullet\partial_{0,1}T(1)}*\partial_{0,1}x_{0}$ Next, we recall [11, Lemma 6.15] that if $L$ is a DGLA, $x(t,dt)$ is a Maurer- Cartan element for $L[t,dt]$ and $\mu(t,dt)\in L[t,dt]^{0}$ is such that $e^{\mu(t,dt)}*x(t,dt)=x(t,dt)$, then $\mu(1)$ is an element of the irrelevant stabilizer of $x(1)$. Therefore, in our case we get $-p_{0}(1)\bullet-\partial_{1,1}T(1)\bullet p_{1}(1)\bullet\partial_{0,1}T(1)\in{\rm Stab}(\partial_{0,1}x_{0}).$ ∎ ###### Proposition 6.2. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. The map $\Phi_{[0,1]}:\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$ is an isomorphism of functors of Artin rings. In particular, $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})$ is a deformation functor. ###### Proof. Let $\Psi_{[0,1]}:Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A)\to\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})\otimes{\mathfrak{m}}_{A}$ be the map given by $(l,m)\mapsto(l,e^{tm}*\partial_{0,1}l)$; it is immediate to check that $\Phi_{[0,1]}$ actually takes its values in $\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$. Moreover, $\Psi_{[0,1]}$ induces a map $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A)\to\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A),$ which is the inverse of $\Phi_{[0,1]}$. Indeed, if $(l_{0},m_{0})\sim(l_{1},m_{1})$ in $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A)$, then there exist elements $a\in\mathfrak{g}^{0}_{0}\otimes\mathfrak{m}_{A}$ and $b\in{\mathfrak{g}}_{1}^{-1}\otimes{\mathfrak{m}}_{A}$ such that $\begin{cases}e^{a}*l_{0}=l_{1}\\\ -m_{0}\bullet-\partial_{1,1}a\bullet m_{1}\bullet\partial_{0,1}a=db+[\partial_{0,1}l_{0},b].\end{cases}$ Therefore, the images $(l_{0},e^{tm_{0}}*\partial_{0,1}l_{0})$ and $(l_{1},e^{tm_{1}}*\partial_{0,1}l_{1})$ are homotopic via the element $z(\xi,d\xi)=(e^{\xi a}*l_{0},e^{t\bigl{(}\partial_{1,1}(\xi a)\bullet m_{0}\bullet(d(\xi b)+[\partial_{0,1}l_{0},\xi b])\bullet-\partial_{0,1}(\xi a)\bigr{)}\bullet\partial_{0,1}(\xi a)}*\partial_{0,1}l_{0}).$ The composition $\Phi_{[0,1]}\circ\Psi_{[0,1]}\colon Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A)\to Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A)$ is clearly the identity, whereas the composition $\Psi_{[0,1]}\circ\Phi_{[0,1]}:\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)\to\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$ is homotopic to the identity. Indeed, $(x,e^{p(t)}*\partial_{0,1}x)$ and $(x,e^{tp(1)}*\partial_{0,1}x)$ are homotopic in $\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$ via the element $z(\xi,d\xi)=(x,e^{\xi tp(1)+(1-\xi)p(t)}*\partial_{0,1}x)$. ∎ ###### Remark 6.3. A particular case of Proposition 6.2, with an almost identical proof, has been considered by one of the authors in [11]. Namely, given three DGLAs $L,M$ and $N$ and two DGLA morphisms $h\colon L\to M$ and $g\colon N\to M$, one can consider the semicosimplicial DGLA $\textstyle{L\oplus N\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{(0,g)}$$\scriptstyle{(h,0)}$$\textstyle{{M}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\cdots}$ to reobtain [11, Theorem 6.17]. ## 7\. Proof of the main theorem In this section, we prove the existence of a natural isomorphism of functors of Artin rings $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})\cong\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}$, for any semicosimplicial DGLA $\mathfrak{g}^{\Delta}$ such that $H^{-1}(\mathfrak{g}_{2})=0$. As an immediate consequence we obtain a natural isomorphism of deformation functors $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})\cong\operatorname{Def}_{{\operatorname{Tot}_{TW}}(\mathfrak{g}^{\Delta})}$, for any semicosimplicial DGLA $\mathfrak{g}^{\Delta}$, such that $H^{j}(\mathfrak{g}_{i})=0$ for $i\geq 0$ and $j<0$. The proof is considerably harder than in the case $\mathfrak{g}^{\Delta_{[0,1]}}$ considered in the previous section. Indeed, we are still able to define a map $\Phi\colon\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\to Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ inducing a natural transformation $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$, but we will not be able to explicitly define an homotopy inverse to $\Phi$, so we will have to directly check that the map $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ is an isomorphism. ###### Proposition 7.1. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA. The map $\Phi:\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\to(\mathfrak{g}_{0}^{1}\oplus\mathfrak{g}_{1}^{0})\otimes\mathfrak{m}_{A},$ given by $(x,e^{p(t)}*\partial_{0,1}x,e^{q(s_{0},s_{1})+r(s_{0},s_{1},ds_{1},ds_{1})}*\partial_{0,2}\partial_{0,1}x)\mapsto(x,p(1)),$ induces a natural transformation of functors of Artin rings $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta}).$ ###### Proof. First we check that $\Phi$ takes its values in $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$. The only nontrivial point consists in showing that $-\partial_{2,2}p(1)\bullet\partial_{1,2}p(1)\bullet-\partial_{0,2}p(1)$ is an element of the irrelevant stabilizer of $\partial_{2,2}\partial_{0,1}x$. This follows by the face condition $e^{(-\partial_{2,2}p(t))\bullet(q(t,1-t)+r(t,1-t,dt))\bullet(-q(0,1))}*\partial_{2,2}\partial_{0,1}x=\partial_{2,2}\partial_{0,1}x,$ applying [11, Lemma 6.15] once again. Next, we notice that the equivalence relation $\sim$ on $Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ only involves the DGLAs ${\mathfrak{g}}_{0}$ and ${\mathfrak{g}}_{1}$; hence, we can conclude verbatim following the proof of Proposition 6.1. ∎ ###### Proposition 7.2. The map $\Phi:\operatorname{Def}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ is surjective. ###### Proof. Let $(l,m)\in Z^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ and $n\in\mathfrak{g}_{2}^{-1}\otimes\mathfrak{m}_{A}$, such that $\partial_{0,2}m\bullet-\partial_{1,2}m\bullet\partial_{2,2}m=dn+\frac{1}{2}[\partial_{2,2}\partial_{0,1}l,n]$. Consider the element $w(t)=d(tn)+\frac{1}{2}[\partial_{2,2}\partial_{0,1}l,tn]$ in the irrelevant stabilizer of $\partial_{2,2}\partial_{0,1}l$ and $R(s_{0},s_{1})=s_{0}s_{1}\frac{s_{0}\partial_{2,2}m\bullet-w(s_{0})\bullet s_{0}\partial_{0,2}m\bullet-s_{0}\partial_{1,2}m}{s_{0}(1-s_{0})}\bullet s_{0}\partial_{1,2}m\bullet s_{1}\partial_{0,2}m.$ Then, $(l,e^{tm}*\partial_{0,1}l,e^{R(s_{0},s_{1})}*\partial_{0,2}\partial_{0,1}l)$ is an element in $\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)$ in the fiber of $\Phi$ over $(l,m)$. Indeed, clearly it satisfies the Maurer- Cartan equation in $\mathfrak{g}_{0}\oplus\mathfrak{g}_{1}\otimes\Omega_{1}\oplus\mathfrak{g}_{2}\otimes\Omega_{2}$; the first face conditions follow easly noticing that $R(0,t)=t\partial_{0,2}m$ and $R(t,0)=t\partial_{1,2}m$; for the last one, we have: $e^{R(t,1-t)}*\partial_{0,2}\partial_{0,1}l=e^{t\partial_{2,2}m\bullet-w(t)\bullet\partial_{0,2}m}*\partial_{0,2}\partial_{0,1}l=$ $=e^{t\partial_{2,2}m\bullet-w(t)}*\partial_{0,2}\partial_{1,1}l=e^{t\partial_{2,2}m\bullet-w(t)}*\partial_{2,2}\partial_{0,1}l=e^{t\partial_{2,2}m}*\partial_{2,2}\partial_{0,1}l.$ ∎ We will prove that the map $\Phi:\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ is injective, under the hypothesis $H^{-1}(\mathfrak{g}_{2})=0$. For this we need two remarks. ###### Remark 7.3. Let $(L,d,[\ ,\ ])$ be a DGLA, $A\in\bf{Art}_{\mathbb{K}}$ and $x\in L^{1}\otimes\mathfrak{m}_{A}$. The linear endomorphism $d_{x}=d+[x,\ ]$ of $L\otimes\mathfrak{m}_{A}$ is a differential if and only if $x\in\operatorname{MC}_{L}(A)$, and in this case $(L\otimes\mathfrak{m}_{A},d_{x},[\ ,\ ])$ is a DGLA. So, we can define the set of the Maurer-Cartan elements $\operatorname{MC}_{L}^{x}(A)$ and the gauge action of $(L^{0}\otimes{\mathfrak{m}}_{A},d_{x},[\ ,\ ])$ on it. We denote by $\operatorname{Def}_{L}^{x}(A)$ the quotient of $\operatorname{MC}_{L}^{x}(A)$ with respect to the gauge action. The affine map $\begin{array}[]{rll}L\otimes\mathfrak{m}_{A}&\to&L\otimes\mathfrak{m}_{A}\\\ v&\mapsto&v-x.\end{array}$ induces an isomorphism $\operatorname{Def}_{L}(A)\cong\operatorname{Def}_{L}^{x}(A)$ with obvious inverse $v\mapsto v+x$. Next, let $M\subseteq L$ be a sub-DGLA and let $x\in\operatorname{MC}_{L}(A)$. If $M\otimes\mathfrak{m}_{A}$ is closed under the differential $d_{x}$, then we can consider the set of Maurer-Cartan elements $\operatorname{MC}_{M}^{x}(A)$, and its quotient $\operatorname{Def}_{M}^{x}(A)$. The tangent space to $\operatorname{Def}_{M}^{x}(A)$ is $H^{1}(M\otimes{\mathfrak{m}}_{A},d_{x})$; so, by upper semicontinuity of cohomology, $H^{1}(M,d)=0$ implies that $\operatorname{Def}^{x}_{M}(A)$ is trivial, for all $x\in\operatorname{MC}_{L}(A)$ such that $d_{x}(M\otimes\mathfrak{m}_{A})\subseteq M\otimes\mathfrak{m}_{A}$. ###### Remark 7.4. For any semicosimplicial DGLA $\mathfrak{g}^{\Delta}$, the truncation morphism $\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\to\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})$ is surjective, i.e., for any $(a_{0},a_{1})\in\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})$ there exist $a_{2}\in(\mathfrak{g}_{2}\otimes\Omega_{2})^{0}$ such that $(a_{0},a_{1},a_{2})\in\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$. To see this, write $a_{1}(t,dt)=a_{1}^{0}(t)+a_{1}^{-1}(t)dt$; then a possible choice for $a_{2}$ is $a_{2}(s_{0},s_{1},ds_{0},ds_{1})=a^{0}_{2}(s_{0},s_{1})+a^{-1}_{2,0}(s_{0},s_{1})ds_{0}+a^{-1}_{2,1}(s_{0},s_{1})ds_{1}+a^{-2}_{2}(s_{0},s_{1})ds_{0}ds_{1},$ with $\displaystyle a^{0}_{2}(s_{0},s_{1})$ $\displaystyle=\partial_{1,2}a^{0}_{1}(s_{0})+\partial_{0,2}a^{0}_{1}(s_{1})-\partial_{1,2}a^{0}_{1}(0)$ $\displaystyle\qquad\qquad+s_{1}\frac{\partial_{2,2}a^{0}_{1}(s_{0})-\partial_{1,2}a^{0}_{1}(s_{0})-\partial_{0,2}a^{0}_{1}(1-s_{0})+\partial_{0,2}a^{0}_{1}(0)}{1-s_{0}};$ $\displaystyle a^{-1}_{2,0}(s_{0},s_{1})$ $\displaystyle=\partial_{1,2}a_{1}^{-1}(s_{0})+\frac{s_{1}}{1-s_{0}}\biggl{(}\partial_{2,2}a_{1}^{-1}(s_{0})-\partial_{1,2}a_{1}^{-1}(s_{0})$ $\displaystyle\qquad\qquad\qquad\qquad\qquad\qquad+\partial_{0,2}a_{1}^{-1}(1-s_{0})-s_{0}\partial_{0,2}a_{1}^{-1}(0)\biggr{)};$ $\displaystyle a^{-1}_{2,1}(s_{0},s_{1})$ $\displaystyle=\partial_{0,2}a_{1}^{-1}(s_{1})ds_{1}-s_{0}\partial_{0,2}a_{1}^{-1}(0);$ $\displaystyle a^{-2}_{2}(s_{0},s_{1})$ $\displaystyle=0.$ It is an easy computation to verify that the element $(a_{0},a_{1},a_{2})$ actually satisfies the face conditions. ###### Proposition 7.5. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA, such that $H^{-1}(\mathfrak{g}_{2})=0$. The map $\Phi:\operatorname{Def}_{{\operatorname{Tot}}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\to H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)$ is injective. ###### Proof. Consider the commutative diagram $\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\operatorname{Id}_{[0,1]}}$$\scriptstyle{\Phi}$$\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\cong}$$\scriptstyle{\Phi_{[0,1]}}$$\textstyle{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})(A)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{i}$$\textstyle{H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta_{[0,1]}})(A);}$ since the map $\Phi_{[0,1]}$ is an isomorphism by Proposition 6.2, it is sufficient to prove that $\operatorname{Id}_{[0,1]}$ is injective. Let $(x_{0},x_{1},x_{2})$ and $(x^{\prime}_{0},x^{\prime}_{1},x^{\prime}_{2})$ be two Maurer-Cartan elements for $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$, such that $(x_{0},x_{1})$ and $(x^{\prime}_{0},x^{\prime}_{1})$ are gauge equivalent elements in $\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})}(A)$. Let $(a_{0},a_{1})\in\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,1]}})\otimes\mathfrak{m}_{A}$ be an element realizing the gauge equivalence between $(x^{\prime}_{0},x^{\prime}_{1})$ and $(x_{0},x_{1})$, and let $(a_{0},a_{1},a_{2})$ be a lift of $(a_{0},a_{1})$ in $\operatorname{Tot}^{0}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\otimes\mathfrak{m}_{A}$ (see Remark 7.4). Then $(x^{\prime}_{0},x^{\prime}_{1},x^{\prime}_{2})$ is gauge equivalent via $(a_{0},a_{1},a_{2})$ to the Maurer-Cartan element $(x_{0},x_{1},e^{a_{2}}*x^{\prime}_{2})$ and we are left to prove that $(x_{0},x_{1},e^{a_{2}}*x^{\prime}_{2})$ is gauge equivalent to $(x_{0},x_{1},x_{2})$. To see this, consider the DGLA $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\otimes\mathfrak{m}_{A}$ and modify its differential with the Maurer-Cartan element $(x_{0},x_{1},x_{2})$, as in Remark 7.3. Translation by $(x_{0},x_{1},x_{2})$ gives an isomorphism $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)\cong\operatorname{Def}^{(x_{0},x_{1},x_{2})}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A);$ hence $(x_{0},x_{1},x_{2})$ and $(x_{0},x_{1},e^{a_{2}}*x^{\prime}_{2})$ will be gauge equivalent in $\operatorname{MC}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)$ if and only if $(0,0,0)$ and $(0,0,e^{a_{2}}*x^{\prime}_{2}-x_{2})$ are gauge- equivalent in $\operatorname{MC}^{(x_{0},x_{1},x_{2})}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)$. Next, observe that the sub-DGLA $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}})\otimes\mathfrak{m}_{A}$ of $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})\otimes\mathfrak{m}_{A}$ is closed under the modified differential $d_{(x_{0},x_{1},x_{2})}$, so we can consider the deformation functor $\operatorname{Def}^{(x_{0},x_{1},x_{2})}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}})}(A)$. Since $H^{1}(\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}}),d_{TW})=H^{1}(\operatorname{Tot}(\mathfrak{g}^{\Delta_{[2,2]}}),d_{\rm Tot})=H^{-1}(\mathfrak{g}_{2})=0$, this deformation functor is trivial (see Remark 7.3). Therefore $(0,0,e^{a_{2}}*x^{\prime}_{2}-x_{2})$ is gauge equivalent to $(0,0,0)$ as an element of $\operatorname{MC}^{(x_{0},x_{1},x_{2})}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[2,2]}})}(A)$, and so, a fortiori, as an element of $\operatorname{MC}^{(x_{0},x_{1},x_{2})}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}(A)$. ∎ Summing up, and recalling Proposition 4.1, we have proved: ###### Theorem 7.6. Let $\mathfrak{g}^{\Delta}$ be a semicosimplicial DGLA, and let $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta})$ and $\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})$ be the Thom-Whitney DGLAs associated with $\mathfrak{g}^{\Delta}$ and $\mathfrak{g}^{\Delta_{[0,2]}}$, respectively. Assume that $H^{-1}(\mathfrak{g}_{2})=0$; then, there is a natural isomorphism of funtors $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta_{[0,2]}})}\cong H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$. If moreover $H^{j}(\mathfrak{g}_{i})=0$ for all $i\geq 0$ and $j<0$, then there is a natural isomorphism of funtors $\operatorname{Def}_{\operatorname{Tot}_{TW}(\mathfrak{g}^{\Delta})}\cong H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$. In particular, in this case, the tangent space to $H^{1}_{\rm sc}(\exp\mathfrak{g}^{\Delta})$ is $H^{1}({\rm Tot}(\mathfrak{g}^{\Delta}))$ and obstructions are contained in $H^{2}({\rm Tot}(\mathfrak{g}^{\Delta}))$. ###### Theorem 7.7. Let $X$ be a paracompact Hausdorff topological space, and let $\mathcal{L}$ be a sheaf of differential graded Lie algebras on $X$, such that the DGLAs $\mathcal{L}(U_{i_{0}\ldots i_{k}})$ has no negative cohomology. Then, every refinement ${\mathcal{V}}\geq{\mathcal{U}}$ of open covers of $X$ induces a natural morphism of deformation functors $\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}\to\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{V}}))}$. In particular, the direct limit $\operatorname{Def}_{[{\mathcal{L}}]}=\lim_{\stackrel{{\scriptstyle\longrightarrow}}{{\mathcal{U}}}}\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}$ is well defined and there is natural isomorphism of functors of Artin rings $H_{\rm Ho}^{1}(X;\exp{\mathcal{L}})\cong\operatorname{Def}_{[{\mathcal{L}}]}.$ Moreover, if acyclic open covers for $\mathcal{L}$ are cofinal in the directed family of all open covers of $X$, then $H_{\rm Ho}^{1}(X;\exp\mathcal{L})\cong H_{\rm sc}^{1}(\exp\mathcal{L}(\mathcal{U}))\qquad\text{and}\qquad\operatorname{Def}_{[{\mathcal{L}}]}\cong\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))},$ for every ${\mathcal{L}}$-acyclic open cover ${\mathcal{U}}$ of $X$. ###### Proof. Let ${\mathcal{V}}\geq{\mathcal{U}}$ be a refinement of open covers of $X$, and let $\tau$ be a refinement function, it induces a natural morphism of semicosimplicial Lie algebras ${\mathcal{L}}({\mathcal{U}})\to{\mathcal{L}}({\mathcal{V}})$ and so a commutative diagram of natural transformations $\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sim}$$\textstyle{H^{1}_{\rm sc}(\exp{\mathcal{L}}({\mathcal{U}}))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{V}}))}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sim}$$\textstyle{H^{1}_{\rm sc}(\exp{\mathcal{L}}({\mathcal{V}})).}$ Horizontal arrows are isomorphisms by Theorem 7.6, and the right vertical arrow is independent of the refinement function $\tau$, as observed in Lemma 2.7. Hence, also the left morphism is independent of $\tau$, then the direct limit $\operatorname{Def}_{[{\mathcal{L}}]}=\lim_{\stackrel{{\scriptstyle\longrightarrow}}{{\mathcal{U}}}}\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}$ is well defined and we have a natural isomorphism $\operatorname{Def}_{[{\mathcal{L}}]}\cong H_{\rm Ho}^{1}(X;\exp{\mathcal{L}})$. Assume now that acyclic open covers for ${\mathcal{L}}$ are cofinal in the family of all open covers of $X$. Then, for any refinement ${\mathcal{V}}\geq{\mathcal{U}}$ of acyclic open covers, the DGLAs-morphism $\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))\to\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{V}}))$ is a quasi-isomorphism by Leray’s theorem. Therefore, we have a commutative diagram of natural transformations $\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\wr}$$\scriptstyle{\sim}$$\textstyle{H^{1}_{\rm sc}(\exp{\mathcal{L}}({\mathcal{U}}))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{V}}))}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sim}$$\textstyle{H^{1}_{\rm sc}(\exp{\mathcal{L}}({\mathcal{V}})),}$ where also the right vertical arrow is forced to be an isomorphism. Taking the direct limit over ${\mathcal{L}}$-acyclic covers, we obtain that, if ${\mathcal{U}}$ is an ${\mathcal{L}}$-acyclic open cover of $X$, then $H_{\rm Ho}^{1}(X;\exp\mathcal{L})\cong H^{1}_{\rm sc}(\exp\mathcal{L}(\mathcal{U}))$ and $\operatorname{Def}_{[{\mathcal{L}}]}\cong\operatorname{Def}_{\operatorname{Tot}_{TW}({\mathcal{L}}({\mathcal{U}}))}$. ∎ ## 8\. Conclusions and further developements We can now sum up our results to obtain a DGLA description of infinitesimal deformations of a coherent sheaf. In Section 1, we analised infinitesimal deformations of a coherent sheaf $\mathcal{F}$ of $\mathcal{O}_{X}$-modules on a ringed space $(X,\mathcal{O}_{X})$. If $\mathcal{E}^{\cdot}\to\mathcal{F}\to 0$ is a locally free resolution of $\mathcal{F}$ on $X$, we showed how infinitesimal deformations of ${\mathcal{F}}$ can be expressed in terms of the sheaf of DGLAs $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})$. More precisely, in Section 2, we showed that the functor of infinitesimal deformations of ${\mathcal{F}}$ is isomorphic to $H^{1}_{\rm Ho}(X;\exp{\mathcal{E}nd}^{*}(\mathcal{E}^{\cdot}))$. Since negative Ext-groups between coherent sheaves are always trivial, all terms in the semicosimplicial DGLA $\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})(\mathcal{U})$ have zero negative cohomology. Therefore, Theorem 7.6 applies and we obtain that the functor of infinitesimal deformations of ${\mathcal{F}}$ is isomorphic to $\operatorname{Def}_{[\mathcal{E}nd^{*}(\mathcal{E}^{\cdot})]}$; in particular, we recover the well known fact that the tangent space to $\operatorname{Def}_{\mathcal{F}}$ is $\operatorname{Ext}^{1}({\mathcal{F}},{\mathcal{F}})$ and that its obstructions are contained in $\operatorname{Ext}^{2}({\mathcal{F}},{\mathcal{F}})$. Moreover, if $X$ is a smooth complex variety, then the DGLA controlling infinitesimal deformations of $\mathcal{F}$ turns out to be not at all mysterious. Indeed, let ${\mathcal{E}nd}^{*}(\mathcal{E}^{\cdot})\to\mathcal{A}^{0,*}_{X}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$ be the Dolbeault resolution of ${\mathcal{E}nd}^{*}(\mathcal{E}^{\cdot})$. Since this resolution is fine, by Theorem 3.2 the functor of infinitesimal deformations of ${\mathcal{F}}$ is isomorphic to the deformation functor associated with the DGLA $A^{0,*}_{X}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$ of global sections of $\mathcal{A}^{0,*}_{X}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$. We can also give an explicit description of this isomorphism of deformation functors. Indeed, a natural isomorphism $\operatorname{Def}_{A^{0,*}_{X}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))}(B)\to\operatorname{Def}_{\mathcal{F}}(B),\qquad\mbox{for}\ B\in\bf{Art}_{\mathbb{K}}$ is defined by associating with every Maurer-Cartan element $\xi$ of the DGLA $A^{0,*}_{X}(\mathcal{E}nd^{*}(\mathcal{E}^{\cdot}))$ the cohomology sheaf of $({\mathcal{A}}_{X}^{0,*}(\mathcal{E}^{\cdot})\otimes B,\overline{\partial}+d_{\mathcal{E}^{\cdot}}+\xi)$. Note that, by semicontinuity, this cohomology sheaf is concentrated in degree zero. The techniques developed in this paper apply to a wide range of other geometric examples. More explicitly, we can use them in all cases when local deformations admit a simple DGLA description in terms of a resolution of the object to be deformed, for instance, in the case of infinitesimal deformations of a singular variety. Namely, let $X$ be a singular variety, ${\mathcal{O}}_{X}$ the sheaf of regular function of $X$ and ${\mathcal{R}}^{\cdot}\to{\mathcal{O}}_{X}$ its standard free resolution [12, Section 1.5]. Then, the deformation functor of infinitesimal deformations of $X$ is isomorphic to $H_{\rm Ho}^{1}(X;\exp{{\mathcal{D}}er}^{*}({\mathcal{R}}^{\cdot}))$; see [5] for details. From this, we also recover the classical result that the tangent space to deformations of $X$ is $\operatorname{Ext}^{1}({\mathbb{L}}_{X},{\mathcal{O}}_{X})$, and that obstructions are contained in $\operatorname{Ext}^{2}({\mathbb{L}}_{X},{\mathcal{O}}_{X})$, where ${\mathbb{L}}_{X}$ is the cotangent complex of $X$. ## References * [1] M. Artin: _Deformation of singularities._ Tata institute of foundamental research, Bombay, (1976). * [2] X. Z. Cheng, E. Getzler: _Homotopy commutative algebraic structures._ J. Pure Appl. Algebra, 212, (2008), 2535-2542. * [3] J. L. Dupont: _Simplicial de Rham cohomology and characteristic classes of flat bundles._ Topology, 15, (1976), 233-245. * [4] J. L. Dupont: _Curvature and characteristic classes._ Lecture Notes in Mathematics, 640, Springer-Verlag, (1978). * [5] D. Fiorenza, D. Iacono, E. Martinengo: _Infinitesimal deformations of singular varieties._ (in prepapartion). * [6] D. Fiorenza, M. Manetti: _$L_{\infty}$ -structures on mapping cones._ Algebra & Number Theory, 1, (2007), 301-330. * [7] D. Fiorenza, M. Manetti, E. Martinengo: _Semicosimplicial DGLAs in deformation theory_. arxiv:math.AG/08030399. * [8] E. Getzler: _Lie theory for nilpotent $L_{\infty}$-algebras._ Ann. of Math., 170, (1), (2009), 271-301. * [9] V. Hinich: _Descent of Deligne groupoids._ Int. Math. Res. Notices, (1997), 5, 223-239. * [10] A. Hirschowitz, C. Simpson: _Descent pour les n-champs._ arXiv:9807049v3. * [11] D. Iacono: _$L_{\infty}$ -algebras and deformations of holomorphic maps._ Int. Math. Res. Notices, (2008), 8, Art. ID rnn013, 36 pp. * [12] L. Illusie: _Complexe cotangent et deformations I, II._ Lecture Notes in Mathematics, 239, 283, Springer-Verlag, New York/Berlin, (1971-1972). * [13] K. Kodaira: _Complex Manifolds and Deformation of Complex Structures._ Die Grundlehren der mathematischen Wissenschaften in Einzeldarstellungen, 283, Springer-Verlag, New York/Berlin, (1986). * [14] K. Kodaira, D. C. Spencer: _On Deformations of Complex Analytic Structures, II._ Ann. of Math., 67 (2), (1958), 403-466. * [15] M. Kuranishi: _Deformations of compact complex manifolds._ Séminaire de Mathematiques Supérieures, No. 39, (Été 1969), Les Presses de l’Université de Montreal, Montreal, (1971). * [16] J. Lurie: _Higher topos theory._ Annals of Mathematics Studies, 170, Princeton University Press, Princeton, NJ, (2009). * [17] M. Manetti: _Deformation theory via differential graded Lie algebras._ Seminari di Geometria Algebrica 1998-1999, Scuola Normale Superiore (1999). * [18] M. Manetti: _Extended deformation functors._ Int. Math. Res. Not., 14, (2002), 719-756. * [19] V. Navarro Aznar: _Sur la théorie de Hodge-Deligne._ Invent. Math., 90, (1987),11-76. * [20] J. P. Pridham: _Deformations via Simplicial Deformation Complexes._ arXiv:math/0311168v6. * [21] D. Quillen: _Rational homotopy theory._ Ann. of Math., (2), 90, (1969), 205-295. * [22] P. Seidel, R. P. Thomas: _Braid group actions on derived categories of coherent sheaves._ Duke Math. J. 108 (2001), no. 1, 37-108. * [23] E. Sernesi: _Deformation of algebraic schemes._ Springer, 334, (2006). * [24] B. Toen: _Higher and derived stack: a global overview._ Proc. Sympos. Pure Math., 80, Part 1, Amer. Math. Soc., Providence, RI, (2009). * [25] A. Yekutieli: _Twisted deformation quatization of algebraic varieties._ arXiv:0905.0488v2
arxiv-papers
2009-04-08T10:11:51
2024-09-04T02:49:01.778954
{ "license": "Public Domain", "authors": "Domenico Fiorenza, Donatella Iacono, Elena Martinengo", "submitter": "Domenico Fiorenza", "url": "https://arxiv.org/abs/0904.1301" }
0904.1304
# Probing new physics in $B\to J/\Psi~{}\pi^{0}$ decay Jing-Wu Li1111Email:lijw@xznu.edu.cn, Dong-Sheng Du2222Email:duds@mail.ihep.ac.cn, Xiang-Yao Wu3333Email:wuxy2066@163.com 1Department of Physics, Xu Zhou Normal University, XuZhou 221116, China, 2Institute of High Energy Physics, P.O. Box 918(4), Beijing 100049, 3Institute of Physics, Jilin Normal University, Siping 136000, China ###### Abstract We calculate the branching ratio of $B\to J/\Psi~{}\pi^{0}$ with a mixed formalism that combines the QCD-improved factorization and the perturbative QCD approaches. The result is consistent with experimental data. The quite small penguin contribution in $B\to J/\Psi~{}\pi^{0}$ decay can be calculated with this method. We suggest two methods to extract the weak phase $\beta$. One is through the dependence of the mixing induced CP asymmetry $S_{J/\Psi\pi^{0}}$ on the weak phase$\beta$ , the other is from the relation of the total asymmetry $A_{CP}$ with the weak phase $\beta$. Our result shows that the deviation $\bigtriangleup S_{J/\psi\pi^{0}}$ of the mixing induced CP asymmetry from $Sin(-2\beta)$ is of $\mathcal{O}(10^{-3})$ and has much less uncertainty. The above $\mathcal{O}(10^{-3})$ deviation can provide a good reference for identifying new physics. ###### pacs: 13.25.Hw, 12.38.Bx B physics is entering the era of precision measurement, It is not far from revealing new physics beyond the Standard Model(SM). Many authors have studied the topics and suggest some windows for looking for new physics(NP)npa1 -npa9 . Because falvour-changing neutral current (FCNC) processes only occur at the loop-level in the SM , so they are particularly sensitive to NP interactions. It was pointed out that $B^{0}_{q}-\bar{B}^{0}_{q}$ mixing and decays are good places for new physics to enter through the exchange of new particles in the box diagrams, or through new contributions at the tree level bmixing1 -bmixing3 , so $B^{0}_{q}-\bar{B}^{0}_{q}$ system has been studied in many papers for probing new physicsbmixingatt1 ; bmixingatt5 . $B\to J/\Psi\pi^{0}$ decay is a good mode for looking for new physics and extracting the weak phase $\beta$ . The direct CP asymmetry $C_{J/\psi\pi^{0}}$ and the deviation $\bigtriangleup S_{J/\psi\pi^{0}}\equiv S_{J/\psi\pi^{0}}-\sin(-2\beta)$ of the mixing -induced CP asymmetry from $\sin(-2\beta)$ in this decay arise from quite small penguin contribution in the SM, so these quantities are sensitive to new physics effect. Comparing the prediction of CP asymmetry in the SM with the experimental data, one can find new physics signal. Thus it is essential to calculate the $\bigtriangleup S_{J/\psi\pi^{0}}$ and $C_{J/\psi\pi^{0}}$ in $B\to J/\Psi\pi^{0}$ in the SM accurately. The deviation $\bigtriangleup S_{J/\psi\pi^{0}}=S_{J/\psi\pi^{0}}-\sin(-2\beta)$ or direct CP asymmetry $C_{J/\psi\pi^{0}}$ in $B\to J/\Psi~{}\pi^{0}$ decay have been studied in Ref. deltasciu by fitting to the current experimental data, the result is $C_{J/\psi\pi^{0}}=0.09\pm 0.19$ which has very large uncertainty. In that case we can not say anything about new physics effects. In order to reveal new physics effects, we need both better theoretical prediction and experimental measurement with less uncertainties. That is the aim of our present paper. In what follows, we first evaluate the penguin pollution effect by a method which have been used to explain many B decays into charmonia successfullybtocharmn1 ; btocharmn2 . We find the penguin pollution in the $B\to J/\Psi~{}\pi^{0}$ decay is quite small, the deviation $\bigtriangleup S_{J/\psi\pi^{0}}=S_{J/\psi\pi^{0}}-\sin(-2\beta)$ in $B\to J/\Psi~{}\pi^{0}$ decay is $\mathcal{O}(10^{-3})$, which means that the measured deviation $\bigtriangleup S_{J/\psi\pi^{0}}$ at $1\%$ will indicate the presence of new physics. The latest experimental data of $\bigtriangleup S_{J/\psi\pi^{0}}$ is $S_{J/\psi\pi^{0}}=-0.4\pm 0.4$pdg2006 , which has large error, so we are expecting to have more precise measurement in the near future. The decay rate of of $B\to J/\Psi~{}\pi^{0}$ can be written as $\Gamma=\frac{1}{32\pi m_{B}}G_{F}^{2}(1-r_{2}^{2}+\frac{1}{2}r_{2}^{4}-r_{3}^{2})|{\cal A}|^{2}\;.$ (1) with $r_{2}=m_{J/\psi}/m_{B}$, $r_{3}=m_{\pi}/m_{B}$. The amplitude ${\cal A}$ consists of factorizable part and nonfactorizable part. It can be written as $\displaystyle{\cal A}$ $\displaystyle=$ $\displaystyle{\cal A}_{NF}+{\cal A}_{VERT}+{\cal A}_{HS}\;,$ (2) where ${\cal A}_{NF}$ denote the factorizable contribution in Naive Factorization Assumption(NF), ${\cal A}_{VERT}$ is the vertex corrections from Fig. 1.(a)-(d) , ${\cal A}_{HS}$ is the spectator correction from Fig. 1.(e)-(f). Figure 1: Nonfactorizable contribution to the $B^{0}\to J/\psi~{}\pi^{0}$ decay The factorizable part ${\cal A}_{NF}$ in Eq. (2) for $B\to J/\Psi\pi^{0}$ decay can not be calculated reliably in the pQCD approach, because its characteristic scale is around 1 GeV. We parameterize the sum of the factorizable part ${\cal A}_{NF}$ and the vertex corrections ${\cal A}_{VERT}$ as, $\displaystyle{\cal A}_{NF}+{\cal A}_{VERT}=a_{eff}m_{B}^{2}f_{J/{\psi}}F_{1}^{B\to\eta}(m_{J/\psi}^{2})(1-r_{2}^{2})\;,$ (3) where $f_{J/{\psi}}$ is decay constant of $J/\psi$ meson, For the $B\to\pi$ transition form factors, we employ the models derived from the light-cone sum rules formbtopi , which have been parameterized as $\displaystyle F_{1}^{B\to\pi}(q^{2})=\frac{r_{1}}{1-q^{2}/m_{1}^{2}}+\frac{r_{2}}{1-q^{2}/m_{fit}^{2}}\;$ (4) with $r_{1}=0.744$, $r_{2}=-0.486$, $m_{1}=5.32Gev$, $m_{fit}^{2}=40.73Gev$ for $B\to\pi$ transition. The factorization and vertex correction from Fig. 1.(a)-(d) can be calculated in the QCDFqcdf . Summing up the factorizable part and vertex correction , we can get the Wilson coefficient $a_{eff}$, $\displaystyle a_{eff}$ $\displaystyle=$ $\displaystyle V_{c}^{\ast}\left[C_{1}+V_{c}^{\ast}\frac{C_{2}}{N_{c}}+\frac{\alpha_{s}}{4\pi}\frac{C_{F}}{N_{c}}C_{2}\left(-18+12\ln\frac{m_{b}}{\mu}+f_{I}\right)\right]$ (5) $\displaystyle- V_{t}^{\ast}\Big{[}C_{3}+\frac{C_{4}}{N_{c}}+\frac{\alpha_{s}}{4\pi}\frac{C_{F}}{N_{c}}C_{4}\left(-18+12\ln\frac{m_{b}}{\mu}+f_{I}\right)$ $\displaystyle+C_{5}+\frac{C_{6}}{N_{c}}+\frac{\alpha_{s}}{4\pi}\frac{C_{F}}{N_{c}}C_{6}\left(6-12\ln\frac{m_{b}}{\mu}-f_{I}\right)+C_{7}+\frac{C_{8}}{N_{c}}+C_{9}+\frac{C_{1}0}{N_{c}}\Big{]}\;$ with the function, $\displaystyle f_{I}=\frac{2\sqrt{2N_{c}}}{f_{J/\psi}}\int dx_{3}\Psi^{L}(x_{2})\left[\frac{3(1-2x_{2})}{1-x_{2}}\ln x_{2}-3\pi i+3\ln(1-r_{2}^{2})+\frac{2r_{2}^{2}(1-x_{2})}{1-r_{2}^{2}x_{2}}\right]\;,$ (6) The spectator corrections ${\cal A}_{HS}$ from Fig. 1.(e)-(f), can be calculated reliably in the pQCD as in Ref. btocharmn1 ; btocharmn2 , $\displaystyle{\cal A}_{HS}$ $\displaystyle=$ $\displaystyle V_{c}^{\ast}{\cal M}_{1}^{(J/\psi\pi)}-V_{t}^{\ast}{\cal M}_{4}^{(J/\psi\pi)}-V_{t}^{\ast}{\cal M}_{6}^{(J/\psi\pi)}\;,$ (7) where the amplitudes ${\cal M}_{1,4}^{(J/\psi\pi)}$ and ${\cal M}_{6}^{(J/\psi\pi)}$ result from the $(V-A)(V-A)$ and $(V-A)(V+A)$ operators in the effective Hamiltonian, respectively. Their factorization formulas are given by the pQCD approach. In the calculation of ${\cal M}_{1,4}^{(J/\psi\eta)}$ and ${\cal M}_{6}^{(J/\psi\eta)}$, because $J/\psi$ is heavy, we reserve the power terms of $r_{2}$ up to $\mathcal{O}(r^{4}_{2})$, the power terms of $r_{3}$ up to $\mathcal{O}(r^{2}_{3})$ . $\displaystyle{\cal M}_{1,4}^{(J/\psi\pi)}$ $\displaystyle=$ $\displaystyle 16\pi m_{B}^{2}C_{F}\sqrt{2N_{c}}\int_{0}^{1}[dx]\int_{0}^{\infty}b_{1}db_{1}\Phi_{B}(x_{1},b_{1})$ (8) $\displaystyle\times\Big{\\{}\Big{[}(1-2r^{2}_{2}+r^{4}_{2})(1-x_{2})\Phi_{\pi}(x_{3})\Psi^{L}(x_{2})+\frac{1}{2}(r^{2}_{2}-r^{4}_{2})\Phi_{\pi}(x_{3})\Psi^{t}(x_{2})$ $\displaystyle- r_{\pi}(1-r^{2}_{2})x_{3}\Phi^{p}_{\pi}(x_{3})\Psi_{L}(x_{2})+r_{\pi}\left(2r^{2}_{2}(1-x_{2})+(1-r^{2}_{2})x_{3}\right)\Phi^{t}_{\pi}(x_{3})\Psi^{L}(x_{2})\Big{]}$ $\displaystyle\times E_{1,4}(t_{d}^{(1)})h_{d}^{(1)}(x_{1},x_{2},x_{3},b_{1})$ $\displaystyle-\Big{[}(x_{2}-x_{2}r^{4}_{2}+x_{3}-2r^{2}_{2}x_{3}+r^{4}_{2}x_{3})x_{3})\Phi_{\pi}(x_{3})\Psi^{L}(x_{2})$ $\displaystyle+r^{2}_{2}(2r_{\pi}\Phi^{t}_{\pi}(x_{3})-\frac{1}{2}(1-r^{2}_{2})\Phi_{\pi}(x_{3}))\Psi^{t}(x_{2})$ $\displaystyle- r_{\pi}(1-r^{2}_{2})x_{3}\Phi^{p}_{\pi}(x_{3})\Psi_{L}(x_{2})-r_{\pi}\left(2r^{2}_{2}x_{2}+(1-r^{2}_{2})x_{3}\right)\Phi^{t}_{\pi}(x_{3})\Psi^{L}(x_{2})\Big{]}$ $\displaystyle\times E_{1,4}(t^{(2)}_{d})h_{d}^{(2)}(x_{1},x_{2},x_{3},b_{1})\;,$ $\displaystyle{\cal M}_{6}^{(J/\psi\pi)}$ $\displaystyle=$ $\displaystyle 16\pi m_{B}^{2}C_{F}\sqrt{2N_{c}}\int_{0}^{1}[dx]\int_{0}^{\infty}b_{1}db_{1}\Phi_{B}(x_{1},b_{1})$ (9) $\displaystyle\times\Big{\\{}\Big{[}(1-x_{2}+r^{4}_{2}x_{2}+x_{3}-2r^{2}_{2}x_{3}+r^{4}_{2}x_{3}-r^{4}_{2})\Phi_{\pi}(x_{3})\Psi^{L}(x_{2})+$ $\displaystyle r^{2}_{2}(2r_{\pi}\Phi^{t}_{\pi}(x_{3})-\frac{1}{2}(1-r^{2}_{2})\Phi_{\pi}(x_{3}))\Psi^{t}(x_{2})$ $\displaystyle- r_{\pi}(1-r^{2}_{2})x_{3}\Phi^{p}_{\pi}(x_{3})\Psi^{L}(x_{2})-r_{\pi}\left(2r^{2}_{2}(1-x_{2})+(1-r^{2}_{2})x_{3}\right)\Phi^{t}_{\pi}(x_{3})\Psi^{L}(x_{2})\Big{]}$ $\displaystyle\times E_{6}(t_{d}^{(1)})h_{d}^{(1)}(x_{1},x_{2},x_{3},b_{1})$ $\displaystyle-\Big{[}(1-2r^{2}_{2}+r^{4}_{2})x_{2}\Phi_{\pi}(x_{3})\Psi^{L}(x_{2})+\frac{1}{2}(r^{2}_{2}-r^{4}_{2})r^{2}_{2}\Phi_{\pi}(x_{3})\Psi^{t}(x_{2})$ $\displaystyle- r_{\pi}(1-r^{2}_{2})x_{3}\Phi^{p}_{\pi}(x_{3})\Psi^{L}(x_{2})+r_{\pi}\left(2r^{2}_{2}x_{2}+(1-r^{2}_{2})x_{3}\right)\Phi^{t}_{\pi}(x_{3})\Psi^{L}(x_{2})\Big{]}$ $\displaystyle\times E_{6}(t^{(2)}_{d})h_{d}^{(2)}(x_{1},x_{2},x_{3},b_{1})\Big{\\}}\;,$ with the color factor $C_{F}=4/3$, the number of colors $N_{c}=3$, the symbol $[dx]\equiv dx_{1}dx_{2}dx_{3}$ and the mass ratio $r_{\pi}=m_{0}^{\pi}/m_{B}$, $m_{0}^{\pi}$ being the chiral scale associated with the $\pi$ meson. The evolution factor $E_{i}$ and hard function $h_{d}$ in Eq.(9) can be found in Ref. btocharmn2 . In the derivation of spectator correction in the pQCD, we need to take the wave function of relevant mesons, we list the wave functions in appendix. For the $B^{0}$ decay, the CP asymmetry is time dependent, $\displaystyle A_{CP}(t)$ $\displaystyle=$ $\displaystyle\frac{\Gamma({\bar{B}}^{0}(t)\to{J/\psi\pi^{0}})-\Gamma(B^{0}(t)\to{J/\psi\pi^{0}})}{\Gamma({\bar{B}}^{0}(t)\to{J/\psi\pi^{0}})+\Gamma(B^{0}(t)\to{J/\psi\pi^{0}})}\;,$ (10) $\displaystyle=$ $\displaystyle S_{J/\psi\pi^{0}}\sin(\Delta Mt)-C_{J/\psi\pi^{0}}\cos(\Delta Mt)\;,$ Where the mixing-induced asymmetry $S_{J/\psi\pi^{0}}$ and direct CP asymmetry is defined as $\displaystyle S_{J/\psi\pi^{0}}=\frac{2\,{\rm Im}\,\lambda_{J/\psi\pi^{0}}}{1+|\lambda_{J/\psi\pi^{0}}|^{2}}\;,$ $\displaystyle C_{J/\psi\pi^{0}}=\frac{1-|\lambda_{J/\psi\pi^{0}}|^{2}}{1+|\lambda_{J/\psi\pi^{0}}|^{2}}\;,$ (11) where $\lambda_{CP}=\frac{V_{tb}^{*}V_{td}\langle J/\psi\pi^{0}|H_{eff}|\overline{B}^{0}\rangle}{V_{tb}V_{td}^{*}\langle J/\psi\pi^{0}|H_{eff}|B^{0}\rangle}.$ (12) There are two ways to extract weak phase $\beta$ through $B^{0}\to J/\Psi~{}\pi^{0}$ decay. The first way is through the dependence of the mixing-induced CP asymmetry on weak phase $\beta$. The $S_{J/\psi\pi^{0}}$ is not sensitive of input parameters, as shown in Fig. 4. That means that the theoretical uncertainties of $S_{J/\psi\pi^{0}}$ is quite small. If we measure the mixing-induced asymmetry $S_{J/\psi\pi^{0}}$, we can determine weak phase $\beta$ through the dependence of $S_{J/\psi\pi^{0}}$ on $\beta$ as shown in Fig. 3 and Table 1, $\beta$(deg) | 18.0 | 18.3 | 18.6 | 18.9 | 19.2 | 19.5 | 19.8 | 20.1 ---|---|---|---|---|---|---|---|--- $S_{J/\psi\pi^{0}}$ | -0.58515 | -0.59357 | -0.60192 | -0.61021 | -0.61843 | -0.62658 | -0.63467 | -0.64269 $\beta$ (deg) | 20.4 | 20.7 | 21 | 21.3 | 21.6 | 21.9 | 22.2 | 22.5 $S_{J/\psi\pi^{0}}$ | -0.65063 | -0.65851 | -0.66631 | -0.67404 | -0.68170 | -0.68929 | -0.69680 | -0.70424 $\beta$ (deg) | 22.8 | 23.1 | 23.4 | 23.7 | 24.0 | 24.3 | 24.6 | 24.9 $S_{J/\psi\pi^{0}}$ | -0.71160 | -0.71888 | -0.72608 | -0.73321 | -0.74025 | -0.74722 | -0.75410 | -0.76090 Table 1: Determination of weak phase $\beta$ through mixing-induced CP asymmetry $S_{J/\psi\pi^{0}}$ Another way is to use the relation of the total asymmetry $A_{CP}$ with the weak phase $\beta$. By integrating $A_{CP}(t)$with respect to the time variable t, we can get the total asymmetry $A_{CP}$, $A_{CP}=\frac{x}{1+x^{2}}S_{J/\psi\pi^{0}}-\frac{1}{1+x^{2}}C_{J/\psi\pi^{0}},$ (13) with $x=\Delta m/\Gamma\simeq 0.723$ for the $B^{0}$-$\overline{B}^{0}$ mixing in the SM pdg2006 . Like the mixing-induced asymmetry, the total asymmetry is also not sensitive to the input parameters, so we can determine the weak phase through the relation of the total CP asymmetry with weak phase $\beta$ shown in Fig. 3. The numerical calculation needs some parameters and meson distribution amplitudes as input, we list them in the appendix. With the parameters and meson distribution amplitude in the appendix, we get the branching ratios of $B\to J/\Psi~{}\pi^{0}$ decays, $\Delta S_{J/\psi\pi^{0}}$ and $C_{J/\psi\pi^{0}}$, $\displaystyle Br(B^{0}\to J/\psi\pi^{0})$ $\displaystyle=$ $\displaystyle[1.89^{+0.182}_{-0.21}(\omega b)^{+0.0496}_{-0.02}(\mu)^{+0.193}_{-0.171}(F_{1})^{+0.015}_{-0.014}(f_{J/\psi})^{+0.04}_{-0.059}(\lambda)^{+0.04}_{-0.068}(A)]\times 10^{-5}\,,$ $\displaystyle C_{J/\psi\pi^{0}}$ $\displaystyle=$ $\displaystyle[-9.936_{-3.093}^{+0.866}(\omega b)_{-2.368}^{+1.173}(\gamma)_{-0.289}^{+6.914}(\mu)_{-1.18}^{+1.34}(F_{1})_{-0.56}^{+0.54}(\beta)]\times 10^{-3}\,,$ $\displaystyle\Delta S_{J/\psi\pi^{0}}$ $\displaystyle=$ $\displaystyle[2.84^{+4.07}_{-1.00}(\omega b)^{+0.72}_{-0.35}(\gamma)^{+2.1}_{-0.17}(\mu)^{+0.29}_{-0.20}(F_{1})^{+0.03}_{-0.05}(\beta)]\times 10^{-3}\,.$ (14) The main theoretical errors of the branching ratio are induced by the uncertainties below. The first error is from $\omega b=0.4\pm 0.04GeV$, the second one is due to renormalization scale $\mu$ taken from $mb/2$ to $mb$, the third one is induced by $15\%$ uncertainty of $B\to\pi$ form factor $F_{1}^{B\to\pi}$, the fourth one arise from decay constant $f_{J/\psi}=0.405\pm 0.05GeV$, the fifth error is from CKM matrix parameter $\lambda=0.2272\pm 0.001$, the sixth one is from CKM matrix parameter $A=0.818^{+0.007}_{-0.017}$. Compared with the experimental datapdg2006 $\displaystyle Br(B^{0}\to J/\psi\pi^{0})$ $\displaystyle=$ $\displaystyle(2.2\pm 0.4)\times 10^{-5}\,,$ (15) our prediction of the branching ratio for $B\to J/\Psi~{}\pi^{0}$ is consistent with it. Unlike the branching ratio, $\Delta S_{J/\psi\pi^{0}}$ and $C_{J/\psi\pi^{0}}$ is not sensitive to CKM matrix parameter $\lambda$ or $A$, because these parameter dependences cancel out. The independence of $\Delta S_{J/\psi\pi^{0}}$ and $C_{J/\psi\pi^{0}}$ on some CKM parameters is shown in Fig. 4(a),(b),and Fig. 5.(a),(b). To find new physics and to extract the weak phase $\beta$, we need reliable evaluation for the direct CP asymmetry $C_{J/\psi\pi^{0}}$ and $\Delta S_{J/\psi\pi^{0}}$, so we now consider the dependence of the direct CP asymmetry $C_{J/\psi\pi^{0}}$ and $\Delta S_{J/\psi\pi^{0}}$with all parameters of input. The main uncertainties of $C_{J/\psi\pi^{0}}$ and $\Delta S_{J/\psi\pi^{0}}$ are induced by uncertainties of shape parameter $\omega b$, CKM matrix phase$\gamma$, renormalization scale $\mu$, $B\to\pi$ form factor $F_{1}^{B\to\pi}$ and the weak phase $\beta$. The uncertainties of $\Delta S_{J/\psi\pi^{0}}$ and $C_{J/\psi\pi^{0}}$ are shown in Fig. 4(c)-(f) and Fig. 5.(c)-(f). Comparing with the result in Ref. deltasciu , $\displaystyle C_{J/\psi\pi^{0}}$ $\displaystyle=$ $\displaystyle 0.09\pm 0.19$ (16) $\displaystyle S_{J/\psi\pi^{0}}$ $\displaystyle=$ $\displaystyle-0.47\pm 0.30$ (17) our results of $\Delta S_{J/\psi\pi^{0}}$and $C_{J/\psi\pi^{0}}$ has much less theoretical uncertainties. So we conclude that if the measured deviation $\Delta S_{J/\psi\pi^{0}}$ of the mixing-induced asymmetry is at $1\%$ or the direct asymmetry $C_{J/\psi\pi^{0}}$ is at the level of percentage then we can say that there should be new physics . We are expecting precise measurement to the CP asymmetry of $B^{0}\to J/\psi\pi^{0}$ in the near future. ## Appendix A Input Parameters And Wave Functions We use the following input parameters in the numerical calculations $\displaystyle\Lambda_{\overline{\mathrm{MS}}}^{(f=4)}$ $\displaystyle=$ $\displaystyle 250{\rm MeV},\quad f_{\pi}=130{\rm MeV},\quad f_{B}=190{\rm MeV},$ $\displaystyle m_{0}^{\pi}$ $\displaystyle=$ $\displaystyle 1.4{\rm GeV},\quad M_{B}=5.2792{\rm GeV},\quad\tau_{B^{0}}=1.53\times 10^{-12}{\rm s},$ (18) For the CKM matrix elements, we adopt the wolfenstein parametrization for the CKM matrix up to $\mathcal{O}$$(\lambda^{3})$pdg2006 , $V_{CKM}=\left(\begin{array}[]{ccc}1-\frac{\lambda^{2}}{2}&\lambda&A\lambda^{3}(\rho-i\eta)\\\ -\lambda&1-\frac{\lambda^{2}}{2}&A\lambda^{2}\\\ A\lambda^{3}(1-\rho-i\eta)&-A\lambda^{2}&1\end{array}\right),$ (19) with the parameters $\lambda=0.2272,A=0.818,\rho=0.221$ and $\eta=0.340$. For the $B$ meson distribution amplitude, we adopt the modelkls01 $\displaystyle\phi_{B}(x,b)$ $\displaystyle=$ $\displaystyle N_{B}x^{2}(1-x)^{2}\mathrm{exp}\left[-\frac{M_{B}^{2}\ x^{2}}{2\omega_{b}^{2}}-\frac{1}{2}(\omega_{b}b)^{2}\right],$ (20) where $\omega_{b}$ is a free parameter and we take $\omega_{b}=0.4\pm 0.05$ GeV in numerical calculations, and $N_{B}=91.745$ is the normalization factor for $\omega_{b}=0.4$. The $J/\psi$ meson asymptotic distribution amplitudes are given by BC04 $\displaystyle\Psi^{L}(x)$ $\displaystyle=$ $\displaystyle\Psi^{T}(x)=9.58\frac{f_{J/\psi}}{2\sqrt{2N_{c}}}x(1-x)\left[\frac{x(1-x)}{1-2.8x(1-x)}\right]^{0.7}\;,$ $\displaystyle\Psi^{t}(x)$ $\displaystyle=$ $\displaystyle 10.94\frac{f_{J/\psi}}{2\sqrt{2N_{c}}}(1-2x)^{2}\left[\frac{x(1-x)}{1-2.8x(1-x)}\right]^{0.7}\;,$ $\displaystyle\Psi^{V}(x)$ $\displaystyle=$ $\displaystyle 1.67\frac{f_{J/\psi}}{2\sqrt{2N_{c}}}\left[1+(2x-1)^{2}\right]\left[\frac{x(1-x)}{1-2.8x(1-x)}\right]^{0.7}\;,$ (21) For the light meson wave function, we neglect the $b$ dependant part, which is not important in numerical analysis. We choose the wave function of $\pi$ meson ball3 : $\displaystyle\Phi_{\pi}(x)$ $\displaystyle=$ $\displaystyle\frac{3}{\sqrt{6}}f_{\pi}x(1-x)\left[1+0.44C_{2}^{3/2}(2x-1)+0.25C_{4}^{3/2}(2x-1)\right],$ (22) $\displaystyle\Phi_{\pi}^{P}(x)$ $\displaystyle=$ $\displaystyle\frac{f_{\pi}}{2\sqrt{6}}\left[1+0.43C_{2}^{1/2}(2x-1)+0.09C_{4}^{1/2}(2x-1)\right],$ (23) $\displaystyle\Phi_{\pi}^{t}(x)$ $\displaystyle=$ $\displaystyle\frac{f_{\pi}}{2\sqrt{6}}(1-2x)\left[1+0.55(10x^{2}-10x+1)\right].$ (24) The Gegenbauer polynomials are defined by $\begin{array}[]{ll}C_{2}^{1/2}(t)=\frac{1}{2}(3t^{2}-1),&C_{4}^{1/2}(t)=\frac{1}{8}(35t^{4}-30t^{2}+3),\\\ C_{2}^{3/2}(t)=\frac{3}{2}(5t^{2}-1),&C_{4}^{3/2}(t)=\frac{15}{8}(21t^{4}-14t^{2}+1).\end{array}$ (25) ## References * (1) Gautam Bhattacharyya, Gustavo C. Branco, Wei-Shu Hou, Phys.Rev. D54(1996)2114; P. Bamert, Int.J.Mod.Phys. A12(1997)723; G.F.Giudice, M.L.Mangano, et al, hep-ph/9602207. * (2) P. Bamert, C.P. Burgess, J.M. Cline, D. London, E. Nardi,Phys.Rev. D54 (1996) 4275; J.L. Hewett, T. Takeuchi, S. Thomas ,hep-ph/9603391; J.-M. Fr re, V.A. Novikov, M.I. Vysotsky, Phys.Lett. B386 (1996) 437. * (3) F. Larios, C.-P. Yuan, Phys.Rev. D55 (1997) 7218; M. Gronau, D. London,Phys.Rev. D55 (1997) 2845; Joao P. Silva, L. Wolfenstein, Phys.Rev. D55 (1997) 5331\. * (4) Dongsheng Du, Hongying Jin, Yadong Yang, Phys.Lett. B414 (1997) 130; S.I.Bityukov, N.V.Krasnikov, Mod.Phys.Lett. A12 (1997) 2011; Robert Fleischer, Thomas Mannel, hep-ph/9706261; A.I. Sanda, Zhi-zhong Xing, Phys.Rev. D56 (1997) 6866. * (5) A.L. Kagan, M. Neubert, Phys.Rev. D58 (1998) 094012; Xiao-Gang He, Wei-Shu Hou, Phys.Lett. B445 (1999) 344; Yue-Liang Wu, Chin.Phys.Lett. 16 (1999) 339. * (6) Katri Huitu, Cai-Dian Lu, Paul Singer, Da-Xin Zhang , Phys.Rev.Lett. 81 (1998) 4313; Harry J. Lipkin, Zhi-zhong Xing, Phys.Lett. B450 (1999) 405; Maxime Imbeault, David London, Chandradew Sharma, Nita Sinha, Rahul Sinha, hep-ph/0608169. * (7) S. Fajfer, S. Prelovsek, P. Singer, D. Wyler, Phys.Lett. B487 (2000) 81; T. M. Aliev, A. Ozpineci, M. Savci, Phys.Rev. D65 (2002) 115002; Cheng-Wei Chiang, Jonathan L. Rosner, Phys.Rev. D68 (2003) 014007; M. Ciuchini, E. Franco, F. Parodi, V. Lubicz, L. Silvestrini, A. Stocchi, hep-ph/0307195. * (8) Andrzej J. Buras, hep-ph/0402191; A.K.Giri, R.Mohanta, Phys.Lett. B594 (2004) 196; A.K.Giri, R.Mohanta, JHEP 0411 (2004) 084; Seungwon Baek, JHEP 0607 (2006) 025 . * (9) Rahul Sinha, Basudha Misra, Wei-Shu Hou, Phys.Rev.Lett. 97 (2006) 131802 ; M. Bona, M. Ciuchini, E. Franco, et al, Phys.Rev.Lett. 97 (2006) 151803; Hsiang-nan Li, Satoshi Mishima, hep-ph/0610120 ; C. S. Kim, Sechul Oh, Yeo Woong Yoon, arXiv:0707.2967. * (10) M. Gronau, D. London, Phys.Rev. D55 (1997) 2845. * (11) D. London, hep-ph/9907311. * (12) Patricia Ball, Robert Fleischer, Eur.Phys.J. C48 (2006) 413; Patricia Ball, hep-ph/0703214. * (13) Alakabha Datta, Phys.Rev. D74 (2006) 014022. * (14) Alakabha Datta, Phys.Rev. D74 (2006) 014022. * (15) Joao P. Silva, Lincoln Wolfenstein, Phys.Rev. D62 (2000) 014018\. * (16) Zhi-zhong Xing, Eur.Phys.J. C4 (1998) 283-287. * (17) George W.S. Hou, hep-ph/0611154. * (18) M. Ciuchini, M. Pierini, L. Silvestrini, Phys.Rev.Lett. 95 (2005) 221804\. * (19) Chuan-Hung Chen, Hsiang-Nan Li, Phys.Rev. D71 (2005) 114008\. * (20) Jing-Wu Li, Dong-Sheng Du, Phys. Rev. D 78, (2008) 074030. * (21) W.-M. Yao et al., Journal of Physics, G 33, 1 (2006). * (22) Patricia Ball, Roman Zwicky, Phys.Rev. D71 (2005) 014015\. * (23) M. Beneke, G. Buchalla, M. Neubert and C. T. Sachrajda, Phys. Rev. Lett. 83, 1914 (1999) ; Nucl. Phys. B 591, 313 (2000) ; M. Beneke, G. Buchalla, M. Neubert and C. T. Sachrajda, Nucl. Phys. B 606, 245 (2001) ; M. Beneke and M. Neubert, Nucl. Phys. B 675, 333 (2003) . * (24) Y.-Y. Keum, H.-n. Li and A.I. Sanda, Phys.Lett. B, 504, 6(2001) ; Phys.Rev. D,63, 054008 (2001) . * (25) A.E. Bondar and V.L. Chernyak, hep-ph/0412335. * (26) V.M. Braun and I.E. Filyanov, Z.Phys.C 48, 239 (1990); P. Ball, J.High Energy Phys. 01,010 (1999) . Figure 2: The dependence of the mixing-induced asymmetry $S_{J/\psi\pi^{0}}$ for $B^{0}\to J/\Psi~{}\pi^{0}$ on the weak phase $\beta$ in diagram $(a)$. The dependence of the deviation $\Delta S_{J/\psi\pi^{0}}$ of the mixing- induced asymmetry from $\sin(-2\beta)$ on the weak phase $\beta$ in diagram $(b)$ Figure 3: The dependence of the the mixing-induced asymmetry $S_{J/\psi\pi^{0}}$ for $B^{0}\to J/\Psi~{}\pi^{0}$ on the weak phase $\beta$ in diagram $(a)$ can be used to extract the weak phase $\beta$ . The dependence of total CP asymmetry $A_{CP}$ on the weak phase $\beta$ in diagram$(b)$ can be used to extract the weak phase $\beta$ also. Figure 4: The uncertainties of $\Delta S_{J/\psi\pi^{0}}$ of the mixing- induced asymmetry from $\sin(-2\beta)$ are induced by that of renormalization scale $\mu$ in $(c)$ , that of $B\to\pi$ form factor in $(d)$, that of the weak phase $\gamma$ in $(e)$ and that of $\sin(2\beta)$ in $(f)$ . Figure 5: The uncertainties of the direct CP asymmetry $C_{J/\psi\pi^{0}}$ are induced by that of renormalization scale $\mu$ in $(c)$ , that of $B\to\pi$ form factor in $(d)$, that of the weak phase $\gamma$ in $(e)$ and that of $\sin(2\beta)$ in $(f)$ .
arxiv-papers
2009-04-08T10:55:59
2024-09-04T02:49:01.787665
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Jing-Wu Li, Dong-Sheng Du, Xiang-Yao Wu", "submitter": "JingWu Li", "url": "https://arxiv.org/abs/0904.1304" }
0904.1356
# Morphology and Interaction between Lipid Domains Tristan S. Ursell1, William S. Klug2 and Rob Phillips1111Address correspondence to: phillips@pboc.caltech.edu 1Department of Applied Physics, California Institute of Technology, Pasadena, CA 91125 2Department of Mechanical and Aerospace Engineering, Program in Biomedical Engineering, and California NanoSystems Institute, University of California Los Angeles, Los Angeles, CA 90095 Cellular membranes are a heterogeneous mix of lipids, proteins and small molecules. Special groupings of saturated lipids and cholesterol form a liquid-ordered phase, known as ‘lipid rafts,’ serving as platforms for signaling, trafficking and material transport throughout the secretory pathway. Questions remain as to how the cell maintains heterogeneity of a fluid membrane with multiple phases, through time, on a length-scale consistent with the fact that no large-scale phase separation is observed. We have utilized a combination of mechanical modeling and in vitro experiments to show that membrane morphology can be a key player in maintaining this heterogeneity and organizing such domains in the membrane. We demonstrate that lipid domains can adopt a flat or dimpled morphology, where the latter facilitates a repulsive interaction that slows coalescence and tends to organize domains. These forces, that depend on domain morphology, play an important role in regulating lipid domain size and in the lateral organization of lipids in the membrane. The plasma and organelle membranes of cells are composed of a host of different lipids, lipophilic molecules and membrane proteins [1]. Together, they form a heterogeneous layer capable of regulating the flow of materials and signals into and out of the cell. Lipid structure and sterol content play a key role in membrane organization, where steric interactions and energetically costly mismatch in the hydrophobic structure of lipid tails result in lateral phase-separation. Saturated lipids and cholesterol are sequestered into liquid-ordered ($L_{\mbox{\footnotesize o}}$) domains, often known as ‘lipid rafts’, from an unsaturated liquid-disordered ($L_{\mbox{\footnotesize d}}$) phase [2, 3, 4]. Domains composed of saturated sphingolipids and cholesterol, with sizes in the range of $\sim 50-500\,\mbox{nm}$, have been implicated in a range of biological processes from lateral protein organization and virus uptake to signaling and plasma- membrane tension regulation [5, 6, 7, 8, 9, 10, 11, 12, 13, 14, 15, 16, 17]. How the cell maintains the lateral heterogeneity of lipids over time, and what physical mechanism might be responsible for the spatial organization of these domains, challenges classical theories of phase-separation and ‘domain ripening’ (such as Cahn-Hilliard kinetics [18]). The maintenance of lateral heterogeneity is thought to arise from a combination of lipid recycling and energetic barriers to domain coalescence [19, 20, 21] (potentially provided by transmembrane proteins [22]), resulting in a stable distribution of domain sizes. The precise origin of this energy barrier and the nature of its dependence on membrane elastic properties remains unclear. The simplest physical model that describes the evolution of lipid domain size and position predicts that domains diffuse and coalesce, such that the number of domains constantly decreases, while the average domain size constantly increases [18]. Indeed, models of two-dimensional phase separation have been studied in detail for many physical systems [23, 24, 25, 26], and where the phase boundary is unfavorable and characterized by an energy per unit length [27], the domain size grows continuously ($\propto t^{1/3}$) [18, 28, 29]. However, membranes can adopt three-dimensional morphologies that affect the kinetics of phase separation [30, 31, 32, 33, 34]. In those cases where morphology is considered as part of the phase separation model, novel coalescence kinetics emerge [31]. Experimentally, model membranes have shown that nearly complete phase separation on the surface of a cell-sized vesicle can be reached in as little as one minute [2]. This seems inconsistent with the fact that on the cell surface, much smaller domains persist on that same time-scale [21] and no large-scale phase separation is observed. With these facts in mind, our central questions are: how can membranes that have phase- separated maintain their lateral heterogeneity on long time scales and short length scales? Are there membrane-mediated (i.e. elastic) forces that inhibit coalescence and spatially organize domains? We begin to answer these questions by examining the energetics of the membrane using a linear elastic model. A phase-separated membrane is endowed with bending stiffness, membrane tension, an energetic cost at the phase boundary, and domains of a particular size. Membrane bending and tension establish a natural length-scale over which a morphological instability develops that switches domains from a flat to ‘dimpled’ shape, similar to classical Euler buckling [35] (see Figure 1). The dimpling instability is size-selective and ‘turns on’ a membrane-mediated interaction that inhibits domain coalescence. This transition is a precursor to budding, and is distinct from transitions that require spontaneous curvature. While variations in membrane composition may change specific parameter values, the mechanical effects we describe are generic. Thus, these systems exhibit shape-dependent coarsening kinetics, that are relevant for a broad class of two-dimensional binary fluid systems. The interaction between domains is a mechanical effect, and we use a model treating dimpled domains as curved rigid inclusions to distill the main principles governing this interaction. The confluence of membrane properties required for this morphological change and its attendant forces lies squarely in the biological regime. Experimentally, we use a model mixture of lipids and cholesterol to show that such an interaction exists between dimpled domains and is well approximated by a simple model. Combined with lipid recycling [19], we offer elastic interactions as a mechanism for the maintenance of lipid lateral-heterogeneity and organization of domains in cellular membranes. Figure 1: Three dimensional rendering of a dimpled lipid domain in dimensionless coordinates. For a domain (shown in red), a competition between bending, membrane tension, and phase boundary line tension results in a morphological transition from a flat to a dimpled state as depicted above. The dimple costs bending energy but relieves line tension by reducing the phase boundary length (shown as a white line around the domain). This morphology facilitates interactions between domains that significantly alter the kinetics of coalescence and lateral lipid organization. The projected domain radius is $\rho_{o}=r_{o}/\lambda_{2}$. The first section of the paper outlines the energetic contributions to the mechanical model, and predicts the conditions under which domain dimpling occurs. The second section outlines how dimpled domains facilitate an elastic interaction and compares the model interaction to our measurements made in phase-separated giant unilamellar vesicles. The Elastic Model and Morphological Transitions The energetics of a lipid domain are dominated by a competition — on one hand the applied membrane tension and bending stiffness both energetically favor a flat domain; on the other hand the phase boundary line tension prefers any domain morphology (in 3D) that reduces the boundary length. We use a continuum mechanical model that couples these effects, relating the energetics of membrane deformation to domain morphology. As we will show, this competition results in a morphological transition from a flat to dimpled domain shape, where two dimpled domains are then capable of interacting elastically. Lipid domains in a liquid state naturally adopt a circular shape to minimize the phase boundary length [2], allowing us to formulate our continuum mechanical model in polar coordinates. We employ a Monge representation, where the membrane mid-plane is described by a height function $h({\bf r})$ in the limit of small membrane deformations (i.e. $|\nabla h|<1$). With this height function, we characterize how membrane tension, bending, spontaneous curvature and line tension all contribute to domain energetics. Changes in membrane height alter the projected area of the membrane and hence do work against the applied membrane tension, resulting in an increase in energy written as ${G_{\mbox{\tiny tens}}=\pi\tau\left(\int_{0}^{r_{o}}(\nabla h_{1})^{2}r{\rm d}r+\int_{r_{o}}^{\infty}(\nabla h_{2})^{2}r{\rm d}r\right),}$ (1) where $\tau$ is the constant membrane tension, $r_{o}$ is the projected radius of the domain, $h_{1}$ is the height function of the domain and $h_{2}$ is the height function of the surrounding membrane [36, 37]. Membrane curvature is penalized by the bending stiffness with a bending energy written as [39, 36] ${G_{\mbox{\tiny bend}}=\pi\kappa_{b}^{\mbox{\tiny(2)}}\left(\sigma\int_{0}^{r_{o}}\left(\nabla^{2}h_{1}\right)^{2}r{\rm d}r+\int_{r_{o}}^{\infty}\left(\nabla^{2}h_{2}\right)^{2}r{\rm d}r\right).}$ (2) Our model allows the domain and surrounding membrane to have differing stiffnesses, $\kappa_{b}^{\mbox{\tiny(1)}}$ and $\kappa_{b}^{\mbox{\tiny(2)}}$ respectively, characterized by the parameter $\sigma=\kappa_{b}^{\mbox{\tiny(1)}}/\kappa_{b}^{\mbox{\tiny(2)}}$, and from this point on we drop the superscript on $\kappa_{b}^{\mbox{\tiny(2)}}$. Recent experiments suggest that the bending moduli of a cholesterol-rich domain and the surrounding membrane are roughly equal [4, 38], and hence for simplicity, we assume the bending moduli of the two regions are equal (i.e. $\sigma=1$), unless otherwise noted. In addition to bending stiffness, the domain may exhibit a preferred ‘spontaneous’ curvature due to lipid asymmetry or protein binding [40, 34]. The contribution of domain spontaneous curvature can be simplified to a boundary integral, which couples to the overall curvature field by ${G_{\mbox{\tiny spont}}=-2\pi\sigma\kappa_{b}c_{o}\int_{0}^{r_{o}}\left(\nabla^{2}h_{1}\right)r{\rm d}r=-2\pi\sigma\kappa_{b}c_{o}r_{o}\epsilon,}$ (3) where $c_{o}$ is the spontaneous curvature of the domain and $\epsilon$ is the membrane slope at the phase boundary as shown in Figure 1. Further, we assume the saddle-splay curvature moduli are equal in the two regions, yielding no dependence on Gaussian curvature. In principle, this contribution could be accounted for with a boundary term, explored in detail in the supplementary information (SI). The phase boundary line tension is applied to the projected circumference of the domain, as shown in Figure 1, by $G_{\mbox{\tiny line}}=2\pi r_{o}\gamma$ where $\gamma$ is the energy per unit length at the phase boundary. Finally, a constraint must be imposed that relates the actual domain area, $\mathcal{A}$, to the projected domain radius $r_{o}$. The energetic cost to change the area per lipid molecule is high ($\sim 50-100\,k_{B}T/\mbox{nm}^{2}$ where $k_{B}=1.38\times 10^{-23}\,J/\mbox{K}$ and $T=300\,\mbox{K}$ [41]), hence we assume the domain area is conserved during any morphological change (see SI for details). We impose this constraint using a Lagrange multiplier, $\tau_{o}$, with units of tension by ${G_{\mbox{\tiny area}}=\tau_{o}\left(\pi\int_{0}^{r_{o}}(\nabla h_{1})^{2}r{\rm d}r+\pi r_{o}^{2}-\mathcal{A}\right).}$ (4) This results in an effective membrane tension within the domain $\tau_{1}=\tau+\tau_{o}$, which must be negative to induce dimpling. Examining the interplay between bending and membrane tension, we see that two natural length scales emerge - within the domain we define $\lambda_{1}=\sqrt{\sigma\kappa_{b}/\tau_{1}}$ and outside the domain we define $\lambda_{2}=\sqrt{\kappa_{b}/\tau}$. These length scales allow us to define the relevant dimensionless parameters in this system. The total free energy of an elastic domain and its surrounding membrane is then the sum of these five terms, $G=G_{\mbox{\tiny tens}}+G_{\mbox{\tiny bend}}+G_{\mbox{\tiny spont}}+G_{\mbox{\tiny line}}+G_{\mbox{\tiny area}}$. Details on all the terms in the free energy can be found in the SI. With this free energy in hand, we examine how the morphology of a circular domain evolves as we tune domain size and the elastic properties of the membrane. The height field and radius can be rescaled by the elastic decay lengths such that the Euler-Lagrange equation for the domain can be written in the parameter-free form $\nabla^{2}(\nabla^{2}+\beta^{2})\eta_{1}=0$, while the equation for the surrounding membrane is $\nabla^{2}(\nabla^{2}-1)\eta_{2}=0$, where the dimensionless variables are defined by $\lambda_{2}\eta_{i}=h_{i}$, $\lambda_{2}\rho=r$, $\lambda_{2}\rho_{o}=r_{o}$ and $\beta=i\lambda_{2}/\lambda_{1}$. Using the same dimensionless notation, the energy from line tension and spontaneous curvature can be written as $G_{\mbox{\tiny line}}=2\pi\kappa_{b}\rho_{o}\chi$ and $G_{\mbox{\tiny spont}}=-2\pi\sigma\kappa_{b}\epsilon\rho_{o}\upsilon_{o}$, with $\upsilon_{o}=\lambda_{2}c_{o}$ and $\chi=\gamma\lambda_{2}/\kappa_{b}$. The dimensionless line tension, $\chi$, is simply a rescaled version of the line tension $\gamma$ and is one of two key parameters that characterize the morphological transition; the dimensionless domain area, $\alpha=\mathcal{A}/\lambda_{2}^{2}$, is the second key parameter. The admissible solutions for $\eta_{1}(\rho)$ and $\eta_{2}(\rho)$ are zeroth order Bessel functions $J_{0}(\beta\rho)$ and $K_{0}(\rho)$, respectively, with the boundary conditions $|\nabla\eta_{1}(0)|=|\nabla\eta_{2}(\infty)|=0$ and $|\nabla\eta_{1}(\rho_{o})|=|\nabla\eta_{2}(\rho_{o})|=\epsilon$. The boundary slope, $\epsilon$, is the parameter that indicates the morphology of the domain; $\epsilon=0$ indicates a flat domain, while $0<|\epsilon|\lesssim 1$ indicates a dimpled domain. The five contributions to membrane deformation energy yield a relatively simple expression for the total free energy, given by $\displaystyle G$ $\displaystyle=$ $\displaystyle\pi\kappa_{b}\rho_{o}\left[\epsilon^{2}\left(\sigma\beta\frac{J_{0}(\beta\rho_{o})}{J_{1}(\beta\rho_{o})}+\frac{K_{0}(\rho_{o})}{K_{1}(\rho_{o})}\right)+2(\chi-\epsilon\sigma\upsilon_{o})\right]$ $\displaystyle-\kappa_{b}(\sigma\beta^{2}+1)(\pi\rho_{o}^{2}-\alpha).$ Mechanical equilibrium is enforced by rendering the energy stationary with respect to unknown parameters $\epsilon$, $\rho_{o}$, and $\beta$, ${\frac{\partial G}{\partial\epsilon}=0,\quad\frac{\partial G}{\partial\rho_{o}}=0,\quad\frac{\partial G}{\partial\beta}=0.}$ (6) These equilibrium equations physically correspond to torque balance at the phase boundary, lateral force balance at the phase boundary and domain area conservation, respectively. Analysis of the equilibrium equations reveals a second-order transition at a critical line-tension, $\chi_{c}$, as shown in Figure 2. For $\chi$ less than this critical value, only the flat, trivial solution with $\epsilon=0$ exists. At $\chi_{c}$ a non-trivial solution describing buckled or dimpled morphologies emerges. For zero spontaneous curvature, the bifurcation is defined by a transcendental characteristic equation ${\sigma\beta\frac{J_{0}(\beta\rho_{o})}{J_{1}(\beta\rho_{o})}+\frac{K_{0}(\rho_{o})}{K_{1}(\rho_{o})}=0,}$ (7) with $\beta=\sqrt{(\chi_{c}/\rho_{o}-1)/\sigma}$ and $\rho_{o}=\sqrt{\alpha/\pi}$. For a given dimensionless domain area, $\alpha$, this defines the critical line tension required to dimple the domain. In Figure 2a(inset), this relation is used to generate a morphological phase diagram that shows where in the space of dimensionless domain area and line tension we find the discontinuous transition (i.e. bifurcation) from a flat domain, to a dimpled domain. Near the morphological transition the boundary slope grows as $|\epsilon|\propto\sqrt{\chi/\chi_{c}-1}$, indicating that a dimple rapidly deviates from the flat state. The transition is symmetric, in that both possible dimple curvatures have the same energy, and hence the domain is equally likely to dimple upwards or downwards. In the experimentally relevant limit of small dimensionless domain area, the complexity of eqn. 7 is reduced to ${\chi_{c}\sqrt{\alpha}=\frac{\gamma_{c}}{\kappa_{b}}\sqrt{\mathcal{A}}\simeq 8\sigma\sqrt{\pi}.}$ (8) This leads to the conclusion that the dominant parameter governing domain dimpling at zero spontaneous curvature is $\chi\sqrt{\alpha}$. For a small domain, the dimpling transition is directly regulated by domain area, the bending modulus, and line tension, but only weakly depends on applied membrane tension. Intuitively, domains dimple when line tension or domain size increase (subject to small $\alpha$), as shown in Figure 2a(inset). Likewise, a decrease in bending stiffness, due, for instance, to changes in membrane sterol content [42, 43], can also induce dimpling. The effects of applied membrane tension are weak because the change in projected area upon dimpling does not lead to a significant energy cost relative to the cost of bending and line tension. If membrane elastic properties are fixed (i.e. fixed $\kappa_{b}$, $\tau$ and $\gamma$), the dimpling-induced interactions ‘turn on’ only after a critical domain size is achieved. This scenario is encountered when two domains, too small to dimple on their own, diffusively coalesce into a larger domain capable of dimpling and hence interacting. Indeed, such a size-selective coalescence mechanism was observed recently in model membrane vesicles [44]. This constitutes a distinct class of coarsening dynamics, where classical diffusion-limited kinetics are obeyed until the domain size distribution has matured past the critical size for dimpling - then domain coalescence is a relatively slow, interaction-limited process. Figure 2: Bifurcation diagram for dimpling transition at constant area ($\alpha=\pi/4$, $\kappa_{b}=25\,k_{B}T$, $\lambda_{2}=500\,\mbox{nm}$, $\sigma=1$). Constant line tension and increasing area produces a qualitatively similar graph. a) At zero spontaneous curvature ($\upsilon_{o}=0\rightarrow\mbox{black}$) the bifurcation is symmetric, the upper and lower branches are at the same energy, and $\epsilon=0$ becomes unstable above the critical point (horizontal black dashed line). With finite spontaneous curvature ($\upsilon_{o}=2$, $c_{o}=(250\,\mbox{nm})^{-1}\rightarrow\mbox{blue}$) the lower energy branch (upper) has non-zero $\epsilon$ for all line tensions, asymptoting to the $\upsilon_{o}=0$ branch. At a line tension slightly higher than $\chi_{c}$ for the $\upsilon_{o}=0$ case, a bifurcation yields a higher energy dimple with the opposite curvature as $\upsilon_{o}$ (indicated by the second vertical dashed line). Inset: Equilibrium phase diagrams for $\sigma=0.5$(red), $\sigma=1$(green), and $\sigma=2$(blue) (the dashed lines are the approximation of eqn. 8) showing flat (F) and dimpled (D) domains. b) Energy difference between the flat and dimpled state, normalized by $\kappa_{b}$, for domains with and without spontaneous curvature ($\upsilon_{o}=0\rightarrow\mbox{black}$; $\upsilon_{o}=2\rightarrow\mbox{blue}$). For the model domain considered in Figure 2, with area $\alpha=\pi/4$ ($r_{o}\simeq 250\,\mbox{nm}$), the critical dimensionless line tension is $\chi_{c}\simeq 13$, corresponding to a critical line tension of $\gamma_{c}\simeq 0.65\,k_{B}T/\mbox{nm}$. This value compares well with both theoretical estimates of the line tension [27, 45], and the higher side of experimentally measured values [4, 46, 47]. Spontaneous curvature does not affect the Euler-Lagrange equations, and hence will not effect the class of equilibrium membrane shapes. However, domains with zero and nonzero spontaneous curvature exhibit qualitatively different behavior. Biological membranes can be asymmetric with respect to leaflet composition [42, 5, 48], endowing a domain with potentially large spontaneous curvature. The energetic contribution from spontaneous curvature takes the form of an additional line tension depending linearly on the slope taken by the domain boundary, $\epsilon$. This breaks the symmetry of the membrane, giving an energetic preference to a dimple with the same curvature as the spontaneous curvature, and eliminating the trivial $\epsilon=0$ solution even at small line-tensions. As line tension increases, a bifurcation produces a second, stable, higher-energy dimple of the opposite curvature as $\upsilon_{o}$. The more energetically stable branch of this transition corresponds to a dimpled state for all values of line tension and non-zero values of domain area, as demonstrated in Figure 2a. This predicts that as soon as a domain with finite spontaneous curvature forms, it dimples, regardless of size, and begins to experience interactions with any nearby dimpled domains. It is reasonable to expect that domains with similar composition will have similar spontaneous curvature, and hence form dimples whose curvature has the same sign. As we will show, dimples whose curvature has the same sign tend to interact repulsively. Such a mechanism of coalescence inhibition was observed recently in simulation [34]. This indicates that control of spontaneous curvature via domain composition or protein binding can regulate dimpling and hence domain interaction [49, 48]. Indeed, recent experimental [50] and theoretical [51] work shows that protein binding and lipid asymmetry, respectively, lead to precisely these kinds of dimpled domains. Figure 3: Theoretical and experimental dimpled domain shapes. Domains are shown in red, surrounding membrane in blue. a) Minimum energy dimples with and without spontaneous curvature (see legend, $\alpha=\pi/4$, $\sigma=1$). b) Epi-fluorescence cross-section of a dimple on the surface of a GUV; the red and blue lines are a guide to the eye. c) 1D model of interaction - dimples maintain shape, but tilt ($\phi$) as a function of separation distance ($d$). Dimples with the same sign of curvature repel, while dimples with opposite sign attract. d) Epi-fluorescence cross-section of two dimpled domains interacting on the surface of a GUV. Scale bars are $3\,\mu\mbox{m}$. Calculated shapes of dimpled domains induced by line tension and spontaneous curvature are shown in Figure 3a, alongside dimpled domains observed on giant unilamellar vesicles, shown in Figure 3b and d. Elastic Interactions of Dimpled Domains Given two domains that have met the criteria for dimpling, the deformation in the membrane surrounding the domains mediates an elastic interaction when they are within a few elastic decay lengths ($\lambda_{2}$) of each other. This equips us to begin addressing how short length-scale and long time-scale membrane heterogeneity might be achieved. As previously stated, free diffusion sets the maximum rate at which a quenched membrane can evolve into a fully phase-separated membrane [18], where this evolution can happen in as little as a minute on the surface of a cell-sized vesicle [2]. On the other hand, recycling and hence homogenization of cellular membrane is a process that takes place on the time-scale of an hour or more [52]. Our measurements of domain interactions (detailed below and other data shown in SI) estimate the coalescence barrier between dimpled domains at $\sim 5-10\,k_{B}T$. Hence, given the diffusion-limited rate of phase separation, interactions slow this process by approximately $e^{-5}\simeq 0.007$ to $e^{-10}\simeq 0.00005$. This makes the time-scale of lipid heterogeneity comparable to the time-scale of membrane recycling and even eukaryotic cell division. The physical origin of domain interaction is explained by a simple model based on the assumption that the dimpled domain shape is constant during interaction, but the domains are free to tilt by an angle $\phi$, as shown in Figure 3c. This assumption was, in part, inspired by experimental observations of domain shapes on the surface of giant unilamellar vesicles, as shown, for example, in Figure 3d. The interaction energy is roughly an order of magnitude less than the free energy associated with the morphological transition itself (see Figure 2b), thus interaction does not perturb the domain shape significantly. Only allowing domains to rotate simplifies the interaction between two domains to a change in the boundary conditions in the three regions of interest, shown in blue in Figure 3c. Applying the small gradient approximation, the boundary slope is given by $|\epsilon-\phi|$ in the outer regions and by $|\epsilon+\phi|$ in the inner region. With the single domain boundary slope, $\epsilon$, set by the energy minimization of the previous section (i.e. eqn. 6), the pairwise energy is minimized at every domain spacing, $d$, by $\partial G/\partial\phi=0$ to find the domain tilt angle that minimizes the deformation energy (see SI for details). This results in two qualitatively distinct scenarios: two domains whose curvatures have the same sign repel each other, while two domains whose curvatures have the opposite sign attract each other. Scaling arguments can be used to show that the strength of interaction between two dimpled domains increases roughly linearly with their area, so long as they are both larger than some critical area (see SI for details). Mathematically, the assumption of rigidly rotating dimpled domains on a membrane is identical to a previous 2D model of bending- mediated interactions between intramembrane proteins represented by rigid conical inclusions [53]. Independent of the effects of spontaneous curvature, slight osmolar imbalances and constriction due to the lipid phase boundaries create small pressure gradients across the membrane that tend to orient all dimples in a cell or vesicle in the same direction, resulting in net repulsive interactions between all domains. Transitions between ‘upward’ and ‘downward’ dimples are infrequent, due to a large energy barrier. In the simplest case, where the domains are the same size, the tilt angle $\phi$ monotonically increases as two domains get closer, $\phi(d)\simeq-\epsilon e^{-d}$. Likewise, the interaction energy, $V_{\mbox{\tiny int}}(d)\simeq 2\pi\kappa_{b}\epsilon^{2}\rho_{o}^{2}e^{-d}$, increases monotonically with decreasing separation. For direct comparison, we fit both the 1D model outlined here and the 2D inclusion model [53] to the data of Fig.4, showing that they are experimentally indistinguishable, though with a slightly different elastic decay length. To quantitatively compare our interaction model with experiment, we examined the thermal motion of small domains on the surface of giant unilamellar vesicles, as described in ‘Materials and Methods.’ Membrane tension was regulated by balancing the internal and external osmolarity, giving us coarse control over the elastic decay length $\lambda_{2}$. Through time, the distance between every domain pair was measured and the net results were used to construct a histogram. The potential of mean force as a function of distance between domains is shown in Figure 4b. We selected vesicles that had a low density of approximately equal-sized domains, and thus generally the interactions were described by a repulsive pairwise potential. Though areal density of domains and generic data quality varied in our experiments (see SI), all data sets exhibit the repulsive core of the elastic interaction. Multi-body interactions occur, though infrequently; their effect can be seen as a small variation in the baseline of Figure 4b, which is not captured by the pairwise interaction model. At high membrane tension, when we would not expect dimpled domains, we qualitatively verified that domains coalesce in a rapid manner as compared to our low tension experiments (data not shown). Other recent experiments have also observed repulsive interactions between domains on low membrane tension vesicles and the lack thereof on taut vesicles [44]. Figure 4: Measuring domain interactions on the surface of a vesicle. a) Three images of dilute interacting domains on the surface of the same vesicle (scale bar is $10\,\mu\mbox{m}$). b) The repulsive interaction potential of domains on the surface of the same vesicle as (a). The energy is measured in $k_{B}T$ and distance is domain center-to-center. The blue dashed line is a fit to the 1D interaction model in this paper, $V_{\mbox{\tiny int}}(r)=a_{1}e^{-r/\lambda_{2}^{\mbox{\tiny(1D)}}}+a_{2}$, with elastic decay length $\lambda_{2}^{\mbox{\tiny(1D)}}=240\,\mbox{nm}$. The orange dashed line is a fit to the model, $V_{\mbox{\tiny int}}(r)=2\pi\kappa_{b}\left[(a_{1}a_{2})^{2}K_{0}(r/\lambda_{2}^{\mbox{\tiny(2D)}})+a_{2}^{2}a_{3}^{4}K_{2}^{2}(r/\lambda_{2}^{\mbox{\tiny(2D)}})\right]+a_{4}$, with elastic decay length $\lambda_{2}^{\mbox{\tiny(2D)}}=270\,\mbox{nm}$, based on the theory of Weikl et al [53]. Both elastic decay lengths indicate a membrane tension of $\sim 4\times 10^{-4}\,k_{B}T/\mbox{nm}^{2}$. Errors bars are shown in green on the $x$-axis. Our measurement of the pairwise potential allows us to estimate elastic properties of the membrane. The elastic decay length was fit to the 1D and 2D interactions models described above, and found to be $\lambda_{2}^{\mbox{\tiny(1D)}}\simeq 240\,\mbox{nm}$ and $\lambda_{2}^{\mbox{\tiny(2D)}}\simeq 270\,\mbox{nm}$, respectively. Taken with a nominal bending modulus of $25\,k_{B}T$, we estimate the membrane tension to be $\sim 4\times 10^{-4}\,k_{B}T/\mbox{nm}^{2}$. From the images, we measure the size of the domains at $r_{o}\simeq 350-400\,\mbox{nm}$, and hence $\rho_{o}\simeq 1.5$. We estimate the line tension, $\gamma$, using eqn. 8, based on the fact that the domains are dimpled, and find a lower bound of $\gamma\simeq 0.49\,k_{B}T/\mbox{nm}$. This is in good agreement with theoretical estimates and values determined from AFM measurements [47], though somewhat higher than the value of $\gamma\simeq 0.22\,k_{B}T/\mbox{nm}$ measured via shape analysis of fully phase separated vesicles [4] and $\gamma\simeq 0.40\,k_{B}T/\mbox{nm}$ from micropipette aspiration experiments [46]. Finally, viewing the repulsive core of the interaction as an effective activation barrier to coalescence, a simple Arrhenius argument suggests a decrease in coalescence kinetics by two to three orders of magnitude. Indeed, such a slowing of coalescence was recently observed in a similar model membrane system [44]. Discussion Comparing biologically relevant domain sizes ($\sim 50-500\,\mbox{nm}$) with the elastic decay length ($\lambda_{2}$), we expect physiologically relevant domains to be small (i.e. small $\alpha$), as presumed in eqn. 8. Estimating the elastic decay length requires knowledge of the membrane tension and bending stiffness. We note that in vitro experiments of osmotically balanced single and multicomponent vesicles, and measurements of the plasma membrane of unstressed cells suggest membrane tensions of $10^{-4}-10^{-2}\,k_{B}T/\mbox{nm}^{2}$ [4, 41, 54, 55]. The typical bending modulus of a phosphocholine bilayer is $\sim 10-50\,k_{B}T$, depending on the exact lipid and cholesterol content [41, 56, 57]. Choosing a nominal membrane tension of $10^{-4}\,k_{B}T/\mbox{nm}^{2}$ and nominal bending modulus of $25\,k_{B}T$ [41, 4] corresponds to an elastic decay length of $\lambda_{2}\simeq 500\,\mbox{nm}$, suggesting that for lipid domains on the order of $50-500\,\mbox{nm}$, small $\alpha$ is an appropriate approximation. Our experiments on the surface of GUVs have three potentially confounding effects, all due to the spherical curvature of the vesicle. First, the surface metric is not entirely flat with respect to the image plane. Thus, measurements of distance are underestimated the farther they are made from the projected vesicle center. This problem is ameliorated by concentrating on domains which are at the bottom (or top) of the vesicle where the surface is nearly flat and demanding that our tracking software exclude domains that are out of focus; see SI for a more detailed explanation. The second potential complication is that we use a flat 2D coordinate system for our theoretical analysis, however domains reside on a curved surface. Given that the domain deformation, and hence energy density, decays exponentially with $\lambda_{2}$, as long as $\lambda_{2}$ is small with respect to the vesicle radius, the energetics that govern morphology converge on an essentially flat surface metric. The final complication is that the circular area of focus creates a fictitious confining potential for the domains, such that the effective measured potential of mean force is the sum of the elastic pairwise potential and a fictitious potential, $V_{\mbox{\tiny eff}}=V_{\mbox{\tiny int}}+V_{\mbox{\tiny fict}}$. The fictitious potential is removed by simulating non-interacting particles in a circle the same size as the radius of focus (see SI for details). The constant tension ensemble used in our theoretical analysis has a range of validity, determined by the excess area available on a thermally fluctuating membrane with conserved volume and total surface area $\mathcal{A}_{o}$ (i.e. a vesicle). In the limit where the morphological transitions use only a small portion ($\Delta\mathcal{A}$) of this excess area, defined by $k_{B}T/8\pi\kappa_{b}\gg\Delta\mathcal{A}/\mathcal{A}_{o}$, the tension is constant. Outside this regime the tension rises exponentially with reduction in excess area, tending to stabilize dimples from fully budding (see SI for details). In addition to the elastic mechanism of interaction, described herein, there may be other organizing forces at work in a phase-separated membrane: those of elastic [27], entropic [58, 59] and electrostatic origin [60], however their putative length-scale, on the order of ten nanometers or less, is not accessible to the spatial and temporal resolution of our experiments, and not consistent with our measurement of an interaction length-scale of hundreds of nanometers. Conclusion We have shown that lipid domains are subject to a morphological dimpling transition that depends on the bilayer elastic properties and domain size. Dimpling allows two domains in proximity to repulsively interact due to the deformation in the surrounding membrane. Our model makes some key predictions: at zero spontaneous curvature the domain size distribution reaches a critical point where coalescence is arrested by repulsive interactions; domains with finite spontaneous curvature are always subject to interaction and hence should always coalesce at a rate slower than the diffusion-limited rate. Additionally, the strength of elastic interactions is augmented by increasing line tension or domain area, with an approximately linear scaling. The domain size and bilayer elastic parameters necessary to induce the dimpled morphology are consistent with physiological conditions. Further, careful regulation of membrane cholesterol in cells may be related to the membrane mechanical properties necessary for morphological transitions. Combined with lipid recycling, our work offers a mechanism working against diffusion-driven coalescence, to maintain fine-scale lateral heterogeneity of lipids over time. We proposed a simple 1D model of an elastic interaction that mediates dimpled- domain repulsion, and then used a standard ternary membrane system to verify the existence of dimpled domains and their subsequent repulsive interaction. Finally, it follows that the morphologies and elastic forces which organize lipid domains might play an important role in the binding and lateral organization of proteins in the membrane. Materials and Methods Giant unilamellar vesicles (GUVs) were prepared from a mixture of DOPC (1,2-Dioleoyl-sn-Glycero-3-Phosphocholine), DPPC (1,2-Dipalmitoyl-sn- Glycero-3-Phosphocholine) and cholesterol (Avanti Polar Lipids) (25:55:20/molar) that exhibits liquid-liquid phase coexistence [2]. Fluorescence contrast between the two lipid phases is provided by the rhodamine head-group labeled lipids: DOPE (1,2-Dioleoyl-sn- Glycero-3-Phosphoethanolamine-N- (Lissamine Rhodamine B Sulfonyl)) or DPPE (1,2-Dipalmitoyl-sn-Glycero-3-Phosphoethanolamine-N- (Lissamine Rhodamine B Sulfonyl)), at a molar fraction of $\sim 0.005$. The leaflet compositions are presumed symmetric and hence $\upsilon_{o}=0$. GUVs were formed via electroformation [2, 61]. Briefly, $3-4\,\mu\mbox{g}$ of lipid in chloroform were deposited on an indium-tin oxide coated slide and dessicated for $\sim 2\,\mbox{hrs}$ to remove excess solvent. The film was then hydrated with a $100\,\mbox{mM}$ sucrose solution and heated to $\sim 50\,\mbox{C}$ to be above the miscibility transition temperature. An alternating electric field was applied; $10\,\mbox{Hz}$ for 120 minutes, $2\,\mbox{Hz}$ for 50 minutes, at $\sim 500\,\mbox{Volts/m}$ over $\sim 2\,\mbox{mm}$. Low membrane tensions were achieved by careful osmolar balancing with sucrose ($\sim 100\,\mbox{mM}$) inside the vesicles, and glucose ($\sim 100-108\,\mbox{mM}$) outside. Domains were induced by a temperature quench (see SI) and imaged using standard TRITC epi-fluorescence microscopy at 80x magnification with a cooled (-30 C) CCD camera (Roper Scientific, $6.7\times 6.7\,\mu\mbox{m}^{2}$ per pixel, 20 MHz digitization). Images were taken from the top or bottom of a GUV where the surface metric is approximately flat (see SI). Data sets contained $\sim 500-1500$ frames collected at 10-20 Hz with a varying number of domains (usually $5-10$). The frame rate was chosen to minimize exposure-time blurring of the domains, while allowing sufficiently large diffusive domain motion. Software was written to track the position of each well-resolved domain and calculate the radial distribution function. The raw radial distribution function was corrected for the fictitious confining potential of the circular geometry (see SI). In the dilute interaction limit, pairwise interactions dominate, and the negative natural logarithm of the radial distribution function is the interaction potential (potential of mean force) plus a constant, as shown in Figure 4b. We thank Patricia Bassereau, Ben Freund, Kerwyn Huang, Greg Huber, Sarah Keller and Udo Seifert for stimulating discussion and comments on the manuscript, and Jenny Hsaio for help with experiments. TU and RP acknowledge the support of the National Science Foundation award No. CMS-0301657, NSF CIMMS award No. ACI-0204932, NIRT award No. CMS-0404031 and the National Institutes of Health Director’s Pioneer Award. WK acknowledges support from NSF CAREER Award CMMI-0748034. ## References * [1] Singer SJ and Nicolson GL (1972). Science, 175:720–31. * [2] Veatch SL and Keller SL (2003). Biophys J, 85:3074–83. * [3] Bacia K, Schwille P, and Kurzchalia T (2005). Proc Natl Acad Sci U S A, 102:3272–7. * [4] Baumgart T, Hess ST, and Webb WW (2003). Nature, 425:821–4. * [5] Simons K and Ikonen E (1997). Nature, 387:569–72. * [6] Sens P and Turner MS (2006). Phys Rev E, 73:031918. * [7] Raucher D and Sheetz MP (1999). Biophys J, 77:1992–2002. * [8] Simons K and Vaz WL (2004). Annu Rev Biophys Biomol Struct, 33:269–95. * [9] Schlegel A, Volonte D, Engelman JA, Galbiati F, Mehta P, Zhang XL, Scherer PE, and Lisanti MP (1998). Cell Signal, 10:457–63. * [10] van Meer G and Sprong H (2004). Curr Opin Cell Biol, 16:373–8. * [11] Chazal N and Gerlier D (2003). Microbiol Mol Biol Rev, 67:226–37. * [12] Mayor S and Rao M (2004). Traffic, 5:231–40. * [13] Dietrich C, Bagatolli LA, Volovyk ZN, Thompson NL, Levi M, Jacobson K, and Gratton E (2001). Biophys J, 80:1417–28. * [14] Park H, Go YM, St John PL, Maland MC, Lisanti MP, Abrahamson DR, and Jo H (1998). J Biol Chem, 273:32304–11. * [15] Helms JB and Zurzolo C (2004). Traffic, 5:247–54. * [16] Lucero HA and Robbins PW (2004). Arch Biochem Biophys, 426:208–24. * [17] Gaus K, Gratton E, Kable EP, Jones AS, Gelissen I, Kritharides L, and Jessup W (2003). Proc Natl Acad Sci U S A, 100:15554–9. * [18] Bray AJ (2002). Adv Phys, 51:481–587. * [19] Turner MS, Sens P, and Socci ND (2005). Phys Rev Lett, 95:168301. * [20] Gheber LA and Edidin M (1999). Biophys J, 77:3163–75. * [21] Dietrich C, Yang B, Fujiwara T, Kusumi A, and Jacobson K (2002). Biophys J, 82:274–84. * [22] Murase K, Fujiwara T, Umemura Y, Suzuki K, Iino R, Yamashita H, Saito M, Murakoshi H, Ritchie K, and Kusumi A (2004). Biophys J, 86:4075–93. * [23] Sagui C and Desai RC (1995). Phys Rev Lett, 74:1119–1122. * [24] Laradji M and Sunil Kumar PB (2004). Phys Rev Lett, 93:198105. * [25] Seul M and Andelman D (1995). Science, 267:476–483. * [26] Sagui C and Desai RC (1994). Phys Rev E, 49:2225–2244. * [27] Kuzmin PI, Akimov SA, Chizmadzhev YA, Zimmerberg J, and Cohen FS (2005). Biophys J, 88:1120–33. * [28] Seul M, Morgan NY, and Sire C (1994). Phys Rev Lett, 73:2284–2287. * [29] Foret L (2005). Europhys Lett, 71:508–514. * [30] Harden JL, Mackintosh FC, and Olmsted PD (2005). Phys Rev E, 72:011903. * [31] Taniguchi T (1996). Phys Rev Lett, 76:4444–4447. * [32] Gozdz WT and Gompper G (2001). Europhys Lett, 55:587–593. * [33] Reigada R, Buceta J, and Lindenberg K (2005). Phys Rev E, 71:051906. * [34] Laradji M and Kumar PB (2006). Phys Rev E, 73:040901. * [35] Freund LB and Suresh S. Thin Film Materials: Stress, Defect Formation and Surface Evolution. Cambridge University Press, 2004. * [36] Boal D. Mechanics of the Cell. Cambridge University Press, 1st edition, 2002. * [37] Wiggins P and Phillips R (2005). Biophys J, 88:880–902. * [38] Parthasarathy R, Yu CH, Groves JT (2006). Langmuir, 22:5095–5099. * [39] Helfrich W (1973). Z Naturforsch [C], 28:693–703. * [40] Farsad K and De Camilli P (2003). Curr Opin Cell Biol, 15:372–81. * [41] Rawicz W, Olbrich KC, McIntosh T, Needham D, and Evans E (2000). Biophys J, 79:328–39. * [42] Simons K and Ikonen E (2000). Science, 290:1721–6. * [43] Lange Y, Ye J, and Steck TL (2004). Proc Natl Acad Sci U S A, 101:11664–7. * [44] Yanagisawa M, Imai M, Masui T, Komura S, and Ohta T (2007). Biophys J, 92:115–25. * [45] Lipowsky R (1992). J Phys II Fr, 2:1925–1840. * [46] Tian A, Johnson C, Wang W, and Baumgart T (2007). Phys Rev Lett, 98:208102. * [47] Garcia-Saez AJ, Chiantia S, and Schwille P (2007). J Biol Chem, 282:33537–33544. * [48] Wang W, Yang L, and Huang HW (2007). Biophys J, 92:2819–30. * [49] McMahon HT and Gallop JL (2005). Nature, 438:590–6. * [50] Baumgart T, Hammond AT, Sengupta P, Hess ST, Holowka DA, Baird BA, and Webb WW (2007). Proc Natl Acad Sci U S A, 104:3165–70. * [51] Huang KC, Mukhopadhyay R, and Wingreen NS (2006). PLoS Comput Biol, 2. * [52] Hansen SH, Sandvig K, and van Deurs B (1992). Exp Cell Res, 199:19–28. * [53] Weikl TR, Kozlov MM, and Helfrich W (1998). Phys Rev E, 57:6988–6995. * [54] Morris CE and Homann U (2001). J Membr Biol, 179:79–102. * [55] Popescu G, Ikeda T, Goda K, Best-Popescu CA, Laposata M, Manley S, Dasari RR, Badizadegan K, and Feld MS (2006). Phys Rev Lett, 97:218101. * [56] Chen Z and Rand RP (1997). Biophys J, 73:267–76. * [57] Henriksen J, Rowat AC, and Ipsen JH (2004). Eur Biophys J, 33:732–41. * [58] Dean DS and Manghi M (2006). Phys Rev E, 74:021916. * [59] Goulian M, Pincus P, and Bruinsma R (1993). Europhys Lett, 22:145–150. * [60] Liu J, Qi S, Groves JT, and Chakraborty AK (2005). J Phys Chem B, 109:19960–9. * [61] Angelova MI, Soleau S, Meleard P, Faucon JF, and Bothorel P (1992). Progr Colloid Polym Sci, 89:127–131.
arxiv-papers
2009-04-08T15:15:09
2024-09-04T02:49:01.793893
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Tristan S. Ursell, William S. Klug, Rob Phillips", "submitter": "Tristan Ursell", "url": "https://arxiv.org/abs/0904.1356" }
0904.1391
# Coronal Loop Models and Those Annoying Observations! James A. Klimchuk ###### Abstract It was once thought that all coronal loops are in static equilibrium, but observational and modeling developments over the past decade have shown that this is clearly not the case. It is now established that warm ($\sim 1$ MK) loops observed in the EUV are explainable as bundles of unresolved strands that are heated impulsively by storms of nanoflares. A raging debate concerning the multi-thermal versus isothermal nature of the loops can be reconciled in terms of the duration of the storm. We show that short and long storms produce narrow and broad thermal distributions, respectively. We also examine the possibility that warm loops can be explained with thermal nonequilibrium, a process by which steady heating produces dynamic behavior whenever the heating is highly concentrated near the loop footpoints. We conclude that this is not a viable explanation for monolithic loops under the conditions we have considered, but that it may have application to multi- stranded loops. Serious questions remain, however. NASA Goddard Space Flight Center, Code 671, Greenbelt, MD 20771, USA ## 1\. Introduction The unusual title of this paper is meant to indicate the emotional aspects of being a coronal loops modeler. Whenever we start to feel confident that the problem is solved, new observations come along and force us to modify our thinking. It can be frustrating, but it is also very rewarding when we gain improved physical understanding of this fascinating phenomenon. The coronal loops problem is an outstanding example of how the greatest progress is made when observation and theory work together, one feeding off of the other. The loops problem can be thought of as a puzzle, with the pieces of the puzzle being observational constraints. The goal is to fit the pieces together into a physically consistent picture (there may be more than one solution). Five key pieces are: (1) density, (2) lifetime, (3) thermal distribution, (4) flows, and (5) intensity profile. For the density, we are particularly interested in how the observed density compares with the density that is expected for static equilibrium. Thermal distribution refers to whether and how the temperature varies over the loop cross section, i.e., across the loop axis, and intensity profile refers to the variation of brightness along the loop axis. For many years, our picture of coronal loops was relatively simple and the puzzle seemed easy to solve. The observational constraints came primarily from soft X-ray (SXR) observations of hot ($>2$ MK) loops. These loops were found to be long-lived (e.g., Porter & Klimchuk 1995) and to satisfy static equilibrium scaling laws (e.g., Rosner, Tucker, & Vaiana 1978; Kano & Tsuneta 1996). The most straightforward explanation was that these loops are heated in a steady fashion. The picture became much more confused with new observations of warm ($\sim 1$ MK) loops made in the EUV by SOHO/EIT and TRACE. These warm loops can appear to occupy the same volume as hot loops—though not necessarily at the same time—but their properties are fundamentally different. Besides the obvious temperature difference, EUV loops are over dense relative to static equilibrium, they have super-hydrostatic scale heights, and they have exceptionally flat temperature profiles when measured with the filter ratio technique (e.g., Aschwanden et al. 1999; Lenz et al. 1999; Aschwanden, Schrijver, & Alexander 2001; Winebarger, Warren, & Mariska 2003). These loops are clearly not in static equilibrium. This paper describes the logical progression that has been followed by the loops community in attempting to explain the observations, especially those of the more challenging EUV loops. We represent this progression with the flowchart in Figure 1, which is in many ways a recent history of how the discipline has evolved. Figure 1.: Flow chart showing the logical progression used to infer the physical nature and heating of a coronal loop. Some boxes indicate observational questions and others indicate conclusions that are drawn from the answers. ## 2\. Density Suppose we wish to investigate an observed loop. We can start by asking the question “Is the loop over dense relative to static equilibrium?” Given the observed temperature and length, static equilibrium theory predicts a unique density. We want to know whether the observed density is larger than this value? If it is not, and if the loop does not evolve rapidly, then steady heating is a possible, though not unique, explanation. This was essentially where things stood through the Yohkoh mission in the 1990’s. As we have already indicated, however, most EUV loops are indeed over dense. This is indicated in Figure 2 (reproduced from Klimchuk 2006), which reveals the physics of what is going on. The figure shows the ratio of the radiative to conductive cooling times plotted against temperature for a large sample of loops. The warm loops were observed by TRACE, and the hot loops were observed by Yohkoh/SXT. The ratio of the cooling times is determined from the measured temperature, density, and length according to $\tau_{rad}/\tau_{cond}=T^{4}/(n^{2}L^{2})$, although the power of temperature depends weakly on the radiative loss function and is slightly different in different temperature regimes. Figure 2.: Ratio of radiative to conductive cooling times versus temperature for many observed loops. Solid line is the cooling track of an impulsively heated loop strand simulation. From Klimchuk (2006). Coronal energy losses from radiation and thermal conduction are comparable for loops that are in static equilibrium (Vesecky, Antiochos, & Underwood 1979), and such loops would fall along a horizontal line near 0 in the plot. Loops that lie above the line are under dense, and loops that lie below the line are over dense. The observed loops follow a clear trend ranging from hot and under dense in the upper-right to warm and over dense in the lower-left. Note, however, that the densities used for the cooling time ratios were measured using emission measures and loop diameters and assuming a filling factor of unity, $n=[EM/(df)]^{1/2}$, so they are lower limits. Smaller filling factors would shift the points downward in the plot. Thus, the hot loops could be in static equilibrium, and the warm loops could be even more over dense than indicated. It is abundantly clear that static equilibrium cannot explain warm loops. An explanation relying on steady end-to-end flows is also not viable (Patsourakos, Klimchuk, & MacNeice 2004). Thermal nonequilibrium is a possibility that we return to later. The most promising explanation for the observed over densities of warm loops is implusive heating. This can also explain the under densities of hot loops, if they are real. The solid curve that fits the points so well in Figure 2 is the evolutionary track from a 1D hydrodynamic simulation of a loop that has been heated impulsively by a nanoflare. Cooling begins at the upper-right end of the track and progresses downward and to the left. The early stages are dominated by thermal conduction and are characterized by under densities, while the late stages are dominated by radiation and are characterized by over densities. The ability of nanoflare models to reproduce the observed densities of loops is well established (Klimchuk 2002; Warren, Winebarger, & Hamilton 2002; Winebarger, Warren, & Mariska 2003; Cargill & Klimchuk 2004; Klimchuk 2006). ## 3\. Lifetime If a loop is heated impulsively, then we might expect it to exist for approximately a cooling time (combining the effects of conduction and radiation), as determined from the observed temperature, density, and length. This is the next question in the flowchart. If the lifetime and cooling time are similar, we can conclude that the loop is a monolithic structure that heats and cools as a homogeneous unit, with uniform temperature over the cross section. Observations show that this is not case, however. The vast majority of loops live longer than a cooling time and sometimes much longer (e.g., Winebarger, Warren, & Seaton 2003; López Fuentes, Klimchuk, & Mandrini 2007). If these loops contain cooling plasma, then they cannot be monolithic. Rather, they must be bundles of thin, unresolved strands that are heated impulsively at different times. Although each strand cools rapidly, the composite bundle appears to evolve slowly (e.g., Winebarger, Warren, & Mariska 2003). Multi- stranded bundles of this type can explain a number of observed properties of warm loops: over density, long lifetime, super-hydrostatic scale height, and flat temperature profile. They can also explain the observed under density of hot loops. Realizing this was a time of rejoicing in the modeling community! But…. ## 4\. Thermal Distribution An important prediction of the multi-strand model is that loops should have multi-thermal cross-sections. Since the unresolved strands are heated at different times, they will be in different stages of cooling and out of phase with each other. A critical question became “Are loops multi-thermal?” An intense debate ensued and continues to this day. Some have answered with a resounding yes (the “Schmelz camp,” e.g., Schmelz & Martens 2006) and others have answered with a resounding no (the “Aschwanden camp,” e.g., Aschwanden & Nightingale 2005). As we now demonstrate, however, it is not especially useful to phrase the multi-thermal question in a way that requires a binary response. Imagine that a loop bundle is heated by a “storm” of nanoflares that occur randomly over a finite window in time. It is easy to see that the range of strand temperatures that are present at any given moment depends on the duration of the storm. For a very short storm, all of strands will be heated at about the same time and will cool together. The instantaneous thermal distribution of the loop will be narrow. In contrast, a storm that lasts longer than a cooling time will produce a much wider thermal distribution. Some strands will have just been heated and will be very hot; others will have cooled to intermediate temperatures; and still others will have had time to cool to much lower temperatures. The flowchart in Figure 1 therefore asks the more meaningful question “How multi-thermal is the loop?” A broad thermal distribution implies a long-duration nanoflare storm, and a narrow distribution implies a short-duration storm. It now appears that the multi- thermal and isothermal camps may both be correct. The duration of the nanoflare storm also determines the lifetime of the loop bundle, so the thermal width and lifetime will be closely related. Figure 3 shows results for simulated nanoflare storms lasting 500, 2500, and 5000 s, top to bottom. The left column has light curves (intensity versus time) as would be observed in the 195 channel of TRACE, with sensitivity peaking near 1 MK. The right column has emission measure distributions, EM($T$) = $T\times\\!$DEM($T$) cm-5, at the time of peak 195 intensity. Only the coronal part of the loop is included; the transition region footpoints are neglected. All three of the storms are comprised of identical nanoflares that have triangular heating profiles lasting 500 s. They were simulated with our “0D” hydro code EBTEL and are the same as example 4 in Klimchuk, Patsourakos, & Cargill (2008). In actuality, Figure 3 was produced with only one simulation. The light curves and EM distributions were constructed using sliding time windows that correspond to the storm durations. Figure 3.: Simulated 195 light curves (left) and emission measure distributions (right) for nanoflare storms lasting 500, 2500, and 5000 s, top to bottom. The instantaneous EM distributions are from the times of peak 195 intensity (t = 3958, 4705, 5445 s for the three storms). As expected, both the lifetime and thermal width increase as the storms get longer. The full widths at half maximum (FWHM) of the light curves are 1098, 2579, and 5008 sec for the 500, 2500, and 5000 s storms, respectively. The FWHM of the EM distributions are 0.13, 0.23, and 0.36 in $\log T$. The full widths at the 1% levels are 0.24, 0.62, and 1.14 in $\log T$. It may seem surprising at first that the EM distributions do not all reach the same maximum temperature, since the nanoflares are the same in all three storms. This is not because individual strands are reheated multiple times in the longer storms; all strands are heated only once. Rather, it is because the distributions are from the time of peak 195 intensity. In the short duration storm, all of the strands have cooled appreciably by the time the peak intensity is reached. Had we chosen to plot the distribution at an earlier time, it would still been narrow, but it would be shifted to higher temperature. Warren et al. (2008) have made Gaussian fits to EM distributions observed by Hinode/EIS. They find a typical central temperature of 1.4 MK and a typical Gaussian half width of 0.3 MK. This corresponds to a FWHM in $\log T$ of roughly 0.24, which by Figure 3 implies a 195 lifetime of roughly 2500 s. Although Warren et al. did not measure the lifetimes of their loops, this value is consistent with the small number of 195 lifetimes that have been reported for other cases (Winebarger & Warren 2005; Ugarte-Urra, Winebarger, & Warren 2006). To our knowledge, there does not exist a single published example where both the thermal width and lifetime have been measured for the same loop. Making such measurements should be a high priority. It is a crucial consistency check of the nanoflare concept. Density measurements should be made at the same time. ## 5\. Very Hot and Very Faint Plasma The nanoflare model makes two observational predictions in addition to the ones we have already discussed. First, it predicts that small amounts of very hot ($>5$ MK) plasma should be present. Figure 4 shows two examples of long (infinite) duration storms, one comprised of relatively weak nanoflares and the other comprised of nanoflares that are ten times stronger. The solid curve in each case is the EM distribution for the whole loop, while the dashed and dot-dashed curves are the contributions from the coronal section and footpoints, respectively. We see that the EM of the hottest plasma is 1.5-2 orders of magnitude smaller than that of the most prevalent plasma. The reason is two-fold. First, the initial cooling after the nanoflare has occurred is very rapid, so the hottest plasma persists for a relatively brief period. Second, the densities are low during this early phase, because chromospheric evaporation has only just begun to fill the loop strand with plasma. Figure 4.: Emission measure distributions for long (infinite) duration nanoflare storms comprised of weak (left) and strong (right) nanoflares: coronal section (dashed), transition region footpoints (dot-dashed), and whole loop (solid). As a consequence of the small emission measures, the intensities of hot spectral lines and channels are predicted to be very faint. The intensities may be reduced still further by ionization nonequilibrium effects (Bradshaw & Cargill 2006; Reale & Orlando 2008). Low levels of super-hot emission have nonetheless been detected recently by the CORONAS, RHESSI, and Hinode missions (Zhitnik et al. 2006; McTiernan 2009; Patsourakos & Klimchuk 2009; Ko et al. 2009). In particular, EM distributions inferred from multi-filter XRT observations of two active regions suggest that the distributions may have two distinct components (Schmelz et al. 2009; Reale et al. 2009). The implications are considerable, since this would rule out a simple power-law energy distribution for the responsible nanoflares. Detailed modeling is now underway. ## 6\. Flows High-speed upflows that reach or exceed 100 km s-1 are predicted during the early evaporation phase of a nanoflare event. Depending on the geometry of the observations, these can produce highly blue-shifted emission. The emission will be very faint, however, for the reasons given above. A composite spectral line profile from a bundle of unresolved strands will be dominated by the weakly red-shifted emission produced during the much longer radiative cooling phase, when the plasma slowly drains and condenses back onto the chromosphere. Signatures of evaporation take the form of blue wing enhancements on this main component (Patsourakos & Klimchuk 2006). They can be very subtle, and they only appear in lines that are well tuned to the temperature of the evaporating plasma. Significantly hotter and cooler lines are not expected to show evidence of evaporation. We have performed sit-and-stare observations with Hinode/EIS and find blue wing asymmetries in Fe XVII ($T\approx 5$ MK) similar to those predicted by our nanoflare models (Patsourakos & Klimchuk 2006). The measurements are very challenging, however, due to the faint nature of the line. Hara et al. (2008) also report blue-wing asymmetries that are suggestive of nanoflares. ## 7\. Thermal Nonequilibrium We have worked our way down the flowchart of Figure 1 and concluded that the observed properties of many loops can be explained by storms of nanoflares occurring within bundles of unresolved strands. There remains the possibility, indicated in the upper right, that many loops can also be explained by thermal nonequilibrium. We consider this possibility now. Thermal nonequilibrium is a fascinating phenomenon in which dynamic behavior is produced by perfectly steady heating (Antiochos & Klimchuk 1991; Karpen et al. 2001; Mueller, Peter, & Hansteen 2004; Karpen, Antiochos, & Klimchuk 2006). No equilibrium exists if the steady heating is sufficiently highly concentrated near the loop footpoints. Instead, the loop goes through periodic convulsions as it searches for a nonexistent equilibrium. Cold, dense condensations form, slide down the loop leg, and later reform in a cycle that repeats with periods of several tens of minutes to several hours. We have recently explored whether thermal nonequilibrium can explain the observed properties of EUV loops (Klimchuk & Karpen 2009). We first considered a monolithic loop, which we simulated with our 1D hydro code ARGOS (Antiochos et al. 1999). The code uses adaptive mesh refinement, which is critical for resolving the thin transition regions that exist on either side of the dynamic condensations. We imposed a steady heating that decreases exponentially with distance from both footpoints. The heating scale length of 5 Mm is one- fifteenth of loop halflength. We introduced a small asymmetry by making the amplitude of the heating on the right side only 75% that on the left. Figure 5 shows the evolution of temperature, density, and intensity as would be observed in the 171 channel of TRACE. These are averages over the upper 80% of the loop. The behavior is typical of the several cycles that we simulated. The loop is visible in 171 for only about 1000 s. This is a factor of 2-4 shorter than observed lifetimes (Winebarger & Warren 2005; Ugarte-Urra, Winebarger, & Warren 2006). A more serious problem is the distribution of emission along the loop (the intensity profile), which disagrees dramatically with observations. Figure 6 shows 171 intensity and temperature as a function of position along the loop at $t=5000$ s. The emission is strongly concentrated in transition region layers at the loop footpoints ($s=45$ and $203$ Mm) and to either side of a cold condensation at $s=163$ Mm. In stark contrast, most observed 171 loops have a fairly uniform brightness along their length. Figure 5.: Evolution of temperature (dashed), density (dotted), and 171 intensity (solid) for a monolithic loop undergoing thermal nonequilibrium. All quantities are normalized. The steady heating is 75% as strong in the right leg as in the left. Figure 6.: Temperature (dashed, MK) and 171 intensity (solid, arbitrary units) as a function of position along the loop at $t=5000$ s in the simulation of Figure 5. The maximum temperature in the loop is 4.4 MK and occurs before the condensation forms. We performed another simulation with a reduced heating rate that has a maximum temperature of only 1.8 MK. Neither the light curve nor the intensity profile are consistent with observations. We conclude that EUV loops are not monolithic structures undergoing thermal nonequilibrium, at least not under conditions that lead to cold condensations. We note, however, that Mok et al. (2008) report a different type of nonequilibrium behavior. One prominent loop in their 3D simulation of an active region exhibits a cooling and heating cycle, but the temperature never drops to the point where a condensation forms. The reasons for the differing behavior are yet to be understood. Whether the loop has properties matching observed loops (density, lifetime, thermal width) is unknown. The simulation of Figures 5 and 6 may nonetheless have some relevance to the Sun. The condensation falls onto the right footpoint at $t=5600$ s. Falling condensations have been seen in the C IV channel of TRACE (Schrijver 2001). They are relatively rare, however, and occur in only a small fraction of loops. We next considered the possibility of a multi-stranded loop bundle in which the individual strands undergo thermal nonequilibrium in an out-of-phase fashion. To approximate such a loop, we performed two additional simulations, similar to the first but with heating imbalances of 50% and 90% instead of 75%. We then averaged all three simulations in time and added them together along with their mirror images to form a composite loop. The resulting 171 intensity profile is shown in Figure 7. It is reasonably uniform except for the very intense spikes at the footpoints (note the logarithmic scale). A more realistic loop bundle with a wider variety of heating imbalances would be even more uniform. We tentatively conclude that the intensity profile is consistent with observations, although we are concerned because bright 171 moss emission is generally observed at the footpoints of SXR loops rather than the footpoints of EUV loops. Figure 7.: Logarithm of 171 intensity as a function of position along a composite loop bundle comprised of individual strands undergoing thermal nonequilibrium. See text for details. Figure 8.: Temperature as a function of position along the composite loop bundle of Figure 7. Solid is the actual mean temperature, while dashed and dotted are the temperatures inferred from TRACE and Yohkoh/SXT filter ratios, respectively. Figure 8 shows three temperature profiles for the composite loop: the average of the actual temperatures in the individual strands (solid), the temperature that would be inferred from TRACE 171/195 intensity ratios (dashed), and the temperature that would be inferred from Yohkoh/SXT Al12/AlMg intensity ratios (dotted). They are different because Yohkoh/SXT is more sensitive to the hotter plasma and TRACE is more sensitive to the warmer plasma. Notice that the profiles is very flat. This is a well-know property of EUV loops. We have also inferred densities from the simulated TRACE observations using exactly the same procedure that was used for the real loops in Figure 2. The model loop is over dense by a factor of 23, consistent with observed values. We have repeated this excise using reduced heating in the strands and find that the over density is a factor of 10 in this case. Although there is some reason for encouragement, it is not obvious that bundles of unresolved strands undergoing thermal nonequilibrium can explain all the salient properties of observed EUV loops. Reproducing the lifetimes is especially challenging. The condensations in the different strands must be sufficiently out of phase to give a uniform intensity profile, but they cannot be so out of phase as to produce a composite loop lifetime longer than 1 hour. Even if the phasing is correct for one condensation cycle, it is likely to be incorrect for subsequent cycles because the interval between condensations depends on both the amplitude of the heating and its left-right imbalance. The imbalance determines the location where the condensation forms, and it must be appreciably different among the strands in order to get a uniform intensity profile. Note that the results shown in Figures 7 and 8 make use of temporal averages over complete cycles, and therefore the lifetime of the equivalent loop bundle is effectively infinite. ## 8\. Conclusions We have described how a combination of observational and modeling work has led to the conclusion that warm ($\sim 1$ MK) EUV loops can be explained as bundles of unresolved strands that are heated by storms of nanoflares. Static equilibrium is out of the question. The observed lifetimes and thermal distributions of the plasma indicate that the storms last for typically 2-4$\times 10^{3}$ s. Additional support for this picture is provided by the shapes of hot spectral line profiles and by the observation that line intensities peak at slightly later times for lines of progressively cooler temperature (Ugarte-Urra, Warren, & Brooks 2009). Also, there is now good evidence for very hot and very faint plasma, as predicted by the nanoflare models. It is not clear whether most hot ($>2$ MK) SXR loops are also heated by nanoflares. If they are, the storms must be long duration in order to explain the observed lifetimes. The loops would then be expected to have co-spatial EUV counterparts, and it is not obvious that they do. One possibility is that the frequency of nanoflares is much higher in long-lived SXR loops, so that the plasma in a strand never cools to EUV temperatures before being reheated. It is worth noting that virtually all of the proposed coronal heating mechanisms predict impulsive energy release on individual magnetic field lines (Klimchuk 2006). We considered the possibility that EUV loops can be explained by thermal nonequilibrium. We concluded that this is not a viable mechanism for monolithic loops under the conditions we have considered—although the results of Mok et al. (2008) are very intriguing—but that it may have application in multi-stranded bundles. Serious questions remain that require further investigation. We close by pointing out that distinct loops are only one component of the corona and that the diffuse component contributes at least as much emission. It is not generally appreciated that the intensity of EUV and SXR loops is typically much less than that of the background (of order 10-40%). The diffuse component may also be made up of individual strands, but we must explain why the strands have a higher concentration in loops. ### Acknowledgments. I am very pleased to acknowledge useful discussions with many people, but I especially wish to thank Spiros Patsourakos, Harry Warren, and Judy Karpen, my collaborator on the thermal nonequilibrium study that is being published here for the first time. I benefited greatly from participation in the Coronal Loops Workshop Series and the International Space Science Institute team led by Susanna Parenti. Financial support came primarily from the NASA Living With a Star program. ## References * Antiochos & Klimchuk (1991) Antiochos, S. K., & Klimchuk, J. A. 1991, ApJ, 378, 372 * Antiochos et al. (1999) Antiochos, S. K., MacNeice, P. J., Spicer, D. S.,& Klimchuk, J. A. 1999, ApJ, 512, 985 * Aschwanden & Nightingale (2005) Aschwanden, M. J., & Nightingale, R. W. 2005, ApJ, 633, 499 * Aschwanden, Schrijver, & Alexander (2001) Aschwanden, M. J., Schrijver, C. J., & Alexander, D. 2001, ApJ, 550, 1036 * Aschwanden et al. (1999) Aschwanden, M. J., Newmark, J. S., Delaboudiniere, J. P., Neupert, W. M., Klimchuk, J. A., Gary, G. A., Portier-Fornazzi, F., & Zucker, A. 1999, ApJ, 515, 842 * Bradshaw & Cargill (2006) Bradshaw, S. J. & Cargill, P. J. 2006, A&A, 458, 987 * Cargill & Klimchuk (2004) Cargill, P. J. & Klimchuk, J. A. 2004, ApJ, 605, 911 * Hara et al. (2008) Hara, H. et al. 2008, ApJ(Lett), 678, L67 * Kano & Tsuneta (1996) Kano, R., & Tsuneta, S. 1996, PASJ, 48, 535 * Karpen et al. (2001) Karpen, J. T., Antiochos, S. K., Hohensee, M., Klimchuk, J. A., & MacNeice, P. J. 2001, ApJ(Lett), 553, L85 * Karpen, Antiochos, & Klimchuk (2006) Karpen, J. T., Antiochos, S. K., & Klimchuk, J. A. 2006, ApJ, 637, 531 * Klimchuk (2002) Klimchuk, J. A. 2002, in ITP Conf. on Solar Magnetism and Related Astrophysics, U. California Santa Barbara, ed. G. Fisher and D. Longcope (http://online.kitp.ucsb.edu/online/solar_c02/klimchuk/). * Klimchuk (2006) Klimchuk, J. A. 2006, Solar Phys., 234, 41 * Klimchuk & Karpen (2009) Klimchuk, J. A., & Karpen, J. T. 2009, in preparation * Klimchuk, Patsourakos, & Cargill (2008) Klimchuk, J. A., Patsourakos, S., & Cargill, P. J. 2008, ApJ, 682, 1351 * Ko et al. (2009) Ko, Y.-K. et al. 2009, ApJ, submitted * Lenz et al. (1999) Lenz, D. D., DeLuca, E. E., Golub, L., Rosner, R., & Bookbinder, J. A. 1999, ApJ, 517, L15 * López Fuentes, Klimchuk, & Mandrini (2007) López Fuentes, M. C., Klimchuk, J. A., & Mandrini, C. H. 2007, ApJ, 657, 1127 * McTiernan (2009) McTiernan, J. M. 2009, ApJ, submitted * Mok et al. (2008) Mok, Y., Mikić, Z., Lionello, R., & Linker, J. A. 2008, ApJ(Lett), 679, L161 * Mueller, Peter, & Hansteen (2004) Mueller, D. A. N., Peter, H., & Hansteen, V. H. 2004, A&A, 424, 289 * Patsourakos, Klimchuk, & MacNeice (2004) Patsourakos, S., Klimchuk, J. A., & MacNeice, P. J. 2004, ApJ, 603, 322 * Patsourakos & Klimchuk (2006) Patsourakos, S., & Klimchuk, J. A. 2006, ApJ, 647, 1452 * Patsourakos & Klimchuk (2009) Patsourakos, S., & Klimchuk, J. A. 2009, ApJ, in press * Porter & Klimchuk (1995) Porter, L. J., & Klimchuk, J. A. 1995, ApJ, 454, 499 * Reale & Orlando (2008) Reale, F. & Orlando, S. 2008, ApJ, 284, 715 * Reale et al. (2009) Reale, F., Testa, P., Klimchuk, J. A., & Parenti, S. 2009, ApJ, submitted * Rosner, Tucker, & Vaiana (1978) Rosner, R., Tucker, W. H., & Vaiana, G. S. 1978, ApJ, 220, 643 * Schmelz & Martens (2006) Schmelz, J. T., & Martens, P. C. H. 2006, ApJ(Lett), 636, L49 * Schmelz et al. (2009) Schmelz, J. T. et al. 2009, ApJ(Lett), in press * Schrijver (2001) Schriver, C. J. 2001, Solar Phys., 198, 325 * Ugarte-Urra, Warren, & Brooks (2009) Ugarte-Urra, I., Warren, H. P., & Brooks, D. H. 2009, ApJ, in press * Ugarte-Urra, Winebarger, & Warren (2006) Ugarte-Urra, I., Winebarger, A. R., & Warren, H. P. 2006, ApJ, 643, 1245 * Vesecky, Antiochos, & Underwood (1979) Vesecky, J. F., Antiochos, S. K., & Underwood, J. H. 1979, ApJ, 233, 987 * Warren et al. (2008) Warren, H. P., Ugarte-Urra, I., Doschek, G. A., Brooks, D. H., & Williams, D. R. 2008, ApJ(Lett), 686, L131 * Warren, Winebarger, & Hamilton (2002) Warren, H. P., Winebarger, A. R., & Hamilton, P. S. 2002, ApJ (Lett), 579, L41 * Warren, Winebarger, & Mariska (2003) Warren, H. P., Winebarger, A. R., & Mariska, J. T. 2003, ApJ, 593, 1174 * Winebarger & Warren (2005) Winebarger, A. R., & Warren, H. P. 2005, ApJ, 626, 543 * Winebarger, Warren, & Mariska (2003) Winebarger, A. R., Warren, H. P., & Mariska, J. T. 2003, ApJ, 587, 439 * Winebarger, Warren, & Seaton (2003) Winebarger, A. R., Warren, H. P., & Seaton, D. B. 2003, ApJ, 593, 1164 * Zhitnik et al. (2006) Zhitnik, I. A. et al. 2006, Solar System Research, 40, 272
arxiv-papers
2009-04-08T17:47:08
2024-09-04T02:49:01.800728
{ "license": "Public Domain", "authors": "James A. Klimchuk", "submitter": "James Klimchuk", "url": "https://arxiv.org/abs/0904.1391" }
0904.1425
# N-body simulations for testing the stability of triaxial galaxies in MOND Xufen Wu1,HongSheng Zhao1,2,Yougang Wang3,Claudio Llinares4,Alexander Knebe4,5 1SUPA, University of St Andrews, North Haugh, Fife, KY16 9SS, UK 2Sterrewacht Leiden, P.O. Box 9513, 2300 RA Leiden, Netherlands 3National Astronomical Observatories, Chinese Academy of Sciences, Beijing, 100012, P.R. China 4Astrophysikalisches Institut Potsdam, An der Sternwarte 16, D-14482 Potsdam 5Departamento de Física Teórica, Módulo C-XI, Univ. Autónoma de Madrid, E-28049 Madrid, Spain ###### Abstract We perform a stability test of triaxial models in MOdified Newtonian Dynamics (MOND) using N-body simulations. The triaxial models considered here have densities that vary with $r^{-1}$ in the center and $r^{-4}$ at large radii. The total mass of the model varies from $10^{8}M_{\odot}$ to $10^{10}M_{\odot}$, representing the mass scale of dwarfs to medium-mass elliptical galaxies, respectively, from deep MOND to quasi-Newtonian gravity. We build triaxial galaxy models using the Schwarzschild technique, and evolve the systems for 200 Keplerian dynamical times (at the typical length scale of 1.0 kpc). We find that the systems are virial overheating, and in quasi- equilibrium with the relaxation taking approximately 5 Keplerian dynamical times (1.0 kpc). For all systems, the change of the inertial (kinetic) energy is less than 10% (20%) after relaxation. However, the central profile of the model is flattened during the relaxation and the (overall) axis ratios change by roughly 10% within 200 Keplerian dynamical times (at 1.0kpc) in our simulations. We further find that the systems are stable once they reach the equilibrium state. ###### keywords: galaxies: kinematics and dynamics- methods: N-body simulations ## 1 Introduction Elliptical galaxies are often triaxial and appear stable. A triaxial equilibrium is non-trivial to build dynamically especially for a system with a cuspy profile of the light and/or the dark halo. The main objective of this work is to test whether triaxial models of galaxies are stable in Modified Newtonian dynamics (MOND, Milgrom 1983). Extensive studies about the stability of triaxial models have been performed in standard Newtonian gravity (see below), however, there is no literature on this topic in MOND. For Newtonian physics, it has been three decades of studies on constructing a self-consistent model for triaxial galaxies since Schwarzschild numerically presented the triaxial Hubble profile in 1979 (Schwarzschild 1979; 1982). Despite its original application to a modified Hubble profile, the method of Schwarzschild (1979) is still widely used for testing the self-consistency of various models for the density distribution in galaxies. For instance, Statler (1987) showed that the perfect triaxial Kuzmin (1973) profile and the de Zeeuw & Lynden-Bell (1985) profile are also self-consistent. Those models have constant density cores, however, observations showed that elliptical galaxies have non-constant cores (Moller, Stiavelli, & Zeilinger 1995; Crane et al. 1993; Jaffe et al. 1994; Ferrarese et al. 1994, Lauer et al. 1995), i.e. the surface brightness increases quickly towards the central region of the galaxies. Almost all elliptical galaxies have power-law cusps $\rho\sim r^{-\gamma}$ with $\gamma$ ranging from 1 to 2 for High Surface Brightness to Low Surface Brightness elliptical galaxies in the central region. Spherical models with a fixed value of $\gamma$ have been proposed, e.g. a $\gamma=2$ model by Jaffe (1983) and a $\gamma=1$ model by Hernquist (1990). Today such models are rather discussed within a family of density distributions with $\gamma$ being a free parameter (Dehnen 1993, Carollo 1993 and Tremaine et al. 1994). In this regard, Merritt & Fridman (1996) tested the modified Dehnen profile, $\rho(r)={(3-\gamma)M\over 4\pi abc}{1\over r^{\gamma}(1+r)^{4-\gamma}},0\leq\gamma<3,$ (1) where $r=\sqrt{({x\over a})^{2}+({y\over b})^{2}+({z\over c})^{2}},(c\leq b\leq a)$, $a$, $b$ and $c$ is the long, intermediate, and short axis of the ellipsoids. They found that triaxial galaxies with central density cusps $(\gamma=1)$ were in equilibrium and self-consistent in Newtonian dynamics. The subsequent work by Capuzzo-Dolcetta et al. (2007) proved that a two- component triaxial Hernquist system, including a baryonic component plus a Cold Dark Matter (CDM) halo are also self-consistent. Modified Newtonian Dynamics (MOND) – proposed by Milgrom (1983a,b) as an alternative gravity theory – was initially designed to abandon the need for that yet-to-be-discovered dark matter that (possibly) accounts for as much as 85% of all matter in the Universe. MOND, on the other hand, perfectly predicts the rotation curves of galaxies as well as the Tully-Fisher relation in the absence of CDM (McGaugh et al. 2000; McGaugh, 2005). Indeed, MOND successfully matches the observations on a wide range of scales, from globular clusters (Angus & McGaugh 2008, in preparation) to different types of galaxies including dwarfs and giants, spirals and ellipticals (Milgrom 2007; Gentile et al. 2007; Milgrom & Sanders 2007; Famaey & Binney 2005; Sanders & Noordermeer 2007; Angus 2008a). The development of several frameworks for a relativistic formulation of MOND (Bekenstein 2004; Sanders 2005; Bruneton & Esposito-Farése 2007; Zhao 2007; Skordis 2008) enabled the study of the Cosmic Microwave Background (CMB) (Skordis et al. 2006; Li et al. 2008), cosmological structure formation (Halle & Zhao 2008; Skordis 2008), strong gravitational lensing of galaxies (Zhao et al 2006; Chen & Zhao 2006, Shan et al. 2008) and weak lensing of clusters of galaxies (Angus 2007; Famaey et al. 2007a). As a dynamically selected reference frame, external fields break the Strong Equivalence Principle (Bekenstein & Milgrom 1984; Zhao & Tian 2006; Famaey, Bruneton & Zhao 2007b, Feix et al. 2008a,b). Consequently, the rotation curve, escape speed and morphology of galaxies are determined by both the background and the internal gravity (Famaey et al. 2007b; Wu et al. 2007, 2008). Despite its great success we need to accept that even MOND cannot do well without dark matter completely: a recent study utilizing a combination of strong and weak lensing by galaxy clusters showed that MOND requires neutrinos of mass $5-7$eV (Natarajan & Zhao 2008). And to be consistent with (dark) matter estimates of galaxy clusters and observataions of the CMB anisotropic spectrum (as well as the matter power spectrum), MOND requires neutrino masses of up to $11$eV (Angus 2008b). One theory capable of accommodating both these requirements is that of a mass-varying neutrino by Zhao (2008). In this paper, we utilize a numerical solver for the MONDian analog to Poisson’s equation to study the stability of triaxial galaxies in MOND. The code named NMODY has been widely applied to different problems: it has been applied to study dissipationless collapses, showing that the end-products are consistent with several observations (Nipoti, Londrillo & Ciotti 2006; Nipotti, Londrillo & Ciotti 2007a). The code has also been used to study various important aspects of galaxy formation. Nipoti et al. (2007b) and Ciotti et al. (2007a,b) found that phase mixing is less effective and the timescale of galaxy mergers is longer for MOND than for CDM. Recently, Jordi et al. (2009) and Haghi et al. (2009) applied the external fields into the NMODY code and studied the internal dynamics of distant star clusters. Further, MOND also produces stronger bars than CDM (Tiret & Combes 2007), and hydrodynamical simulations of spherical bulges indicated that there are tight correlations between bulge mass, central black hole and stellar velocity dispersion in MOND (Zhao et al. 2008). These differences and similarities to CDM simulations immediately lead to the question of the stability of triaxial systems in MOND as realistic galaxies are not spherically symmetric objects. Wang et al. (2008) recently found that the self-consistency of a triaxial cuspy centre $\gamma=1$ also exists for MOND. By extending the original Schwarzschild method and weighting the orbits during the generation of the Initial Conditions (ICs) for N-body simulations it is possible to study the stability and future evolution of these density models (Zhao 1996). This method proved successful in, for instance, creating equilibrium ICs for a fast-rotating, triaxial, double-exponential bar reminiscent of a steady-state Galactic bar (Zhao 1996) when evolved forward in time using a Self-Consistent- Field code (Hernquist & Ostriker 1992). Whether there are stable galaxy models in MOND is a lacuna in the studies. It is important to build stable galaxy models for dynamical studies. Here we will expand upon previous work by studying the stability and evolution utilizing direct N-body simulations. Our target of study will be an isolated triaxial galaxy with a mild cusp of $\gamma=1$ in the centre within the Bekenstein- Milgrom MOND theory (1984). We use the same density models applied in Wang et al. (2008), with total mass ranging from $10^{10}M_{\odot}$ to $10^{8}M_{\odot}$, respectively, representing medium-mass elliptical galaxies down to dwarf ellipsoidals, which are in quasi-Newtonian to deep MONDian gravity. We generate the ICs utilizing the method outlined in Zhao (1996) and our N-body simulations confirm that these systems are (initially) in quasi- equilibrium and relax on a rather short time scale of only a few Keplerian dynamical times (1.0 kpc) (see below, sub-section 3.1). The systems quickly reach a state of equilibrium, consistent with the results of Wang et al. (2008). The inertial energy changes by less than 10% and the kinetic energy by less than 20% during the relaxation process. At the same time, the initial $\gamma=1$ cusps are flattened. After the relaxation, the systems remain stable. We further note that the triaxialities of the systems do not change significantly during 200 Keplerian dynamical times (1.0 kpc). Moreover, the scalar Virial theorem is valid at any time. ## 2 Models, Schwarzschild technique, and ICs for N-body ### 2.1 Poisson’s equation in MONDian The MONDian Poisson’s equation can be written as (Bekenstein-Milgrom 1984): $\nabla\cdot\left[\mu\left({|\nabla\Phi|\over a_{0}}\right)\nabla\Phi\right]=4\pi G\rho,$ (2) where $\Phi$ is the MONDian potential generated by the matter density $\rho$. For the gravity acceleration constant, we use $a_{0}=3600$ km2s-2kpc-1, which is same as adopted by Milgrom (1983a,b), Sanders & McGaugh (2002) and Bekenstein (2006). The so-called MONDian interpolation function $\mu$ is approaching 1 for $|\nabla\Phi|>>a_{0}$ (Newtonian limit) and $\mu\to{|\nabla\Phi|\over a_{0}}$ for $|\nabla\Phi|<<a_{0}$ (deep MOND regime), and the gravity acceleration is then given by $\sqrt{a_{0}g_{N}}$, taking the place of the Newtonian acceleration $g_{N}=\nabla\Phi_{N}$ at the same limit. For our simulations we chose the ’simple’ $\mu$-function in the form of (Famaey & Binney 2005; Zhao & Famaey 2006; Sanders & Noordermeer 2007) $\mu(x)={x\over 1+x}.$ (3) Furthermore, we use the density distribution given by Eq. 1, choosing $\gamma=1$, and $M$ being the total mass of the system. For our simulations, we choose the ratios $a:b:c=1:0.86:0.7$, with $a=1$kpc. ### 2.2 Initial Potential A very important step in our calculation is to solve Poisson’s equation in MOND (cf. Eq. 2). This is achieved via numerical integration utilizing the N-body code NMODY (Ciotti et al. 2006; Nipoti et al. 2007a) on a spherical grid of coordinates $(r,\theta,\psi)$. To this extent we applied a grid of $256\times 64\times 128$ cells. Note that we yet do not evolve the system forward in time; we simply extract the potential of our (static) density distribution and use it for the Schwarzschild method detailed below. ### 2.3 Schwarzschild technique Since Schwarzschild (1979, 1982) pioneered the orbit-superposition method to construct self-consistent models of galaxies, this technique has been widely applied in dynamical studies (e.g., Zhao 1996; Rix et al. 1997; van der Marel et al. 1998; Kuijken 2004; Binney 2005; Capuzzo-Dolcetta et al. 2007). The essence of this method is to sample phase-space with a large number of orbits. Properly assigning weights to different orbits can then give rise to the mass distribution we are interested in. Specifically, let $N_{\rm orbits}$ be the total number of orbits and $N_{\rm cells}$ be the number of spatial cells (both will be specified below). For each orbit $j\in N_{\rm orbits}$, we count the fraction of time, denoted by $O_{ij}$, that it spends in each of the cells $i\in N_{\rm cells}$. The occupation number $W_{j}$ for each orbit $j$ is then determined by the following set of linear equations $\sum_{j=1}^{N_{\rm orbits}}W_{j}O_{ij}=M_{i},~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}i=1,...,N_{\rm cells}\ ,$ (4) where $M_{i}$ is the mass in cell $i$ expected from the given mass distribution. We have checked the sum $\sum_{i=1}^{N_{\rm cells}}O_{ij}$ equals unity for each orbit. There are now various choices of how to actually solve Eq. 4: liner programming (Schwarzschild 1979; 1982; 1993), Lucy’s method (Lucy 1974; Statler 1987), maximum entropy methods (Richstone & Tremaine 1988; Statler 1991; Gebhardt et al. 2003), or least-square solvers (Lawson & Hanson 1974; Merritt & Fridman 1996; Capuzzo-Dolcetta et al. 2007). We chose the least-square method (cf. Wang et al. 2008). Because of the symmetry of the mass distribution specified by Eq. (1), it is sufficient to only consider mass cells in the first octant in our analyses. Following Merri & Fridmann (1996), we divide the first octant into cells of equal masses, i.e. the first octant of each initial system is divided into 21 sectors by 20 shells, where every sector has the same amount of mass inside. The first octant is further divided into three parts by the planes $z=cx/a$, $y=bx/a$ and $z=cy/b$ (see Fig. 1, upper left panel). Each of these three parts is sub-divided into 16 cells by the planes $ay/bx=1/5$, $2/5$, $2/3$ and $az/cx=1/5$, $2/5$, $2/3$ (see Fig. 1, upper right panel). Therefore, the total number of cells in the first octant is $16\times 3\times 21=1008$. However, we only consider the innermost 912 cells (the inner 19 sectors) when solving Eq. 4 since only a few orbits supply densities in the outermost sector of grid cells; we simply discard the cells of the outermost sector. Figure 1: The first octant is divided by planes $z=cx/a$, $y=bx/a$ and $z=cy/b$ (upper left panel) into three parts. Each part is subdivided by planes $ay/bx=1/5$, $2/5$, $2/3$ and $az/cx=1/5$, $2/5$, $2/3$ into 16 cells (upper right panel). In the lower panel, curve A is the circle of the minimal radius of 1:1 resonant orbit at the energy $E_{k}$, curve B is the zero- velocity surface of the energy $E_{k}$. There are 10 dotted lines $x=z\tan\theta$ divide the values of $\theta$ from $2.25^{\circ}$ to $87.75^{\circ}$. The 15 diamonds equally divide the radius into 16 parts. The diamonds are the initial positions from which the $x-z$ orbits are launched. In a spherical system, the total energy and the three components of the angular momentum are integrals-of-motion. However, in a triaxial system only the energy remains constant (Merritt 1980; Valluri & Merritt 1998; Papaphilippou & Laskar 1998). We therefore use the 7/8 order Runge-Kutta algorithm (Fehlberg 1968) for orbital calculations, with 100 orbital times (see below Section 3.1) for the full integration time of each orbit. We followed Schwarzschild (1993) and Merritt & Fridman (1996) in assigning initial conditions from one of two sets of starting points (cf. also Wang et al. 2008): stationary orbits with zero initial velocity, and orbits in the $x-z$ plane with $v_{x}=v_{z}=0$, and $v_{y}=\sqrt{2(E-\Phi)}\neq 0$ in the first octant. Note that there is quite a large number of non-symmetric orbits that will lead to artifacts in the procedure if only being considered in the first octant. To circumvent this problem and to keep the symmetry of the system, we reflect the orbits from the boundaries of each octant. Note that by our method the computational workload is not increased as would be the case when calculating eight octants. As mentioned above, there are $16\times 3$ cells in each sector. To obtain enough orbits for the library, we sub-divide the cells by the midplanes of the cells once again, i.e., the midlines of each grid as seen in the upper right panel of Fig. 1; these midlines equally divide the cell at $x=az/c$ and $x=ay/b$. Thus we have $4\times 16\times 3=192$ sub-cells in each sector. The central points on the outer shell surfaces of the sub-cells are the launching points. Hence there are 192 stationary starting orbits in each sector. The total energy on the $k$th sector is defined as the outer boundary shell $E_{k}$, and for the stationary orbits inside the $k$th sector this amounts to $E_{k}=\Phi(x,y,z)$. For the orbits launched from the $x-z$ plane the initial energy is $E_{k}=\Phi(x,0,z)$, as shown in Fig. 1 (lower panel). This figure further shows that the radius of the inner shell (marked as curve A) is the minimal radius of 1:1 resonant orbits (x:y), and the outer shell (marked as curve B) is the zero velocity surface. We define 10 lines satisfying $x=z\tan\theta$ where $\theta$ lies within the range $2.25^{\circ}$ to $87.75^{\circ}$. Along the radial direction, we equally divide the radius between two boundaries into 16 parts with 15 points, where those 15 points are the initial positions for the orbits launched from the $x-z$ plane. Hence there are 150 $x-z$ plane starting orbits. In summary, we have 192 stationary and 150 $x-z$ plane orbits in each sector amounting to a total of $N_{\rm orbits}=6840$ and we use $N_{\rm cells}=16\times 3\times 19=912$ cells for the generation of our orbit library. The energy in each sector is a constant which equals the potential energy on the outer shell surface. As a result, the energies for the systems can be considered ’quantized’ with each system having 19 ’energy levels’. In Fig. 2 there are some examples of asymmetric orbits: the upper four panels are stationary starting orbits, and the lower four panels are orbits launched from the $x-z$ plane. In order to generate equilibrium Initial Conditions for the $N$-body simulations to be presented in Section 3, we need to symmetrize the orbits by using ’mirror particles’. Figure 2: The asymmetric non-zero weights orbits in the orbit library. The upper four panels: stationary starting orbits and the lower four panels: x-z plane launched orbits. All the left panels are orbits projected on x-y plane and right panels are projected on x-z plane. Figure 3: The accumulated of energy distribution of different orbit families in the intermediate model with a total mass of $M=10^{9}M_{\odot}$. The horizontal axis is dimensionless energy of ${E\over GM/1.0kpc}$, and vertical axis is the integration of mass as a function of energy. The dashed, dotted, dot-dashed lines are for box, chaotic and loop orbits. The solid line is for all of the orbits. Finally, in Fig. 3 we show the integration of mass as a function of energy for the model with a mass of $10^{9}M_{\odot}$. There we find that more than half of the mass stems from loop orbits with chaotic orbits contributing more than $1/3$ of the mass; box orbits therefore do not play an important role in the model. We further like to note that the self-consistency of the model in MOND has been examined in Wang et al. (2008), and Antonov’s third law was applied to check the stability of the models initially. However, it is unknown whether or not Antonov’s third law is also valid in MOND so far. The most direct way to check for the stability and investigate the evolution N-body of the system is by means of N-body simulation to be elaborated upon in the following sub- section. ### 2.4 ICs for N-body systems In order to study the stability and evolution of the systems, we need to convert the orbits into an N-body model. According to Zhao (1996), the number of particles $n_{j}$ on the $j$th orbit is proportional to the weight of the orbit, i.e., for an $\mathit{N}$ particle system there are $W_{j}N$ particles on the $j$th orbit. Here we sample the particles on the $j$th orbit isochronously at $t_{j}={T_{j}\over n_{j}}\times(i+0.5),i=0,1,2,...,n_{j}-1$ where $T_{j}$ is the total integration time of the $j$th orbit. To this extend we interpolate the positions and velocities from the 6-dimensional output data of the Schwarzschild orbits. We generate $n_{j}=W_{j}N$ (5) particles on the j$\mathit{th}$ orbit and symmetrize the particles in phase- space. The remaining particles are kept as our Initial Conditions of the N-body system. ## 3 N-body simulations in MOND All results presented in this section were obtained by evolving our systems forward in time with using the N-body particle-mesh code NMODY (Ciotti et al. 2006; Nipoti et al. 2007a). ### 3.1 Technical Details In our simulations, we have $\mathit{N}=8\times 10^{5}$ particles for each model, and choose a grid for the numerical integration of Eq. 2 with $64\times 32\times 64$ cells in the spherical coordinates $(r,\theta,\psi)$, where the radial grids are defined by $r_{i}=2.0\tan[(i+0.5)0.5\pi/(256+1)]$kpc. The density is obtained via a quadratic particle-mesh interpolation and the time integration is performed by the classical two order leap-frog scheme. As our time unit for all subsequent plots we use the following definition (cf. Wang et al. 2008) $T_{\rm simu}=\left({GM\over a^{3}}\right)^{-1/2}=4.7\times 10^{6}yr\left({M\over 10^{10}M_{\odot}}\right)^{-1/2}\left({a\over 1kpc}\right)^{3/2}.$ (6) which represents the Newtonian (or Keplerian) dynamical time at the radius of $r=a$ without the factor of $2\pi$. We remind the reader that the parameter $T_{\rm simu}$ is neither the dynamical time nor the orbital time in general MOND simulations. The orbital time in our MONDian systems is defined as the period of the 1:1 resonant orbit in the $x-y$ plane (Wang et al. 2008). Fig. 4 shows the periods of circular orbits at different radii for the three models presented here. Fig. 4 as well as Eq. 6 imply that the MONDian dynamical time at the radius of 1 kpc is about $7T_{\rm simu}$, $5T_{\rm simu}$ and $3.5T_{\rm simu}$ for the three models whose masses are $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$. We further like to note that the internal time step used by the code NMODY to integrate the equations-of-motion is ${0.3\over\sqrt{\max|\nabla\cdot\bf g|}}$, where the factor $0.3$ is a typical number used in N-body simulations, and $\nabla\cdot\bf{g=4\pi G\rho_{eff}}$, where $\rho_{eff}$ is the effective dynamical density of the system, i.e. the sum of the baryon and (phantom) dark matter density in the Newtonian force law to produce the gravity or potential of baryons in MOND (see We et al. 2008). The time steps here are determined by the maximum values of $\nabla\cdot\bf{g}$, which means the densest dynamical region of the models, where gravity changes most sharply. Note that all particles share a common time step that typically is $0.005\sim 0.03T_{simu}$. A flowchart of the technical steps involved in the process prior to the analysis stage can be viewed in Fig. 5. This figure summarizes the methodology of how to generate and evolve the $N$-body systems. In Table 1 we present the total times each systems has been evolved for. Table 1: Total simulation times = $200\times T_{\rm simu}$. Model | N-body run duration $T$ | unit time $T_{simu}$ ---|---|--- $10^{10}M_{\odot}$ | 0.94 Gyrs | 4.7 Myrs $10^{9}M_{\odot}$ | 3.0 Gyrs | 14.9 Myrs $10^{8}M_{\odot}$ | 9.4 Gyrs | 47.0 Myrs Figure 4: The period of 1:1 resonant circular orbits on the $x-y$ plane as a function of radius. The solid, dotted, and dashed lines are for models with mass of $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$, respectively. Figure 5: Flowchart of the simulations. ### 3.2 Virial Theorem The scalar Virial theorem, $W+2K=0$, is valid for systems in equilibrium, where $W$ is the Clausius integral, $W=\int\rho\vec{x}\cdot\nabla\Phi d^{3}x,$ (7) and $K$ is the kinetic energy of the system (Binney & Tremaine 1987). In the left panel of Fig. 6, we show that the evolution of $-2K/W$ for all models is always about unity, as expected for an equilibrium system. We though note that during the first circa five Keplerian dynamical times (1.0 kpc) all systems are moving from a quasi-equilibrium state with $-2K/W\approx 1.1-1.2$ to $-2K/W=1.0\pm 0.1$ afterwards (marginally oscillating about unity). This figure demonstrates that our $N$-body ICs start off in quasi-equilibrium and after approximately five Keplerian dynamical times (1.0 kpc) can be considered fully relaxed. These ’hot’ $N$-body ICs could be due to a number of reasons including the resolution of the simulation and chaotic orbits, respectively. Regarding the latter, we need to mention that we compute the orbit library for 100 orbital times, and the time integration may not be long enough to ensure a relaxation of those chaotic orbits; particles coming from the chaotic orbits could lead to higher pressure ’overheating’ the system. In Fig. 6, we plot the velocity dispersion $v_{\rm rms}$ for all systems as a function of the simulation time unit. The plot indicates that each $v_{\rm rms}$ decreases by about 10% during the relaxation process and stays constant afterwards (with tiny variations though).111There are typos in Wang et al. (2008) about the total mass of models and $v_{rms}$. Figure 6: The evolution of $2K/|W|$ for all three systems. The solid, dotted, and dashed lines are for models with mass of $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$, respectively. The evolution is shown for 200 Keplerian dynamical times (1.0 kpc). Note that (as inferred from the right panel of Fig. 6) the kinetic energy of the systems decrease nearly one quarter for the maximal evolved case after the relaxation.222The kinetic energy $K$ is proportional to $v_{\rm rms}^{2}$. However, the Virial theorem is still satisfied. That does not mean the energy conservation law is broken: $W+K$ is not the total energy of a MONDian system, and it isnot conserved either. The total energy is still the conserved quantity but for a MONDian system it is given by (Bekenstein & Milgrom 1984): $E=-L+K$ (8) where $L$ is the Lagrangian of the MONDian system, defined by $L=\int d^{3}r\left\\{\rho\Phi+{1\over 8\pi G}a_{0}^{2}\mathcal{F}\left[{(\nabla\Phi)^{2}\over a_{0}^{2}}\right]\right\\},$ (9) and $\mathcal{F}(x^{2})$ is an arbitrary function with $\mu(x)=\mathcal{F}^{\prime}(x^{2})$. For an isolated system in MOND, the potential is logarithmic thus the potential energy is infinite. Therefore, the only meaningful quantity is the difference in energies between different systems (Bekenstein & Milgrom, 1984; Nipoti et al. 2007). However, the evident evolution of $W+K$ at the very beginning (i.e. the first 5 Keplerian dynamical times (1.0 kpc)) shows that the N-body ICs are not accurately in equilibrium, and hence referred to as quasi-equilibrium. ### 3.3 Energy Distribution One of the characteristic quantities to describe relaxation processes is the so-called differential energy distribution, i.e. the quotient of mass $dM$ over the energy band interval $[E,E+dE]$ (Binney & Tremaine 1987). The energy of a unit mass element is $E={1\over 2}v^{2}+\phi(\vec{x})$, where $\phi$ is logarithmically infinite in MOND and hence all particles are bound. But since the absolute value of potential energies is meaningless, we can define the zero point as the last point of the radial grid. Hence, there are positive relative energies for part of the particles though all of them are bound to the system. The left panels of Fig. 7 show the evolution of ${dM\over dE}$ over 200 Keplerian dynamical times (1.0 kpc) for all three models (upper to lower) and we find that all distributions are rather similar. And the most pronounced evolution of the energy distribution is at the low-$E$ end, where particles are most strongly bound to the system. All of the differential energy distributions have 19 peaks, as can be seen in left panels of Fig. 7 That is due to the energy definition of the Schwarzschild technique outlined in §2.3: Inside every sector, the energy (kinetic plus potential energy) is a constant, while the outer shell is the zero-velocity surface of this sector. The adjacent two sectors have energy jumps at the shell. Therefore there are 19 ’quantized energy levels’ for our models, and for each model there are no mass distributions outside these 19 constant ’energy levels’ and hence they appear as ’valleys’ in the left panels of Fig. 7. That explains why the curves appear noisy. We note that after the initial relaxation of about five Keplerian dynamical times (1.0 kpc)333Even though we do not show the curves for 5 Keplerian dynamical times (1.0 kpc) we acknowledge that the drop happens during that initial relaxation phase. Here we care about the long-term evolution within 200 Keplerian dynamical times (1.0 kpc) and hence decided to rather focus on the late evolution of the systems. the low-$E$ end of the distribution becomes devoid of particles, i.e., particles are leaving the central regions where the potential well is deepest. This actually hints at a possible flattening of the initially present density cusp $\gamma=1$! We return to this issue later in sub-section 3.5. Comparing the three left panels in Fig. 7, we observe that the system in the mild MOND regime (i.e. the model with a mass of $1\times 10^{10}M_{\odot}$: upper-left panel) has the most significant evolution, whereas the model in deep MOND evolves least (lower-left panel). We therefore conclude that our ICs are most stable for the deep MOND regime. Figure 7: Left panels: Evolution of the differential energy distribution ${dM\over dE}$. The panels (from upper to lower) correspond to our models with total mass of $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$, respectively. Right panels: The accumulation of energy distribution. The black lines denote the ICs, and the violet, blue, yellow and green lines show the differential energy after 50, 100, 150, 200 Keplerian dynamical times (1.0 kpc). Both ${dM\over dE}$ and the Energy are given in units where G=1 and M=1. As seen in the right panels of Figure 7, the accumulation of energy distribution clearly confirms the previous conclusion from the differential distributions. After the relaxation, the mass in the inner region escapes to the outer, while the outer part is nearly unchanged. The mass distribution obviously does not evolve after relaxation. ### 3.4 Kinetics To further check upon the stability of our systems, we calculate the radial velocity dispersion profiles $\sigma_{r}(r)$ as well as the anisotropy parameter $\beta(r)\equiv 1-{\sigma_{\theta}^{2}+\sigma_{\psi}^{2}\over 2\sigma_{r}^{2}}.$ (10) Here $r$ is the spheroidal radius, the same as in Eq. 1, and $\sigma_{\theta}$, $\sigma_{\psi}$ are the tangential and azimuthal velocity dispersions. The results can be viewed in the left panels of Fig. 8. We find that, for all three models, $\sigma_{r}$ drops within the central 2 kpc during the relaxation at the beginning of the simulation, i.e. the first five Keplerian dynamical times (1.0 kpc) (though not shown for clarity). Afterwards, there is only very little evolution noticeable. The reduction of $\sigma_{r}$ in the core means that the ICs are too hot in the radial direction to sustain equilibrium. We also note that the drop is more pronounced the less MONDian the ICs are. In the mild MONDian model with a mass of $M=10^{10}M_{\odot}$, (upper-most panel) the model obviously appears to be hotter inside than outside. This trend is weakened for the deep-MOND model with a total mass of $M=10^{8}M_{\odot}$ where the self-gravity of the system is much weaker than $a_{0}$. The slope of $\sigma_{r}(r)$ oscillates around a constant value of approximately 20 km/s. In the intermediate model with $M=10^{9}M_{\odot}$ the slope is between the most massive and least massive ones. Figure 8: Left panels: Evolution of the radial velocity dispersion $\sigma_{r}(r)$. Right panels: Evolution of the velocity dispersion anisotropy $\beta(r)$. The upper, middle and lower panels are corresponding to models of $M=1.0\times 10^{10}M_{\odot}$, $M=1.0\times 10^{9}M_{\odot}$ and $M=1.0\times 10^{8}M_{\odot}$. The ordering of the panels corresponds to Fig. 7 as does the colouring of the lines. However, after the relaxation, the slope of $\sigma_{r}(r)$ has the same behavior in all three models, radially cooling down towards the cores. The curves of velocity dispersion after relaxation look like the rotation curves of disc galaxies at the similar mass range (Milgrom & Sanders 2007; Gentile 2008). In the centres, the tangential velocity dispersion $\sigma_{\theta}^{2}+\sigma_{\psi}^{2}$ plays an important role for the Virial Theorem and keeps the cores in equilibrium. Therefore, the systems prefer more isotropic velocity dispersions in the cuspy centres. To confirm this, we also present the anisotropy parameter $\beta(r)$ in the right panels of Fig. 8. We do find the expected small values of $\beta$ in the centres as well as a radial increase of $\beta(r)$. Inside 1 kpc the $\beta$-profiles oscillate during the whole evolution while they remain stable in the outer parts. Furthermore, the anisotropy increases with radius in all three models out to about 25 kpc where it turns approximately constant, $\beta=0.6$, i.e., the velocities are distributed hyper-radially. Nevertheless, within 2 kpc, there should be a more substantial redistribution of kinetic energies in the tangential direction after relaxation due to the evolution of $\sigma_{r}$ seen in the left panels of Fig. 8; otherwise, the systems lose quite a lot of kinetic energy in the core. Unfortunately, the evolution of $\beta$ in the central region, seen in right panels of Fig. 8, is not as large as expected. Thus, there are outflows of kinetic energy from the centres of the systems. The values of velocity dispersion and anisotropic parameters in the deep MOND regions of our systems fit pretty well with the analytical predictions of isothermal spheres by Milgrom (1984; 1994). ### 3.5 Mass distributions Due to parts of the kinetic energies spilling out of the cores (cf. sub- section 3.3 and 3.4), the mass densities could redistribute at the same time. Indeed, we find that there are outflows of mass: the cuspy centers with an initial value of $\gamma=1$ are flattened. This can be viewed in Fig. 9 where we show the densities along the major axis (left panels) and cumulative (right panels) mass distributions for our MOND models. With regards to the density panels, the three models show a similar behavior. It is clear that the mass is redistributed during the relaxation with losses in the very central region of $r<0.5$ kpc and gains outside. The density curves are ocsillating around the initial analytical density as given by Eq. 1. Therefore, the system becomes slightly less cuspy and keeps the triaxial density after reaching equilibrium. Note that the density distribution still remains triaxial after the system is in equilibrium, and there is no obvious evolution within 200 Keplerian Dynamical times (at the typical scale a=1.0 kpc). The right panels of Figure 9 show the total mass inside the radial direction $r$. The black dashed straight lines in right panels are defined by $M_{0}={a_{0}r^{2}\over G}$, the mass to produce the gravity acceleration $a_{0}$ in a point mass approximation. $M_{0}$ is the watershed of the enclosed mass producing MOND and Newton dominating gravities. At a certain radius $r$, when the enclosed mass is smaller than $M_{0}$, there occurs a transition to MONDian gravity. We find that in all of the three models MONDian effects cannot be ignored. Even for $1.0\times 10^{10}M_{\odot}$, the MONDian gravity dominates the regions of $r>10^{0.3}\sim 2$ kpc. Obviously, the model $M=1.0\times 10^{8}M_{\odot}$ is in deep MOND region. The colours show the evolution of the systems. Mass in the inner part of the system is lost during the density re-distribution, while in the outer part, beyond 4 kpc, the total mass is not affected. We further note that after the redistribution (during the relaxation) the mass distribution has stabilized. Figure 9: The evolution of the mass distribution for the models with $M=10^{10}M_{\odot}$ (upper), $M=10^{9}M_{\odot}$ (middle), $M=10^{8}M_{\odot}$ (lower). The left panels show the density distributions on the major axis the density information can be obtained from the axis ratios of Figure 10. The right panels show the accumulated mass inside the radius $r$. The dashed black lines in the right panels are defined as ${a_{0}r^{2}\over G}$, which are the watersheds of enclosed mass producing MONDian dominating gravity (below the lines) and Newtonian dominating gravity (upon the lines). The colouring of the lines is representative of the evolutionary stage of the model and corresponds to Fig. 7. ### 3.6 Shape As confirmed in §3.5, the mass redistributes inside our systems during relaxation. Hence, the question arises whether the shape (i.e., the initial triaxiality) remains stable or undergoes changes. To address this, we show the evolution of the axis ratios of the eigenvalues $\sqrt{I_{yy}/I_{xx}}$ and $\sqrt{I_{zz}/I_{xx}}$ of the moment of inertia tensor $m_{ij}x_{i}x_{j}$, ($m_{ij}=M/N$) in Fig. 10. The three models give similar results, hence we highlight the model with a total mass of $10^{9}M_{\odot}$ in the upper panel. We find that the axial ratios (as a function of radius) merely evolve about 10% within 200 Keplerian dynamical times (1.0 kpc). The system is rounder in the center, but the whole system keeps the triaxial shape during the long stage of evolution. It is clear that the axis ratio between the minor and major axes is more stable than that of the intermediate and major axes. Not only the ratios are almost constant, but also the absolute values of $I_{xx}$, $I_{yy}$ and $I_{zz}$ seem in dynamic equilibrium and stable, changing less than $20\%$ during the oscillation (cf. Fig 11). However, we note that at the time $t=0$ the ratios of $\sqrt{I_{yy}/I_{xx}}$ and $\sqrt{I_{zz}/I_{xx}}$ do not accurately equal $b:a=0.86$ and $c:a=0.7$ in most of the inner regions, which is caused by the numerical effects in generating the $N$-body ICs. However, at the edge of the galaxy (i.e., including more than 80% of the total mass), the axis ratios are close to the suggested ones. We conclude that the ICs generated by our application of the Schwarzschild technique roughly lead to a 5% error for the axis ratios. A study of the tensor kinetic energies $K_{xx}$, $K_{yy}$ and $K_{zz}$, defined as $K_{xx}=0.5<v_{x}\cdot v_{x}>$, shows a similar behaviour to the moment of inertia tensor analysis presented above. The ratios remain constant although the absolute values change by at most 20%. This can again be verified in Figure 11 where we plot the inertial (left panel) and kinetic energy (right panel) components for the three models. Figure 10: Evolution of axis ratios with the median model of a total mass of $1.0\times 10^{9}M_{\odot}$ (Upper panel), $1.0\times 10^{10}M_{\odot}$ (lower left panel) and $1.0\times 10^{8}M_{\odot}$ (lower right panel). The lower and upper series of lines are for the ratios of minor : major axis and intermediate : major axis, i.e., $\sqrt{I_{zz}/I_{xx}}$ and $\sqrt{I_{yy}/I_{xx}}$. The different line symbols are defined the same as in the figure: solid, dotted, short dashed, dot-dashed and long dashed lines are for system evolving 0, 50, 100, 150 and 200 $T_{simu}$, where $T_{simu}$ is the Newtonian orbital time at 1.0 kpc . Figure 11: Upper, middle and lower panels are different mass models of $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$. The left panels are the evolution of the inertial tensor $I_{xx}$ (solid line), $I_{yy}$ (dotted) and $I_{zz}$ (dashed). The right panels are the evolution of kinetics energy $K_{xx}$ (solid), $K_{yy}$ (dotted) and $K_{zz}$ (dashed). The total simulation time is 200 $T_{simu}$. As a final note, considering existing Schwarzschild plus N-body simulations in the literature, we find that the evolution seen in our MONDian cuspy elliptical models is comparable to that seen in Fig.5 of Poon & Merritt (2004, ApJ 606, 774) for triaxial ellipticals in Newtonian gravity. Our simulations are much longer than 10 crossing times, which provides a typical scale for checking stability in Newtonian Schwarzschild simulations in the literature (Poon & Merritt 2004, Zhao 1996). ## 4 Conclusions and Discussion We explored the stability and evolution of the triaxial Dehnen model (Dehnen 1993; Merritt & Fridman 1996; Capuzzo-Dolcetta et al. 2007) with a $\gamma=1$ central cusp using MOND. We utilized the Schwarzschild method (Schwarzschild 1979) to build orbit models which were in turn used to generate initial conditions (ICs) for N-body simulations using the method outlined in Zhao (1996). These ICs were evolved forward in time for 200 Keplerian dynamical times (at the typical length scale of 1.0 kpc) by the numerical integrator NMODY developed by the Bologna group (Ciotti et al. 2006; Nipoti et al. 2007) and designed to include the effects of MOND. We additionally ran the same simulations with a second MONDian gravity solver AMIGA (Llinares, Knebe & Zhao 2008, cf. Appendix B) based upon an entirely different grid-geometry to confirm the credibility of our results. In our simulations, the virial theorem was satisfied at all times. We showed that the systems start in quasi-equilibrium with a short relaxation phase of approximately less than five Keplerian dynamical times (1.0 kpc). We found outflows of energy and mass from the centres of the systems under investigation. Hence, during the relaxation stage, there is a flattening of the initially present $\gamma=1$ cusp to a core. Despite the obvious mass redistribution, we need to acknowledge that the shape of the systems remained unchanged in the course of the simulations; the axis ratios of the eigenvalues of the moment of inertia tensor (as well as the kinetic energy tensor) stayed constant. The effects of resolution of the simulations should not remain unmentioned. We found that the potential calculated from the N-body ICs differs by 10% compared to the analytical potential. Furthermore, the analytically predicted velocity dispersions at the initial time are $107.3$ km/s, $54.2$ km/s and $29.3$ km/s for the models $M=10^{10},10^{9},10^{8}M_{\odot}$, respectively. However, they do not match the (numerical) values plotted in right panel of Fig. 6. Hence we use the Clausius integral $|W|$ in Equation 7, calculate the analytical densities for the systems at $t=0$, to minimize the errors. Moreover, we have found that due to the resolution limitation of the NMODY code, the errors accumulate during the simulations, which is insensitive to more massive systems, but becomes an issue when the mass of the system decreases. This causes small non-zero net velocities in the systems. The simulation centres of the systems with $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$ move significantly after 200 Keplerian dynamical times (1.0 kpc) and hence we restrict our analysis to this time frame. To further check the credibility of our results and the dependence on the code, we ran the simulations again with a technically substantially different code (AMIGA), which is also capable of integrating the analog to Poisson’s equation (cf. equation 2 in Appendix B). The results are practically indistinguishable reassuring their tenability. We like to close with the notation that our systems are isolated systems, corresponding to the cases of field galaxies. The self-potentials of the systems in MOND are logarithmic at large radii, therefore no stars can escape from such systems. However, for any system embedded in external fields, the potential is truncated when the strength of the external field becomes comparable to the internal field (Milgrom 1984; Wu et al. 2007). Therefore, Poisson’s equation should be modified to $\nabla\cdot\left[\mu\left({|\nabla\Phi_{int}-\vec{g}_{ext}|\over a_{0}}\right)(\nabla\Phi_{int}-\vec{g}_{ext})\right]=4\pi G\rho_{b},$ (11) where the $\mu$-function is determined by both the internal and external gravitational accelerations. Hence the strong equivalence principle is violated, and the directions along and against the external field, the $\mu$-function has different values even though the mass density distributions are the same. A direct result is that the potentials become non-symmetric along and against the directions of the external field, i.e., a symmetric system is not in equilibrium due to the non-symmetry of self-potential. Therefore, MOND predicts that there are no real symmetric systems within the external gravity backgrounds. This will be explored in greater detail in a future paper (Wang et al. in preparation). ## 5 acknowledgments We thank the anonymous referee for helpful suggestions and comments to the earlier version of the manuscript. We thank Luca Ciotti, Pasquale Londrillo, Carlo Nipoti for generously sharing their code, Martin Feix for polishing the English writing and Victor Debattista, Mordehai Milgrom and Christos Siopis for nice comments in the earlier version of the paper. We thank the Mordehai Milgrom and Francoise Combes for the comments to the paper. XW and HSZ acknowledges the Dark Cosmology Center of Copenhagen University and Sterrewacht of Leiden University. XW acknowledges the support of SUPA studentship. HSZ acknowledges partial support from UK PPARC Advanced Fellowship and National Natural Science Foundation of China (NSFC under grant No. 10428308). YGW acknowledges the support of the 973 Program (No.2007CB815402), the CAS Knowledge Innovation Program (Grant No. KJCX3-SYW-N2), and the NSFC grant 10503010. CLL and AK acknowledge funding by the DFG under grant KN 755/2. AK further acknowledges funding through the Emmy Noether programme of the DFG (KN 755/1). ## Appendix A Symmetry and Numerical Challenges Evolving the systems without filtering the high frequent components of mass during the Legendre transformation in time for up to 200 Keplerian dynamical times (1.0 kpc) we find that they appear ’unstable’. However, a detailed investigation revealed that is a numerical effect rather than a physical instability. There is a small, uneven force in the $z$ direction which comes from the asymmetry of the density distribution of ICs for N-body and systems during the simulations and the errors obviously accumulate when the numbers of particles are not big enough. Further, the total momentum of the systems is not conserved giving a non-zero net velocity along the minor axis. Hence the code requires a large number of particles for smooth density distributions to make sure the tiny asymmetry of some particles does not affect the whole system. Note that this effect is more serious when the systems are not symmetrized by utilizing ’mirror particles’ inside the systems. It is known that particles generated from asymmetric orbits (e.g. the ’banana orbits’) could break the symmetry of the systems in phase space. Furthermore, there are a couple of hundred of chaotic orbits with positive weights, and, during the Schwarzschild process, the time integration of 100 orbital times may not be long enough to obtain symmetry. We therefore show in Fig. 12 the average value of positions and velocities along the $z$-axis for every orbit of the $N$-body ICs of the model with mass $10^{9}M_{\odot}$. We plot $\bar{z}$ vs. $\bar{v}_{z}$ since the $z$-direction displays the most serious shifting. For a perfectly symmetric system the values of $\bar{z}$ and $\bar{v}_{z}$ should be close to zero, while we find that they are not. Hence we need to symmetrize the systems prior to the N-body procedure. The simplest way to achieve this is by placing ’mirror particles’ into the system, i.e. using a minus sign in front of the 6-dimensional components. Therefore, the total numbers of particles increases to $N\times 2^{6}=64N$. Figure 12: The average values of positions ($\bar{z}$) vs. velocities ($\bar{v}_{z}$) projected on the z axis for each non-zero weight orbit. The model has the total mass of $10^{9}M_{\odot}$. To illustrate (and quantify) this effect we plot in Fig. 13 the centre-shifts along the three axes (left panel) as well as the evolution of the net velocities along the same axes (right panel) during the first 40 Keplerian dynamical times (1.0 kpc) for the models without the 64 mirrors. We find that the most massive system (i.e. $10^{10}M_{\odot}$, which is in mild-MOND gravity) is least affected by these numerical artifacts. As a matter of fact, this particular system shows credible signs of stability even after 200 Keplerian dynamical times (1.0 kpc). We need to acknowledge that this is partly due to our definition of the time unit (cf. Eq. 6): it is shorter for more massive systems. However, all the analysis presented in this paper indicates that the system is stable despite the apparent numerical artifacts of the code. We though cannot evolve the system further in time as the accumulation of errors would lead to substantial deviations from the system’s equilibrium state; but this ’instability’ is caused by numerics rather than physics! Given the technical particulars of the NMODY code such a centre-shift will lead to a decrease in resolution as the code utilizes a spherical grid. , Figure 13: Left panel: The shifted positions of the centre of mass of the three systems. The solid, dotted, dashed lines are for the systems with their total mass of $10^{10}M_{\odot}$, $10^{9}M_{\odot}$ and $10^{8}M_{\odot}$. The colours of black, yellow and blue correspond to the z, y and x axis. The right panel: net velocities of the systems in the three axis directions. ## Appendix B Comparison with another MOND solver As just highlighted in Section A, there are numerical challenges to evolving our systems under MONDian gravity using the N-body code NMODY. In order to confirm that the results are not unique to this one code we therefore decided to also use another novel solver for the MONDian analog to Poisson’s equation, namely the AMIGA code (Llinares, Knebe & Zhao 2008). AMIGA is the successor to MLAPM (Knebe, Green & Binney 2001) that has recently been adapted to also solve Eq. 2.444We like to note in passing that MLAPM has already been successfully applied to study cosmological structure formation under MOND (Knebe & Gibson 2004) under certain assumptions. The code utilizes adaptive meshes in Cartesian coordinates in a cubical volume as opposed to the spherical grid of NMODY. The solution is obtained via multi-grid relaxation and we refer the interested reader to Llinares et al. (2008) for more details. However, here we need to elaborate upon the boundary constraints as we cannot assume that the potential on the boundary will be a constant: the box is a cube and not a sphere. We decided to use the solution for a point mass in the center of the box $\Phi(r)=-\frac{GM}{2}\left(\frac{1}{r}-\frac{1}{r_{0}}\right)+\left(f(r)-f(r_{0})\right),$ (12) with $\begin{array}[]{rcl}f(r)&=&\displaystyle-\sqrt{GMa_{0}}\\\ &&\displaystyle\left[\frac{-1}{2r}\sqrt{q^{2}+4r^{2}}+\ln\left(2r+\sqrt{q^{2}+4r^{2}}\right)\right]\\\ \\\ q^{2}&=&\displaystyle\frac{GM}{a_{0}},\end{array}$ (13) where, $M$ is the total mass in the box and $r_{0}$ is a length scale (a constant of integration). For $a_{0}\rightarrow 0$ we recover the Newtonian solution and for $a_{0}$ finite and $r\rightarrow\infty$ we have $\ln(r)$, which is the typical behaviour for any MONDian solution. In the case that we use $r_{0}=B$, with $B$ being the size of the cubical box, we end up with $\Phi=0$ in a sphere of radius $B$, that is equivalent to the conditions used in NMODY. We now run simulations with the same Initial Conditions for N-body as used with NMODY utilizing a domain grid with $128^{3}$ cells. Each of these domain grid cells is refined and split into eight sub-cells once the number of particles inside that cell is in excess of 6. The box size is $B=165.5152$kpc and the scale for the boundary conditions is $r_{0}=82.7576$ Kpc (half of the box). The results obtained are similar to the NMODY simulations. The system is stable with a normal secular evolution. We observe the same kind of evolution. We confirm that all other quantities behave in a similar manner too, and hence are confident that the results presented in the previous section 3 are not dominated and/or contaminated by numerical artifacts. ## Appendix C Longer time evolution of the $10^{10}M_{\odot}$ model We initially ran the models for 200 simulation time units (i.e. 200 circular orbital times at the length of 1.0 kpc, see Table 1). Hence the most massive model has been evolved for the least time, about 1 Gyr. For brighter galaxies because they are also bigger galaxies, the dynamical time is longer. This is the opposite to our trend in Table 1. This can be understood because our toy galaxies do not sit on the fundamental plane. To see this, we estimate $r_{h}$, the characteristic length of an elliptical galaxy on the fundamental plane (e.g., Eq. 9 in Zhao, Xu, Dobbs 2008, which follows Faber et al. 1997 ). $\log{GMr_{h}^{-2}\over 350\times 10^{-10}m/s^{2}}=-1.52\log{M\over 1.5\times 10^{11}M_{\odot}}\pm 0.5,$ (14) we find $r_{h}=0.082^{+0.049}_{-0.032}$ kpc for the model with $10^{10}M_{\odot}$. This is one order of magnitude smaller than our assumed size $1$ kpc. The dynamical time for a $10^{10}M_{\odot}$ galaxy sitting on the fundamental plane is about 0.1 Million years. To be on the safe side, we re-ran the model for about 3 Gyrs ($650T_{simu}$), and show its virial ratio (Fig. 14). And our conclusion in the §3.2 does not change. The virial ratio oscillates around 1 within 10% at most. Figure 14: The virial ratio of model with $10^{10}M_{\odot}$, simulating 3 Gyrs (650 circular orbital time at typical length of 1.0kpc). ## References * (1) Angus G.W., 2008a, MNRAS, 387,1481 * (2) Angus G.W., 2008b, arXiv:0805.4014 * (3) Angus G.W., Shan H.Y., Zhao H.S. & Famaey B., 2007, ApJ, 654, L13 * (4) Bekenstein J., 2004, Phys. Rev. D., 70, 3509 * (5) Bekenstein J., 2006, Contemp. Phys., 47, 387 * (6) Bekenstein J., Milgrom M., 1984, ApJ, 286, 7 * (7) Binney, J. 2005, MNRAS, 363, 937 * (8) Binney J.& Tremaine S., 1987, Galactic Dynamics, Princeton University Press, 1987, 747 p * (9) Bruneton J.-P., Esposito-Farèse G., 2007, Phys. Rev. D, 76, 124012 * (10) Capuzzo-Dolcetta R., Leccese L., Merritt D. & Vicari A., 2007, ApJ, 666, 165 * (11) Carollo, C. M. 1993, Ph.D. thesis, Ludwig-Maximilians Univ., Munich * (12) Chen D.M., Zhao H.S., 2006, ApJ, 650, 9 * (13) Ciotti L., Londrillo P. & Nipoti C., 2006, ApJ, 640, 741 * (14) Ciotti L., Nipoti C. & Londrillo P., 2007, arXiv:astro-ph/0701826 * (15) Crane, P., et al. 1993, AJ, 106, 1371 * (16) Dehnen, W. 1993, MNRAS, 265, 250 * (17) de Zeeuw, P. T. & Lynden-Bell, D. 1985, MNRAS, 215, 713 * (18) Faber S.M., Tremaine S., Ajhar E.A., Byun Y.I., Dressler A., Gebhardt K., Grillmaair C., Kormendy J. et al., 1997, AJ, 114, 1771 * (19) Famaey B., Angus G.W., Gentile G., Shan H.Y. & Zhao H.S., 2007a, World Scientific in press, (arXiv:0706.1279) * (20) Famaey B., Binney J., 2005, MNRAS, 363, 603 * (21) Famaey B., Bruneton J.P. & Zhao H.S, 2007b, MNRAS, 377, L79 * (22) Feix M., Fedeli C. & Bartelmann M., 2008, A&A,480,313 * (23) Feix M., Xu D., Shan H.Y., Famaey B., Limousin M., Zhao H.S., & taylor A., 2008, ApJ, 682, 711 * (24) Fehlberg, E. 1968, Classical Fifth-, Sixth-, Seventh-, and Eighth-Order Rung-Kutta Formullas with Stepsize Control (NASA Tech. Rep. R-287; Washington: NASA) * (25) Ferrarese, L., van den Bosch, F. C., Ford, H. C., Jaffe, W., & O Connell, R. W. 1994, AJ, 108, 1598 * (26) Gebhardt, K., et al. 2003, ApJ, 583, 92 * (27) Gentile G. 2008, ApJ, 684, 1018 * (28) Gentile G., Famaey B., Combes F., Kroupa P. Zhao H.S. & Tiret O., 2007a, A&A, 472, L25 * (29) Halle A., Zhao H.S. & Li B., 2008, ApJS, 177, 1 * (30) Hernquist, L. 1990, ApJ, 356, 359 * (31) Hernquist L. & Ostriker J.P., 1992, ApJ, 386, 375 * (32) Hosein Haghi, Holger Baumgardt, Pavel Kroupa, Eva K. Grebel, Michael Hilker, Katrin Jordi, 2009, MNRAS, in press (arXiv: 0902.1846) * (33) vK. Jordi, E.K. Grebel, M. Hilker, H. Baumgardt, M. Frank, P. Kroupa, H. Haghi, P. C t , S.G. Djorgovski, 2009, AJ, in press (arXiv: 0903.4448) * (34) Knebe A., Green A., & Binney J., 2001, MNRAS, 325, 845 * (35) Knebe A., Gibson B.K., 2004, MNRAS, 347, 1055 * (36) Kuzmin, G. G. 1973, in The Dynamics of Galaxies and Star Clusters, ed. T. B. Omarov (Nauka of the Kazakh S. S. R., Alma-Ata), p. 71. * (37) Kuijken, K. 2004, ASPC, 317, 310 * (38) Lauer, T. R., et al. 1995, AJ, 110, 2622 * (39) Lawson, C. L., & Hanson, R. 1974, Solving Least Squares Problems (2d ed.; Englewood Cliffs: Prentice Hall) * (40) Li B., Barrow J. D., Mota D. F. & Zhao H.S., 2008, arXiv:0805.4400 * (41) Llinares C., Knebe A. & Zhao H.S., 2008, MNRAS, in press; arXiv:0809.2899 * (42) Lucy, L. B. 1974, AJ, 79, 745 * (43) Merritt D. & Fridman T., 1996, ApJ, 460, 136 * (44) McGaugh S. S., Schombert J. M., Bothun G. D. & de Blok W. J. G., 2000, ApJ, 533, 99 * (45) McGaugh S., 2005, Phys.Rev.Lett. 95, 171302 * (46) Milgrom M., 1983a, ApJ, 270, 365 * (47) Milgrom M., 1983b, ApJ, 270, 371 * (48) Milgrom M., 1984, ApJ, 287,571 * (49) Milgrom M. 1994; ApJ, 429, 540 * (50) Milgrom M., 2007, ApJ, 667, 45 * (51) Milgrom M., Sanders R.H., 2007, ApJ, 658, 17 * (52) Nipoti C., Londrillo P., Ciotti, L., 2006, MNRAS, 370, 681 * (53) Nipoti C., Londrillo P., Ciotti, L., 2007a, ApJ, 660, 256 * (54) Nipoti C., Londrillo P., Ciotti, L., 2007b, MNRAS, 381, 104 * (55) Natarajan P. & Zhao H.S., 2008, MNRAS, 389, 250 * (56) Poon M.Y. & Merritt D., 2004, ApJ, 606,774 * (57) Richstone, D. O., & Tremaine, S. 1988, ApJ, 327, 82 * (58) Rix, H. W., et al. 1997, ApJ, 488, 702 * (59) Sanders R.H., 2005, MNRAS, 363,459 * (60) Sanders R.H., Noordermeer E., 2007, MNRAS, 379,702 * (61) Sanders R.H., McGaugh S.S., 2002, ARA&A, 40, 263 * (62) Schwarzschild, M., 1979, ApJ, 232, 236S * (63) Schwarzschild, M., 1982, ApJ, 263, 599S * (64) Schwarzschild, M. 1993, ApJ, 409, 563 * (65) Shan H. Y., Feix M., Famaey B. & Zhao, H.S., 2008, MNRAS, 387, 1303 * (66) Skordis C., 2008, PhRvD, 7713502S * (67) Statler, T. S. 1987, ApJ, 321, 113 * (68) Statler, T. S. 1991, AJ, 102, 882 * (69) Tiret O. & Combes F., 2007, 2007sf2a.conf..356T * (70) Tremaine, S., Richstone, D., Buyn, Y.-I., Dressler, A., Faber, S. M., Grillmair, C., Kor- mendy, J., & Lauer, T. R. 1994, AJ, 107, 634 * (71) van der Marel, R. P., et al. 1998, ApJ, 493, 613 * (72) Wang Y., Wu X. & Zhao H.S., 2008, ApJ, 677, 1033 * (73) Wu X., Famaey B., Gentile G., Perets H. & Zhao H.S., 2008, MNRAS, 386, 2199 * (74) Wu X., Zhao H.S., Famaey B., Gentile G., Tiret O., Combes F., Angus G.W. & Robin A.C., 2007, ApJ, 655, L101 * (75) Zhao H.S., 1996, MNRAS, 283, 149 * (76) Zhao H.S., 2007, ApJ, 671, L1 * (77) Zhao H.S., Bacon D.J., Taylor A.N. & Horne K., 2006, MNRAS, 368, 171 * (78) Zhao H.S., Famaey B., 2006, ApJ, 638, L9 * (79) Zhao H.S., Tian L., 2006, A&A, 450, 1005 * (80) Zhao H.S., Xu B.X. & Dobbs C., 2008, arXiv0802.1073
arxiv-papers
2009-04-08T20:39:25
2024-09-04T02:49:01.807701
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Xufen Wu, HongSheng Zhao, Yougang Wang, Claudio Llinares, Alexander\n Knebe", "submitter": "Xufen Wu", "url": "https://arxiv.org/abs/0904.1425" }
0904.1883
# On the subgroup structure of the full Brauer group of Sweedler Hopf algebra Giovanna Carnovale Juan Cuadra Dipartimento di Matematica Pura Universidad de Almería ed Applicata Dpto. Álgebra y Análisis Matemático via Trieste 63 E-04120 Almería, Spain I-35121 Padua, Italy jcdiaz@ual.es carnoval@math.unipd.it ###### Abstract We introduce a family of three parameters $2$-dimensional algebras representing elements in the Brauer group $BQ(k,H_{4})$ of Sweedler Hopf algebra $H_{4}$ over a field $k$. They allow us to describe the mutual intersection of the subgroups arising from a quasitriangular or coquasitriangular structure. We also define a new subgroup of $BQ(k,H_{4})$ and construct an exact sequence relating it to the Brauer group of Nichols $8$-dimensional Hopf algebra with respect to the quasitriangular structure attached to the $2\times 2$-matrix with $1$ in the $(1,2)$-entry and zero elsewhere. MSC:16W30, 16K50 ## Introduction The Brauer group of a Hopf algebra is an extremely complicated invariant that reflects many aspects of the Hopf algebra: its automorphisms group, its Hopf- Galois theory, its second lazy cohomology group, (co)quasitriangularity, etc. It is very difficult to describe all its elements and to find their multiplication rules. For the most studied case, that of a commutative and cocommutative Hopf algebra, these are the results known so far: the first explicit computation was done by Long in [14] for the group algebra $k{\mathbb{Z}}_{n},$ where $n$ is square-free and $k$ algebraically closed with $char(k)\nmid n$; DeMeyer and Ford [12] computed it for $k{\mathbb{Z}}_{2}$ with $k$ a commutative ring containing $2^{-1}$. Their result was extended by Beattie and Caenepeel in [2] for $k{\mathbb{Z}}_{n},$ where $n$ is a power of an odd prime number and some mild assumptions on $k$. In [4] Caenepeel achieved to compute the multiplication rules for a subgroup, the so-called split part, of the Brauer group for a faithfully projective commutative and cocommutative Hopf algebra $H$ over any commutative ring $k$. These results were improved in [6] and allowed him to compute the Brauer group of Tate-Oort algebras of prime rank. For a unified exposition of these results the profuse monograph [5] is recommended. Since the Brauer group was defined for any Hopf algebra with bijective antipode ([7], [8]), it was a main goal to compute it for the smallest noncommutative noncocommutative Hopf algebra: Sweedler’s four dimensional Hopf algebra $H_{4}$, which is generated over the field $k$ ($char(k)\neq 2$) by the group-like $g$, the $(g,1)$-primitive element $h$ and relations $g^{2}=1,h^{2}=0,gh=-hg$. A first step was the calculation in [20] of the subgroup $BM(k,H_{4},R_{0})$ induced by the quasitriangular structure $R_{0}=2^{-1}(1\otimes 1+g\otimes 1+1\otimes g-g\otimes g).$ It was shown to be isomorphic to the direct product of $(k,+)$, the additive group of $k$, and $BW(k)$, the Brauer-Wall group of $k$. It was later proved in [9] that the subgroups $BM(k,H_{4},R_{t})$ and $BC(k,H_{4},r_{s})$ arising from all the quasitriangular structures $R_{t}$ and the coquasitriangular structures $r_{s}$ of $H_{4}$ respectively, with $s,t\in k$, are all isomorphic. In this paper we introduce a family of three parameters $2$-dimensional algebras $C(a;t,s)$, for $a,t,s\in k,$ that represent elements in $BQ(k,H_{4})$. They will allow us to shed a ray of light on the subgroup structure of $BQ(k,H_{4})$ and will provide some evidences about the difficulty of the computation of this group. The algebra $C(a;t,s)$ is generated by $x$ with relation $x^{2}=a$ and has a $H_{4}$-Yetter-Drinfeld module algebra structure with action and coaction: $g\cdot x=-x,\quad h\cdot x=t,\quad\rho(x)=x\otimes g+s\otimes h.$ We list the main properties of these algebras in Section 2 (Lemma 2.1) and we show that $C(a;t,s)$ is $H_{4}$-Azumaya if and only if $2a\neq st$. When $s=lt$ they represent elements in $BM(k,H_{4},R_{l})$ and this subgroup is indeed generated by the classes of $C(a;1,t)$ with $2a\neq t$ together with $BW(k)$, Proposition 2.6. The same statement holds true for $BC(k,H_{4},r_{l})$ when $t=sl$ replacing $C(a;1,t)$ by $C(a;s,1)$, Proposition 2.5. Using the description of $BM(k,H_{4},R_{t})$ and $BC(k,H_{4},r_{s})$ in terms of these algebras, Section 3 is devoted to analyze the intersection of these subgroups inside $BQ(k,H_{4})$. Let $i_{t}$ and $\iota_{s}$ denote the inclusion map of the former and the latter respectively. It is known that $BW(k)$ is contained in any of the above subgroups. Theorem 3.5 states that: 1. (1) $Im(i_{t})\cap Im(\iota_{s})\neq BW(k)$ iff $ts=1$. If this is the case, $Im(i_{t})=Im(\iota_{s})$; 2. (2) $Im(i_{t})\cap Im(i_{s})\neq BW(k)$ if and only if $t=s$; 3. (3) $Im(\iota_{t})\cap Im(\iota_{s})\neq BW(k)$ if and only if $t=s$. A remarkable property of our algebras is that they represent the same class in $BQ(k,H_{4})$ if and only if they are isomorphic, Corollary 3.4. A morphism from the automorphism group of $H_{4}$ to $BQ(k,H_{4})$ was constructed in [19], allowing to consider $k^{\cdot 2}$ as a subgroup of $BQ(k,H_{4})$. In Section 4 we show that the subgroup $BM(k,H_{4},R_{l})$ is conjugated to $BM(k,H_{4},R_{l\alpha^{2}})$ inside $BQ(k,H_{4})$, for $\alpha\in k^{\cdot}$, by a suitable representative of $k^{\cdot 2}$, Lemma 4.1. Any $H_{4}$-Azumaya algebra possesses two natural ${\mathbb{Z}}_{2}$-gradings: one stemming from the action of $g$ and one from the coaction (after projection) of $g$. In Section 6 we introduce the subgroup $BQ_{grad}(k,H_{4})$ consisting of those classes of $BQ(k,H_{4})$ that can be represented by $H_{4}$-Azumaya algebras for which the two ${\mathbb{Z}}_{2}$-gradings coincide. On the other hand, the Drinfeld double of $H_{4}$ admits a Hopf algebra map $T$ onto Nichols $8$-dimensional Hopf algebra $E(2)$. This map is quasitriangular as $E(2)$ is equipped with the quasitriangular structure $R_{N}$ corresponding to the $2\times 2$-matrix $N$ with $1$ in the $(1,2)$-entry and zero elsewhere, see (5.1). If we consider the associated Brauer group $BM(k,E(2),R_{N})$, then Theorem 5.2 claims that $T$ induces a group homomorphism $T^{*}$ fitting in the following exact sequence $\begin{array}[]{l}\begin{CD}1\longrightarrow{\mathbb{Z}}_{2}@>{}>{}>BM(k,E(2),R_{N})@>{T^{*}}>{}>BQ_{grad}(k,H_{4})\longrightarrow 1.\end{CD}\end{array}$ So in order to compute $BQ(k,H_{4})$ one should first understand $BM(k,E(2),R_{N})$. This new problem cannot be attacked with the available techniques for computations of groups of type BM, [20], [10], [11]. Those computations were achieved by finding suitable invariants for a class by means of a Skolem-Noether-like theory. In the Appendix we underline some obstacles to the application of these techniques to the computation of $BM(k,E(2),R_{N})$: the set of elements represented by algebras for which the action of one of the standard nilpotent generators of $E(2)$ is inner coincides with the set of classes represented by ${\mathbb{Z}}_{2}$-graded central simple algebras and this is not a subgroup of $BM(k,E(2),R_{N}),$ Theorems 6.1, 6.3. Moreover, $BM(k,E(2),R_{N})$ seems to be much more complex than the groups of type BM treated until now since, according to Proposition 5.3, each group $BM(k,H_{4},R_{t})$ may be viewed as a subgroup of it. ## 1 Preliminaries In this paper $k$ is a field, $H$ will denote a Hopf algebra over $k$ with bijective antipode $S$, coproduct $\Delta$ and counit $\varepsilon$. Tensor products $\otimes$ will be over $k$ and, for vector spaces $V$ and $W$, the usual flip map is denoted by $\tau:V\otimes W\to W\otimes V$. We shall adopt the Sweedler-like notations $\Delta(h)=h_{(1)}\otimes h_{(2)}$ and $\rho(m)=m_{(0)}\otimes m_{(1)}$ for coproducts and right comodule structures respectively. For $H$ coquasitriangular (resp. quasitriangular), the set of all coquasitriangular (resp. quasitriangular) structures will be denoted by $\cal U$ (resp. $\cal T$). Yetter-Drinfeld modules. Let us recall that if $A$ is a left $H$-module with action $\cdot$ and a right $H$-comodule with coaction $\rho$ the two structures combine to a left module structure for the Drinfeld double $D(H)=H^{*,cop}\bowtie H$ of $H$ (cfr. [15]) if and only if they satisfy the so-called Yetter-Drinfeld compatibility condition: $\rho(l\cdot b)=l_{(2)}\cdot b_{(0)}\otimes l_{(3)}b_{(1)}S^{-1}(l_{(1)}),\quad\forall l\in H,b\in A.$ (1.1) Modules satisfying this condition are usually called Yetter-Drinfeld modules. If $A$ is a left $H$-module algebra and a right $H^{op}$-comodule algebra satisfying (1.1) we shall call it a Yetter-Drinfeld $H$-module algebra. The Brauer group (see [7], [8]). Suppose that $A$ is a Yetter-Drinfeld $H$-module algebra. The $H$-opposite algebra of $A$, denoted by $\overline{A}$, is the underlying vector space of $A$ endowed with product $a\circ c=c_{(0)}(c_{(1)}\cdot a)$ for every $a,c\in A$. The same action and coaction of $H$ on $A$ turn $\overline{A}$ into a Yetter-Drinfeld $H$-module algebra. Given two Yetter-Drinfeld $H$-module algebras $A$ and $B$ we can construct a new Yetter-Drinfeld module $A\\#B$ whose underlying vector space is $A\otimes B$, with action $h\cdot(a\otimes b)=h_{(1)}\cdot a\otimes h_{(2)}\cdot b$ and with coaction $a\otimes b\mapsto a_{(0)}b_{(0)}\otimes b_{(1)}a_{(1)}$. This object becomes a Yetter-Drinfeld module algebra if we provide it with the multiplication $(a\\#b)(c\\#d)=ac_{(0)}\\#(c_{(1)}\cdot b)d.$ For every finite dimensional Yetter-Drinfeld module $M$ the algebras ${\rm End}(M)$ and ${\rm End}(M)^{op}$ can be naturally provided of a Yetter- Drinfeld module algebra structure through (1.2) and (1.3) below respectively: $\begin{array}[]{l}(h\cdot f)(m)=h_{(1)}\cdot f(S(h_{(2)})\cdot m),\vspace{2pt}\\\ \rho(f)(m)=f(m_{(0)})_{(0)}\otimes S^{-1}(m_{(1)})f(m_{(0)})_{(1)},\end{array}$ (1.2) $\begin{array}[]{l}(h\cdot f)(m)=h_{(2)}\cdot f(S^{-1}(h_{(1)})\cdot m),\vspace{2pt}\\\ \rho(f)(m)=f(m_{(0)})_{(0)}\otimes f(m_{(0)})_{(1)}S(m_{(1)}),\end{array}$ (1.3) where $h\in H,f\in End(M),m\in M.$ A finite dimensional Yetter-Drinfeld module algebra $A$ is called $H$-Azumaya if the following module algebra maps are isomorphisms: $\begin{array}[]{ll}F\colon A\\#{\overline{A}}\rightarrow{\rm End}(A),&F(a\\#b)(c)=ac_{(0)}(c_{(1)}\cdot b),\vspace{2pt}\\\ G\colon\overline{A}\\#{{A}}\rightarrow{\rm End}(A)^{op},&G(a\\#b)(c)=a_{(0)}(a_{(1)}\cdot c)b.\end{array}$ (1.4) The algebras ${\rm End}(M)$ and ${\rm End}(M)^{op}$, for a finite dimensional Yetter-Drinfeld module $M$, provided with the preceding structures are $H$-Azumaya. The following relation $\sim$ established on the set of isomorphism classes of $H$-Azumaya algebras is an equivalence relation: $A\sim B$ if there exist finite dimensional Yetter-Drinfeld modules $M$ and $N$ such that $A\\#{\rm End}(M)\cong B\\#{\rm End}(N)$ as Yetter-Drinfeld module algebras. The set of equivalence classes of $H$-Azumaya algebras, denoted by $BQ(k,H)$, is a group with product $[A][B]=[A\\#B]$, inverse element $[\overline{A}]$ and identity element $[End(M)]$ for finite dimensional Yetter-Drinfeld modules $M$. This group is called the full Brauer group of $H$. The adjective full is used to distinguish it from the subgroups presented next, that receive the same name in the literature. Given a left $H$-module algebra $A$ with action $\cdot$ and a quasitriangular structure $R=R^{(1)}\otimes R^{(2)}$ on $H$, a right $H^{op}$-comodule algebra structure $\rho$ on $A$ is determined by $\rho(a)=(R^{(2)}\cdot a)\otimes R^{(1)},\quad\forall a\in A.$ We will call this coaction the coaction induced by $\cdot$ and $R$. It is well-known that $(A,\cdot,\rho)$ satisfies the Yetter-Drinfeld condition. This allows the definition of the subgroup $BM(k,H,R)$ of $BQ(k,H)$ whose elements are equivalence classes of $H$-Azumaya algebras with coaction induced by $R$ ([8, §1.5]). To underline that a representative $A$ of a given class in $BQ(k,H)$ represents a class in $BM(k,H,R)$ we shall say that $A$ is an $(H,R)$-Azumaya algebra. The inclusion map will be denoted by $i\colon BM(k,H,R)\to BQ(k,H)$. For $H$ finite dimensional $BQ(k,H)=BM(k,D(H),{\cal R}),$ where ${\cal R}$ is the natural quasitriangular structure on the Drinfeld double $D(H)$. Dually, given a right $H^{op}$-comodule algebra $A$ with coaction $\varrho$ and a coquasitriangular structure $r$ on $H$, a $H$-module algebra structure $\cdot$ on $A$ is determined by $h\cdot a=a_{(0)}r(h\otimes a_{(1)}),\quad\forall a\in A,h\in H,$ and $(A,\cdot,\varrho)$ becomes a Yetter-Drinfeld module algebra. We will call this action the action induced by $\chi$ and $r$. The subset $BC(k,H,r)$ of $BQ(k,H)$ consisting of those classes admitting a representative whose action is induced by $r$ is a subgroup ([8, §1.5]). To stress that a representative $A$ of a class in $BQ(k,H)$ represents a class in $BC(k,H,r)$ we shall say that $A$ is an $(H,r)$-Azumaya algebra. The inclusion of $BC(k,H,r)$ in $BQ(k,H)$ will be denoted by $\iota\colon BC(k,H,r)\to BQ(k,H)$. On Sweedler Hopf algebra. In the sequel we will assume that $char(k)\neq 2.$ Let $H_{4}$ be Sweedler Hopf algebra, that is, the Hopf algebra over $k$ generated by a grouplike element $g$ and an element $h$ with relations, coproduct and antipode: $g^{2}=1,\quad h^{2}=gh+hg=0,\quad\Delta(h)=1\otimes h+h\otimes g,\quad S(g)=g,\quad S(h)=gh.$ The Hopf algebra $H_{4}$ has a family of quasitriangular (indeed triangular) structures. They were classified in [18] and are given by: $R_{t}=\frac{1}{2}(1\otimes 1+1\otimes g+g\otimes 1-g\otimes g)+\frac{t}{2}(h\otimes h+h\otimes gh+gh\otimes gh-gh\otimes h),$ where $t\in k$. It is well-known that $H_{4}$ is self-dual so that $H_{4}$ is also cotriangular. Let $\\{1^{*},g^{*},h^{*},(gh)^{*}\\}$ be the basis of $H^{*}_{4}$ dual to $\\{1,g,h,gh\\}$. We will often make use of the Hopf algebra isomorphism $\begin{array}[]{rl}\phi\colon H_{4}&\to H_{4}^{*}\\\ 1&\mapsto 1^{*}+g^{*}=\varepsilon\\\ h&\mapsto h^{*}+(gh)^{*}\\\ g&\mapsto 1^{*}-g^{*}\\\ gh&\mapsto h^{*}-(gh)^{*}.\end{array}$ So, the cotriangular structures of $H_{4}$ can be obtained applying the isomorphism $\phi\otimes\phi$ to the $R_{t}$’s. They are: $\begin{array}[]{c|rrrr}r_{t}&1&g&h&gh\\\ \hline\cr 1&1&1&0&0\\\ g&1&-1&0&0\\\ h&0&0&t&-t\\\ gh&0&0&t&t\\\ \end{array}$ The Drinfeld double $D(H_{4})=H_{4}^{*,cop}\bowtie H_{4}$ of $H_{4}$ is isomorphic to the Hopf algebra generated by $\phi(h)\bowtie 1$, $\phi(g)\bowtie 1$, $\varepsilon\bowtie g$ and $\varepsilon\bowtie h$ with relations: $\begin{array}[]{l}(\phi(h)\bowtie 1)^{2}=0;\\\ (\phi(g)\bowtie 1)^{2}=\varepsilon\bowtie 1;\\\ (\phi(h)\bowtie 1)(\phi(g)\bowtie 1)+(\phi(g)\bowtie 1)(\phi(h)\bowtie 1)=0;\\\ (\varepsilon\bowtie h)^{2}=0;\\\ (\varepsilon\bowtie h)(\varepsilon\bowtie g)+(\varepsilon\bowtie g)(\varepsilon\bowtie h)=0;\\\ (\varepsilon\bowtie g)^{2}=\varepsilon\bowtie 1;\\\ (\phi(h)\bowtie 1)(\varepsilon\bowtie g)+(\varepsilon\bowtie g)(\phi(h)\bowtie 1)=0;\\\ (\phi(g)\bowtie 1)(\varepsilon\bowtie h)+(\varepsilon\bowtie h)(\phi(g)\bowtie 1)=0;\\\ (\varepsilon\bowtie g)(\phi(g)\bowtie 1)=(\phi(g)\bowtie 1)(\varepsilon\bowtie g);\\\ (\phi(h)\bowtie 1)(\varepsilon\bowtie h)-(\varepsilon\bowtie h)(\phi(h)\bowtie 1)=(\phi(g)\bowtie 1)-(\varepsilon\bowtie g)\end{array}$ and with coproduct induced by the coproducts in $H_{4}$ and $H_{4}^{*,cop}$. For $l\in H_{4}$ we will sometimes write $\phi(l)$ instead of $\phi(l)\bowtie 1$ and $l$ instead of $1\bowtie l$ for simplicity. Let us recall that a Yetter-Drinfeld $H_{4}$-module $M$ with action $\cdot$ and coaction $\rho$ becomes a $D(H_{4})$-module by letting $1\bowtie l$ act as $l$ for every $l\in H_{4}$ and $(\phi(l)\bowtie 1).m=m_{(0)}(\phi(l)(m_{(1)}))$ for $m\in M$. Conversely, a $D(H_{4})$-module $M$ becomes naturally a Yetter-Drinfeld module with $H_{4}$-action obtained by restriction and $H_{4}$-coaction given by $\rho(m)=\frac{1}{2}(\phi(1+g).m\otimes 1+\phi(1-g).m\otimes g+\phi(h+gh).m\otimes h+\phi(h-gh)\otimes gh).$ We will often switch from one notation to the other according to convenience. Centers and centralizers. If $A$ is a Yetter-Drinfeld $H$-module algebra, and $B$ is a Yetter-Drinfeld submodule algebra of $A$, the left and the right centralizer of $B$ in $A$ are defined to be: $C^{l}_{A}(B):=\\{a\in A~{}|~{}ba=a_{(0)}(a_{(1)}\cdot b)\ \forall b\in B\\},$ $C^{r}_{A}(B):=\\{a\in A~{}|~{}ab=b_{(0)}(b_{(1)}\cdot a)\ \forall b\in B\\}.$ For the particular case $B=A$ we have the right center $Z^{r}(A)$ and the left center $Z^{l}(A)$ of $A$. Both are trivial when $A$ is $H$-Azumaya, [8, Proposition 2.12]. ## 2 Some low dimensional representatives in $BQ(k,H_{4})$ In this section we shall introduce a family of 2-dimensional representatives of classes in $BQ(k,H_{4})$ that will turn out to be easy to compute with. They appeared for the first time in [16] and a particular case of them is treated in [1, Section 1.5]. Let $a,\,t,\,s\in k$. The algebra $C(a)$ generated by $x$ with relation $x^{2}=a$ is acted upon by $H_{4}$ by $g\cdot 1=1,\quad g\cdot x=-x,\quad h\cdot 1=0,\qquad h\cdot x=t,$ and it is a right $H_{4}$-comodule via $\rho_{s}(1)=1\otimes 1,\quad\quad\rho_{s}(x)=x\otimes g+s\otimes h.$ It is not hard to check that $C(a)$ with this action and coaction is a left $H_{4}$-module algebra and a right $H^{op}$-comodule algebra. We shall denote it by $C(a;t,s)$. ###### Lemma 2.1 Let notation be as above. 1. (1) $C(a;t,s)$ is a Yetter-Drinfeld module algebra with the preceding structures. 2. (2) As a module algebra $C(a;t,s)\cong C(a^{\prime};t^{\prime},s^{\prime})$ if and only if there is $\alpha\in k^{\cdot}$ such that $a=\alpha^{2}a^{\prime}$ and $t=\alpha t^{\prime}$. 3. (3) As a comodule algebra $C(a;t,s)\cong C(a^{\prime};t^{\prime},s^{\prime})$ if and only if there is $\alpha\in k^{\cdot}$ such that $a=\alpha^{2}a^{\prime}$ and $s=\alpha s^{\prime}$. 4. (4) As a Yetter-Drinfeld module algebra $C(a;t,s)\cong C(a^{\prime};t^{\prime},s^{\prime})$ if and only if there exists $\alpha\in k^{\cdot}$ such that $a=\alpha^{2}a^{\prime}$, $t=\alpha t^{\prime}$ and $s=\alpha s^{\prime}$. 5. (5) The module structure on $C(a;t,s)$ is induced by its comodule structure and a cotriangular structure $r_{l}$ if and only if $t=sl$. 6. (6) The comodule structure on $C(a;t,s)$ is induced by its module structure and a triangular structure $R_{l}$ if and only if $s=lt$. 7. (7) The $H_{4}$-opposite algebra of $C(a;t,s)$ is $C(st-a;t,s)$. 8. (8) $C(a;t,s)$ is an $H_{4}$-Azumaya algebra if and only if $2a\neq st$. Proof: Let $x$ and $y$ be algebra generators in $C(a;t,s)$ and $C(a^{\prime};t^{\prime},s^{\prime})$ respectively with $x^{2}=a$ and $y^{2}=a^{\prime}$. (1) We verify condition (1.1) for $b=x$ and $l=h$. The other cases are easier to check. $\begin{array}[]{l}h_{(2)}\cdot x_{(0)}\otimes h_{(3)}x_{(1)}S^{-1}(h_{(1)})\\\ \hskip 48.36958pt=g\cdot x\otimes(-gh)+g\cdot s\otimes(gh)(-gh)+h\cdot x\otimes g^{2}\\\ \hskip 56.9055pt+h\cdot s\otimes gh+x\otimes hg+s\otimes h^{2}\\\ \hskip 48.36958pt=x\otimes gh+t\otimes 1-x\otimes gh\\\ \hskip 48.36958pt=\rho_{s}(h\cdot x).\end{array}$ (2) An algebra isomorphism $f\colon C(a;t,s)\to C(a^{\prime};t^{\prime},s^{\prime})$ must map $x$ to $\alpha y$ for some $\alpha\in k^{\cdot}$. Then $a=x^{2}=(\alpha y)^{2}=\alpha^{2}a^{\prime}$. Besides, $h.f(x)=f(h.x)$ implies $t^{\prime}\alpha=t$. It is easy to verify that the condition is also sufficient. (3) In the above setup $\rho_{s^{\prime}}(f(x))=(f\otimes{\rm id})\rho_{s}(x)$ implies $s^{\prime}\alpha=s$. It is not hard to check that this condition is also sufficient. (4) It follows from the preceding statements. (5) If the module structure on $C(a;t,s)$ is induced by its comodule structure $\rho_{s}$ and some $r_{l}\in{\cal U},$ then $t=h\cdot x=xr_{l}(h\otimes g)+sr_{l}(h\otimes h)=sl.$ Conversely, if $t=sl$, then $\begin{array}[]{l}g\cdot 1=1=1r_{l}(g\otimes 1);\qquad h\cdot 1=0=1r_{l}(h\otimes 1);\vspace{2pt}\\\ g\cdot x=-x=xr_{l}(g\otimes g)+sr_{l}(g\otimes h)=x_{(0)}r_{l}(g\otimes x_{(1)});\vspace{2pt}\\\ h\cdot x=t=xr_{l}(h\otimes g)+sr_{l}(h\otimes h)=x_{(0)}r_{l}(h\otimes x_{(1)}).\end{array}$ Therefore the action is induced by the coaction and $r_{l}$. (6) If the comodule structure on $C(a;t,s)$ is induced by the action and some $R_{l}\in{\cal T},$ then $x\otimes g+s\otimes h=\rho_{s}(x)=(R_{l}^{(2)}\cdot x)\otimes R_{l}^{(1)}=\frac{1}{2}(2x\otimes g)+\frac{l}{2}(2t\otimes h)=x\otimes g+lt\otimes h$ hence $s=lt$. Conversely, if $s=lt$ then $\begin{array}[]{l}\rho_{s}(1)=1\otimes 1=(R_{l}^{(2)}\cdot 1)\otimes R_{l}^{(1)},\\\ \rho_{s}(x)=x\otimes g+s\otimes h=(R_{l}^{(2)}\cdot x)\otimes R_{l}^{(1)},\end{array}$ so the comodule structure is induced by the action and $R_{l}$. (7) $\overline{C(a;t,s)}$ has $1,\,x$ as a basis and $1$ is the unit. The action and coaction on $1$ and $x$ are as for $C(a;t,s)$. By direct computation, $x\circ x=x(g\cdot x)+s(h\cdot x)=-a+st,$ so $\overline{C(a;t,s)}=C(st-a;t,s)$. (8) The algebra $C(a;t,s)$ is $H_{4}$-Azumaya if and only if the maps $F$ and $G$ defined in (1.4) are isomorphisms. The space $C(a;t,s)\\#C(a;t,s)$ has ordered basis $1\\#1,\,1\\#x,\,x\\#1,\,x\\#x$ while ${\rm End}(C(a;t,s))$ has basis $1^{*}\otimes 1,\,1^{*}\otimes x,\,x^{*}\otimes 1,\,x^{*}\otimes x$ with the usual identification $C(a;t,s)^{*}\otimes C(a;t,s)\cong{\rm End}(C(a;t,s))$. Then for every $b,c\in C(a;t,s)$ we have $\begin{array}[]{l}F(b\\#c)(1)=bc,\quad F(b\\#c)(x)=bx(g\cdot c)+sb(h\cdot c),\vspace{2pt}\\\ G(1\\#b)(c)=cb,\quad G(x\\#b)(c)=x(g\cdot c)b+s(h\cdot c)b.\end{array}$ The matrices associated with $F$ and $G$ with respect to the given bases are respectively $\left(\begin{array}[]{cccc}1&0&0&a\\\ 0&1&1&0\\\ 0&st-a&a&0\\\ 1&0&0&st-a\end{array}\right)\qquad\left(\begin{array}[]{cccc}1&0&0&a\\\ 0&1&1&0\\\ 0&a&st-a&0\\\ 1&0&0&st-a\end{array}\right)$ whose determinants $-(st-2a)^{2}$ and $(st-2a)^{2}$ are nonzero if and only if $2a\neq st$. $\Box$ We have seen so far that the algebras $C(a;s,t)$ can be viewed as representatives of classes in $BM(k,H_{4},R_{l})$ or in $BC(k,H_{4},r_{l})$ for suitable $l\in k$. It is known that these groups are all isomorphic to $(k,+)\times BW(k),$ where $BW(k)$ is the Brauer-Wall group of $k$. We aim to find to which pair $(\beta,[A])\in(k,+)\times BW(k)$ do the class of $C(a;t,s)$ correspond. The group $BM(k,H_{4},R_{0})$ was computed in [20]. The computation of $BC(k,H_{4},r_{0})$ follows from self-duality of $H_{4}$. It was shown in [9] that all groups $BC(k,H_{4},r_{t})$ (hence, dually, all $BM(k,H_{4},R_{t})$) are isomorphic. We shall use the description of $BM(k,E(1),R_{t})$ given in [11] beause this might allow generalizations. In the mentioned paper the Brauer group $BM(k,E(n),R_{0})$ is computed for the family of Hopf algebras $E(n)$, where $E(1)=H_{4}$. We shall recall first where do the isomorphism of the different Brauer groups $BC$ and $BM$ stem from. The notion of lazy cocycle plays a key role here. We recall from [3] that a lazy cocycle on $H$ is a left 2-cocycle $\sigma$ such that twisting $H$ by $\sigma$ does not modify the product in $H$. In other words: for every $h,l,m\in H,$ $\sigma(h_{(1)}\otimes l_{(1)})\sigma(h_{(2)}l_{(2)}\otimes m)=\sigma(l_{(1)}\otimes m_{(1)})\sigma(h\otimes l_{(2)}m_{(2)})$ (2.1) $\sigma(h_{(1)}\otimes l_{(1)})h_{(2)}l_{(2)}=h_{(1)}l_{(1)}\sigma(h_{(2)}\otimes l_{(2)})$ (2.2) It turns out that a lazy left cocycle is also a right cocycle. Given a lazy cocycle $\sigma$ for $H$ and a $H^{op}$-comodule algebra $A$, we may construct a new $H^{op}$-comodule algebra $A_{\sigma}$, which is equal to $A$ as a $H^{op}$-comodule, but with product defined by: $a\bullet b=a_{(0)}b_{(0)}\sigma(a_{(1)}\otimes b_{(1)}).$ The group of lazy cocycles for $H_{4}$ is computed in [3]. Lazy cocycles are parametrized by elements $t\in k$ as follows: $\begin{array}[]{c|rrrr}\sigma_{t}&1&g&h&gh\\\ \hline\cr 1&1&1&0&0\\\ g&1&1&0&0\\\ h&0&0&\frac{t}{2}&\frac{t}{2}\\\ gh&0&0&\frac{t}{2}&-\frac{t}{2}\\\ \end{array}$ We have the following group isomorphisms: 1. (2.3) $\Psi_{t}:BC(k,H_{4},r_{0})\rightarrow BC(k,H_{4},r_{t}),[A]\mapsto[A_{\sigma_{t}}],$ constructed in [9, Proposition 3.1]. 2. (2.4) $\Phi_{t}:BM(k,H_{4},R_{t})\rightarrow BC(k,H_{4},r_{t}),[A]\mapsto[A^{op}].$ We explain how $A^{op}$ is equipped with the corresponding structure. The left $H_{4}$-module algebra $A$ becomes a right $H_{4}^{*}$-comodule algebra. Then $A^{op}$ is a right $H_{4}^{*,op}$-comodule algebra. The quasitriangular structure $R_{t}$ is a coquasitriangular structure in $H_{4}^{*}$. Then $A^{op}$ may be endowed with the left $H_{4}^{*}$-action stemming from the comodule structure and $R_{t}$. On the other hand, $A^{op}$ may be viewed as an $H_{4}^{op}$-comodule algebra through the isomorphism $\phi:H_{4}\rightarrow H_{4}^{*}$. The coquasitriangular structure $R_{t}$ on $H_{4}^{*}$ corresponds to the coquasitriangular structure $r_{t}$ on $H_{4}$ via $\phi.$ An isomorphism between $BM(k,H_{4},R_{0})$ and $BM(k,H_{4},R_{t})$ can be constructed combining the above ones. Thus, the crucial step is to analyze the sought correspondence for $BM(k,H_{4},R_{0})$. The Brauer group $BM(k,H_{4},R_{0})$ is computed in [20] through the split exact sequence (see also [1, Theorem 3.8] for an alternative approach): $\textstyle{1\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{(k,+)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{BM(k,H_{4},R_{0})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{j^{*}}$$\textstyle{BW(k)\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi^{*}}$$\textstyle{1.}$ The map $j^{*}:BM(k,H_{4},R_{0})\to BW(k),[A]\mapsto[A]$ is obtained by restricting the $H_{4}$-action of $A$ to a $k{\mathbb{Z}}_{2}$-action via the inclusion map $j:k{\mathbb{Z}}_{2}\rightarrow H_{4}$. This map is split by $\pi^{*}:BW(k)\rightarrow BM(k,H_{4},R_{0}),[B]\mapsto[B]$, where $B$ is considered as an $H_{4}$-module by restriction of scalars via the algebra projection $\pi:H_{4}\rightarrow k{\mathbb{Z}}_{2},g\mapsto g,h\mapsto 0$. A class $[A]$ lying in the kernel of $j^{*}$ is a matrix algebra with an inner action of $H_{4}$ such that the restriction to $k{\mathbb{Z}}_{2}$ is strongly inner. Thus there exist uniquely determined $u,w\in A$ such that $g\cdot a=uau^{-1},\quad h\cdot a=w(g\cdot a)-aw\quad\forall a\in A,$ (2.5) $u^{2}=1,\quad wu+uw=0,\quad w^{2}=\beta,$ (2.6) for certain $\beta\in k$. Mapping $[A]\mapsto\beta$ defines a group isomorphism $\chi\colon Ker(j^{*})\\\ \cong(k,+)$. We will determine $j^{*}([C(a;t,s)])$ and $\chi([C(a;t,s)]\pi^{*}j^{*}([C(a;t,s)]^{-1}))$ whenever this is well-defined. To this purpose, we will first describe all products of two algebras of type $C(a;t,s)$. ###### Lemma 2.2 Let $x,y$ be generators for $C(a;t,s)$ and $C(a^{\prime};t^{\prime},s^{\prime})$ respectively, with relations, $H_{4}$-actions and coactions as above. The product $C(a;t,s)\\#C(a^{\prime};t^{\prime},s^{\prime})$ is isomorphic to the generalized quaternion algebra with generators $X=x\\#1$ and $Y=1\\#y$, relations, $H_{4}$-action and and $H_{4}$-coaction: $X^{2}=a,\quad Y^{2}=a^{\prime},\quad XY+YX=st^{\prime},$ $g\cdot X=-X,\quad g\cdot Y=-Y,\quad h\cdot X=t,\quad h\cdot Y=t^{\prime},$ $\rho(X)=X\otimes g+s\otimes h,\quad\rho(Y)=Y\otimes g+s^{\prime}\otimes h.$ Proof: By direct computation: $X^{2}=(x\\#1)(x\\#1)=a\\#1,\quad Y^{2}=(1\\#y)(1\\#y)=a^{\prime}\\#1,\quad XY=x\\#y,$ $YX=(1\\#y)(x\\#1)=x\\#(g\cdot y)+s\\#(h\cdot y)=-XY+st^{\prime}\\#1.$ The formulas for the action and the coaction follow immediately from the definition of action and coaction on a $\\#$-product. $\Box$ Elements in $BW(k)$ are represented by graded tensor products of the following three type of algebras: $C(1)$ generated by the odd element $x$ with $x^{2}=1$; classically Azumaya algebras having trivial ${\mathbb{Z}}_{2}$-action; and $C(a)\\#C(1),$ where $C(a)$ is generated by the odd element $y$ with $y^{2}=a\in k^{\cdot}$ ([13, Theorem IV.4.4]). ###### Proposition 2.3 For $a\neq 0$ let $[C(a;t,0)]\in BM(k,H_{4},R_{0})$ denote the class of $C(a;t,0).$ Then $[C(a;t,0)]=(t^{2}(4a)^{-1},[C(a)])\in(k,+)\times BW(k),$ so the group $BM(k,H_{4},R_{0})$ is generated by $BW(k)$ and the classes $[C(a;1,0)]$. Proof: It is clear that if $a\neq 0$ then $j^{*}([C(a;t,0)])=[C(a)]$ and that $\pi^{*}([C(a)])=[C(a;0,0)]$. Thus, $[C(a;t,0)\\#C(-a;0,0)]\in{\rm Ker}(j^{*})$. We shall compute its image through $\chi$. By Lemma 2.2, $C(a;t,0)\\#C(-a;0,0)$ is generated by $X$ and $Y$ with relations, $H_{4}$-action and $H_{4}$-coaction: $X^{2}=a,\quad Y^{2}=-a,\quad XY+YX=0,$ $g\cdot X=-X,\quad g\cdot Y=-Y,\quad h\cdot X=t,\quad h\cdot Y=0,$ $\rho(X)=X\otimes g,\quad\rho(Y)=Y\otimes g.$ We look for the element $w$ satisfying (2.5) and (2.6). This element must be odd with respect to the ${\mathbb{Z}}_{2}$-grading induced by the $g$-action, hence $w=\lambda X+\mu Y$ for some $\lambda,\mu\in k$. Condition $h\cdot X=-wX-Xw$ implies $t=-2\lambda a$ and condition $h\cdot Y=-wY-Yw$ implies $0=-2\mu a$ so $w^{2}=a\lambda^{2}=t^{2}(4a)^{-1}$. Thus $[C(a;t,0)]=(t^{2}(4a)^{-1},[C(a)])$ and we have the first statement. For the second one, let $(\beta,[A])\in(k,+)\times BW(k)$. If $\beta=0$ there is nothing to prove. If $\beta\neq 0$, the class $[C((4\beta)^{-1}t^{2};t,0)]=[C((4\beta)^{-1};1,0)]=(\beta,[C((4\beta)^{-1})])$, so $BM(k,H_{4},R_{0})\cong(k,+)\times BW(k)$ is generated by $BW(k)$ and the $[C(a;1,0)]$ for $a\neq 0.$ $\Box$ ###### Lemma 2.4 Let $A$ be a $D(H_{4})$-module algebra. 1. (1) If the $h$-action on $A$ is trivial, then $A$ is $(H_{4},R_{0})$-Azumaya if and only if it is $(H_{4},R_{t})$-Azumaya for every $t\in k$. 2. (2) If the $\phi(h)$-action on $A$ is trivial, then $A$ is $(H_{4},r_{0})$-Azumaya if and only if it is $(H_{4},r_{t})$-Azumaya for every $t\in k$. 3. (3) The representatives of $BW(k)$ in $BC(k,H_{4},r_{t})$ and $BM(k,H_{4},R_{s})$ all coincide when viewed inside $BQ(k,H_{4})$. Proof: (1) It follows from the form of the elements in ${\cal T}$ that if $A$ is $(H_{4},R_{0})$-Azumaya and the action of $h$ on $A$ is trivial (i.e., if it lies in $BW(k)$), then its comodule structure $\rho_{t}$ induced by $R_{t}$ coincides with the comodule structure $\rho_{0}$ induced by $R_{0}$. Hence, the maps $F$ and $G$ with respect to the action and $\rho_{t}$ are the same as the maps $F$ and $G$ with respect to the action and $\rho_{0}$, so $A$ is $(H_{4},R_{t})$-Azumaya for every $t\in k$. (2) It is proved as (1). (3) The first statement shows that the representatives of $BW(k)$ inside the different $BM(k,H_{4},R_{t})$ coincide. The second statement shows the same for $BC(k,H_{4},r_{t})$. Therefore we may assume $s=t=0$. The elements of this copy of $BW(k)$ consist of ${\mathbb{Z}}_{2}$-graded Azumaya algebras $A$ where the grading is induced by the action of $g$. The $h$-action is trivial. If the coaction $\rho$ is induced by $R_{0}$, then $a\in A$ is odd if and only if $\rho(a)=a\otimes g$. The action $\rightharpoonup$ induced on $A$ by $r_{0}$ and $\rho$ is as follows: $h\rightharpoonup a=0$ for every $a\in A$ and $g\rightharpoonup a=-a$ if and only if $\rho(a)=a\otimes g$, that is, the original action on $A$ and $\rightharpoonup$ coincide. Thus, the maps $F$ and $G$ coincide in all cases and $A$ represents an element in $BW(k)\subset BM(k,H_{4},R_{0})$ if and only if it represents an element in $BW(k)\subset BC(k,H_{4},r_{0})$. $\Box$ ###### Proposition 2.5 The group $BC(k,H_{4},r_{s})$ is generated by the Brauer-Wall group and the classes $[C(a;s,1)]$ for $2a\neq s$. Proof: We will first deal with the case $s=0$. We will show that the isomorphism $\Phi_{0}:BM(k,H_{4},R_{0})\rightarrow BC(k,H_{4},r_{0}),$ $[A]\mapsto[A^{op}]$ in (2.4) maps $[C(a;1,0)]$ to $[C(a;0,1)]$ and $BW(k)\subset BM(k,H_{4},R_{0})$ to $BW(k)\subset BC(k,H_{4},r_{0})$. The class $[C(a;1,0)]$ is mapped to the class of the algebra $C(a)^{op}$ with comodule structure $\rho(x)=x\otimes(1^{*}-g^{*})+1\otimes(h^{*}+(gh)^{*})=x\otimes\phi(g)+1\otimes\phi(h)$ and $H_{4}$-action induced by the cotriangular structure $r_{0}$, that is, $g\cdot x=-x$ and $h\cdot x=0$. The algebra $C(a)^{op}$ with these structures is just $C(a;0,1)$. Let $A$ be a representative of a class in $BW(k)\subset BM(k,H_{4},R_{0})$ with action $\cdot$ for which $h\cdot a=0$ for all $a\in A$. The class $[A]$ is mapped by $\Phi_{0}$ to the class of $A^{op}$ with coaction $\rho(a)=a\otimes 1^{*}+(g\cdot a)\otimes g^{*}+(h\cdot a)\otimes h^{*}+(gh\cdot a)\otimes(gh)^{*}\in A\otimes\phi(k{\mathbb{Z}}_{2}).$ Therefore $[A^{op}]\in BW(k)\subset BC(k,H_{4},r_{0})$. We now take $s\in k$ arbitrary and use the isomorphism $\Psi_{s}:BC(k,H_{4},r_{0})\rightarrow BC(k,H_{4},r_{s})$ in (2.3) to prove the statement. We will show that $[C(a;0,1)]$ is mapped to $[C(a+2^{-1}s;s,1)]$ through $\Psi_{s}$. Recall that $\Psi_{s}$ maps the class of $C(a;0,1)$ to the class of the algebra $C(a;0,1)_{\sigma_{s}}$. It is generated by $x$ with relation $x\bullet x=x^{2}\sigma_{s}(g\otimes g)+x\sigma_{s}(h\otimes g)+x\sigma_{s}(g\otimes h)+\sigma_{s}(h\otimes h)=a+\frac{s}{2},$ with (same) coaction $\rho(x)=x\otimes g+1\otimes h$ and action induced by $\rho$ and $r_{s}$, that is: $g\cdot x=r_{s}(g\otimes g)x+r_{s}(g\otimes h)=-x,\quad h\cdot x=r_{s}(h\otimes g)x+r_{s}(h\otimes h)=s.$ Then $\Psi_{s}([C(a;0,1)])=[C(a+\frac{s}{2};s,1)]$. Since the coaction is not changed by $\Psi_{s}$ the class of an element $A$ for which the image of the coaction is in $A\otimes k{\mathbb{Z}}_{2}$ is again of this form. Hence the classes in $BW(k)\subset BC(k,H_{4},r_{0})$ correspond to the classes in $BW(k)\subset BC(k,H_{4},r_{s})$. $\Box$ ###### Proposition 2.6 The group $BM(k,H_{4},R_{t})$ is generated by the Brauer-Wall group and the classes $[C(a;1,t)]$ for $2a\neq t$. Proof: Through the isomorphism $\Phi_{t}:BM(k,H_{4},R_{t})\rightarrow BC(k,H_{4},r_{t})$ in (2.4), the class $[C(a;1,t)]$ is mapped to $[C(a;t,1)]$ and the classes in $BW(k)\subset BM(k,H_{4},R_{t})$ correspond to the classes in $BW(k)\subset BC(k,H_{4},r_{t})$. The $H_{4}$-comodule structure on the algebra $C(a)^{op}$ is: $\rho(x)=x\otimes(1^{*}-g^{*})+1\otimes(h^{*}+(gh)^{*})=x\otimes\phi(g)+1\otimes\phi(h)$ The $H_{4}$-action induced by the cotriangular structure $r_{t}$ on $H_{4}$ gives $h\cdot x=t$. Therefore this algebra is $C(a;t,1)$. Finally, the statement concerning $BW(k)$ is proved as in the preceding theorem. $\Box$ ###### Remark 2.7 That $BM(k,H_{4},R_{t})$ is generated by $BW(k)$ and the classes $[C(a;1,t)]$ for $2a\neq t$ was first discovered in [1, Theorem 3.8 and Page 392] as a consequence of the Structure Theorems for $(H_{4},R_{t})$-Azumaya algebras. Since we will strongly use Proposition 2.6 later, for the reader’s convenience we offered this alternative and self-contained approach. Notice that it mainly relies on Lemma 2.2 that will be another key result for us in the sequel. ## 3 Fitting $BM(k,H_{4},R_{t})$ and $BC(k,H_{4},r_{s})$ into $BQ(k,H_{4})$ As groups $BM(k,H_{4},R_{t})\cong BC(k,H_{4},r_{s})$ for every $s,t\in k$. However, their images in $BQ(k,H_{4})$ through the natural embeddings $i_{t}\colon BM(k,H_{4},R_{t})\to BQ(k,H_{4})\quad\textrm{and}\quad\iota_{s}\colon BC(k,H_{4},r_{s})\to BQ(k,H_{4})$ do not coincide in general. In this section we will describe the mutual intersections of these images. ###### Proposition 3.1 Let $0\neq t\in k$ then $Im(i_{t})=Im(\iota_{t^{-1}})$ Proof: Given $t\neq 0$, by Lemma 2.1, $[C(a;1,t)]\in Im(i_{t})\cap Im(\iota_{t^{-1}})$ for every $a\neq 2t.$ Besides, by Lemma 2.4, $i_{t}(BW(k))=\iota_{s}(BW(k))$ for any $s\in k$. Since the elements of $BW(k)$ and the $[C(a;1,t)]$’s generate $BM(k,H_{4},R_{t})$ and $BC(k,H_{4},r_{t^{-1}})$ we are done. $\Box$ Given $[A]$ in $BQ(k,H_{4})$, there are two natural ${\mathbb{Z}}_{2}$-gradings on $A$, the one coming from the $g$-action, for which $|a|=1$ iff $g\cdot a=-a$ for $0\neq a\in A$ and the one arising from the coaction, for which $\deg(a)=1$ if and only if $({\rm id}\otimes\pi)\rho(a)=a\otimes g$ where $\pi$ is the projection onto $k{\mathbb{Z}}_{2}$. If we view $A$ as a $D(H_{4})$-module, the grading $|\cdot|$ is associated with the $1\bowtie g$-action whereas the grading $\deg$ is associated with the $\phi(g)\bowtie 1$-action. Let us observe that for the classes $C(a;t,s)$ the two natural gradings coincide, for every $a,\,t,\,s\in k$. ###### Lemma 3.2 Let $[A]\in BQ(k,H_{4})$ and $[B]$ in $i_{0}(BW(k))$. As a $H_{4}$-module algebra, * (1) $A\\#B\cong A\widehat{\otimes}B$, the ${\mathbb{Z}}_{2}$-graded tensor product with respect to the $\deg$-grading on $A$ and the natural $|\cdot|$-grading on $B$. * (2) $B\\#A\cong B\widehat{\otimes}A$, the ${\mathbb{Z}}_{2}$-graded tensor product with respect to the $|\cdot|$-grading on $A$ and the natural $|\cdot|$-grading on $B$. Proof: The two gradings on $B$ coincide and we have, for homogeneous $b\in B$ and $c\in A$ (for the $\deg$-grading): $(a\\#b)(c\\#d)=ac_{(0)}\\#(c_{(1)}\cdot b)d=ac\\#(g^{\deg(c)}\cdot b)d=(-1)^{\deg(c)|b|}ac\\#bd.$ For homogeneous $b\in B$ and $c\in A$ (for the $|\cdot|$-grading): $(d\\#c)(b\\#a)=db_{(0)}\\#(b_{(1)}\cdot c)a=db\\#(g^{|b|}\cdot c)a=(-1)^{|c||b|}db\\#ca.$ $\Box$ It follows from Propositions 2.5, 2.6 and Lemma 3.2 that all elements in $Im(i_{t})$ and $Im(\iota_{t})$ can be represented by algebras for which the two ${\mathbb{Z}}_{2}$-gradings coincide, since this property is respected by the $\\#$-product. Indeed, this kind of representatives give rise to a subgroup that we will study in Section 5. We will show now that groups of type $BC$ or $BM$ either intersect only in $BW(k)$ or coincide and that the latter happens only in the situation of Proposition 3.1. ###### Theorem 3.3 Consider the class of $C(a;t,s)$ in $BQ(k,H_{4})$. Then: 1. (1) $[C(a;t,s)]\in Im(i_{l})$ if and only if $s=lt$; 2. (2) $[C(a;t,s)]\in Im(\iota_{l})$ if and only if $sl=t$. Proof: (1) We know from Lemma 2.1 that if the action (resp. coaction) of $C(a;t,s)$ comes from the cotriangular (resp. triangular) structure, then the indicated relations among the parameters hold. We only need to show that the condition is still necessary if we change representative in the class. Let us assume that $[C(a;t,s)]\in Im(i_{l})$ for some $l\in k$. Then $[C(a;t,s)]=[C(b;1,l)][A]=[A][C(b;1,l)]$ for some $[A]\in i_{l}(BW(k))$ and $b\in k$ with $2b\neq l$. Hence $[C(a;t,s)\\#C(l-b;1,l)]=[A]\in i_{l}(BW(k))$. We may choose $A$ so that the $h$-action and the $\phi(h)$-action on $A$ are trivial. Since $[C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}]$ is trivial in $BQ(k,H_{4})$, there is a $D(H_{4})$-module $P$ such that $C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}\cong{\rm End(P)}$ as $D(H_{4})$-module algebras. Then ${\rm End(P)}$ has a strongly inner $D(H_{4})$-action. In other words, there is a convolution invertible algebra map $\nu\colon D(H_{4})\to{\rm End}(P)$ such that $(m\bowtie n)\cdot f=\nu(m_{(2)}\bowtie n_{(1)})f\nu^{-1}(m_{(1)}\bowtie n_{(2)})$ for every $m\bowtie n\in D(H_{4}),f\in{\rm End(P)}$, where $\nu^{-1}$ denotes the convolution inverse of $\nu$. In particular, for $u=\nu(\varepsilon\bowtie g)$ and $w=\nu(\varepsilon\bowtie h)u$ we have $\begin{array}[]{l}g\cdot f=ufu^{-1},\quad h\cdot f=w(g\cdot f)-fw,\vspace{5pt}\\\ u^{2}=1,\quad w^{2}=0,\quad uw+wu=0.\end{array}$ We should be able to find $U,\,W\in C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}$ such that $\begin{array}[]{l}U^{2}=1,\quad g\cdot Z=UZU^{-1},\vspace{5pt}\\\ g\cdot W=-W,\quad W^{2}=0,\quad h\cdot Z=W(g\cdot Z)-ZW\end{array}$ for all $Z$ in $C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}.$ Using the presentation of $C(a;t,s)\\#C(l-b;1,l)$ in Lemma 2.2 we may write $W=\sum_{0\leq i,j\leq 1}X^{i}Y^{j}\\#\alpha_{ij}$ with $\alpha_{ij}\in\overline{A}$ homogeneous of degree $i+j+1\;{\rm mod}\ 2$ with respect to the $g$-grading. Since the action of $h$ on $1\\#\overline{A}$ is trivial we have, for homogeneous $\gamma\in\overline{A}$: $\begin{array}[]{ll}0&=h\cdot(1\\#\gamma)\vspace{2pt}\\\ &=W(g\cdot(1\\#\gamma))-(1\\#\gamma)W\vspace{2pt}\\\ &=(-1)^{|\gamma|}\sum_{0\leq i,j\leq 1}X^{i}Y^{j}\\#\alpha_{ij}\gamma-\sum_{0\leq i,j\leq 1}(X^{i}Y^{j})_{(0)}\\#((X^{i}Y^{j})_{(1)}\cdot\gamma)\alpha_{ij}\vspace{2pt}\\\ &=(-1)^{|\gamma|}[1\\#\alpha_{00}\gamma+Y\\#\alpha_{01}\gamma+X\\#\alpha_{10}\gamma+XY\\#\alpha_{11}\gamma]\vspace{2pt}\\\ &\phantom{=}-1\\#\gamma\alpha_{00}-Y\\#(-1)^{|\gamma|}\gamma\alpha_{01}-X\\#(-1)^{|\gamma|}\gamma\alpha_{10}-XY\\#\gamma\alpha_{11}.\end{array}$ From here we deduce that the odd elements $\alpha_{00},\alpha_{11}$ and the even elements $\alpha_{10},\alpha_{01}$ belong to the ${\mathbb{Z}}_{2}$-center of $\overline{A}.$ Hence $\alpha_{00},\alpha_{11}$ are zero and $\alpha_{10},\alpha_{01}$ are scalars. So, we can write $W=\alpha X\\#1+\beta Y\\#1$ for some $\alpha,\beta\in k$ and we will get: $\begin{array}[]{rl}\alpha t+\beta&=h\cdot W=-2W^{2}=0,\\\ t&=h\cdot(X\\#1)=\alpha(-2a+ts),\\\ 1&=h\cdot(Y\\#1)=-\alpha s-2\beta(l-b)=\alpha(-s+2t(l-b)).\end{array}$ Combining the second equation with the third one multiplied by $t$ and using $\alpha\neq 0$ we obtain $a=ts-t^{2}(l-b).$ (3.1) The $|\cdot|$-grading and the $\deg$-grading on $C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}$ coincide. Therefore: $\nu(\phi(g)\bowtie 1)f\nu(\phi(g)\bowtie 1)^{-1}=\phi(g)\cdot f=g\cdot f=ufu^{-1}\qquad\forall f\in{\rm End}(P).$ Since ${\rm End}(P)$ is central and $\nu$ is an algebra morphism, $u^{\prime}:=\nu(\phi(g)\bowtie 1)=\lambda u$ with $\lambda=\pm 1$ (both possibilities will be analyzed later). The element $w^{\prime}:=\nu(\phi(h)\bowtie 1)$ satisfies $\phi(h)\cdot f=w^{\prime}f-(\phi(g)\cdot f)w^{\prime}\qquad\forall f\in{\rm End}(P).$ Thus, we can take $W^{\prime}$ in $C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}$ such that $W^{\prime}U+UW^{\prime}=0,\quad(W^{\prime})^{2}=0\quad\phi(h)\cdot Z=W^{\prime}Z-(g\cdot Z)W^{\prime}$ for all $Z$ in $C(a;t,s)\\#C(l-b;1,l)\\#\overline{A}.$ Arguing as for $W$ before, we see that $W^{\prime}=\gamma X\\#1+\delta Y\\#1$ for some $\gamma,\delta\in k$. It follows from the last relation of $D(H_{4})$ in §1 that $\nu(\varepsilon\bowtie hg)\nu(\phi(h)\bowtie 1)+\nu(\phi(h)\bowtie 1)\nu(\varepsilon\bowtie hg)=\nu(\phi(g)\bowtie 1)\nu(\varepsilon\bowtie g)-\nu(\varepsilon\bowtie g)^{2}.$ This implies $WW^{\prime}+W^{\prime}W=\lambda-1.$ Besides, $0=\phi(h)\cdot W^{\prime}=2(W^{\prime})^{2}=s\gamma+\delta l.$ Now, by direct computation: $\begin{array}[]{rl}\lambda-1&=WW^{\prime}+W^{\prime}W\vspace{2pt}\\\ &=\alpha((X-tY)(\gamma X+\delta Y)+(\gamma X+\delta Y)(X-tY))\vspace{2pt}\\\ &=\alpha\gamma(2a-ts)+\alpha\delta(s-2t(l-b))\\\ &=-t\gamma-\delta.\end{array}$ Let us first assume $\lambda=1$. Then, $\gamma(s-tl)=0$. If $\gamma=0,$ then $\delta=0$ and so $W^{\prime}=0$. This means that the $\phi(h)$-action is identically zero, yielding $s=l=0$. Otherwise, $s=tl$ and we are done. We finally show that the possibility $\lambda=-1$ can not occur. If $\lambda=-1$, then $\delta=2-t\gamma$ and $s\gamma=-(2-t\gamma)l$. On the other hand, $l=\phi(h)\cdot(Y\\#1)=W^{\prime}(Y\\#1)+(Y\\#1)W^{\prime}=s\gamma+2(2-t\gamma)(l-b)$ (3.2) Moreover, $\begin{array}[]{rl}0&=(W^{\prime})^{2}\vspace{2pt}\\\ &=\gamma^{2}a+\delta^{2}(l-b)+\gamma\delta s\vspace{2pt}\\\ &\stackrel{{\scriptstyle(\ref{a=})}}{{=}}\gamma^{2}(ts-t^{2}(l-b))+(2-t\gamma)^{2}(l-b)+\gamma(2-t\gamma)s\vspace{2pt}\\\ &=2(l-b)(2-2t\gamma)+2\gamma s\end{array}$ From here, $s\gamma=(2t\gamma-2)(l-b).$ Substituting this in (3.2) we get $l=2b$, contradicting the fact that $C(b;1,l)$ is $(H_{4},R_{l})$-Azumaya. (2) If $l\not=0$, then $Im(\iota_{l})=Im(i_{l^{-1}})$ by Proposition 3.1 and the statement follows from (1). It remains to show that $[C(a;t,s)]\in Im(\iota_{0})$ implies $t=0$. If $[C(a;t,s)]\in Im(\iota_{0}),$ there exists $b\in k^{\cdot}$ and an $H_{4}$-Azumaya algebra $A$ with trivial $h$-action and trivial $\phi(h)$-action such that $[C(a;t,s)]=[A\\#C(b;0,1)].$ Then $C(a;t,s)\\#C(-b;0,1)\\#\overline{A}\cong{\rm End}(P)$ for some $D(H_{4})$-module $P$. Arguing as in (1) we see that there is $W=\alpha X\\#1+\beta Y\\#1\in(C(a;t,s)\\#C(-b;0,1))\\#\overline{A}$ for some $\alpha,\beta\in k$ such that $\begin{array}[]{ll}&\hskip 11.0pth\cdot Z=W(g\cdot Z)-ZW,\\\ 0&=h\cdot W=-2W^{2}=\alpha t+\beta,\\\ t&=h\cdot(X\\#1)=-2a\alpha,\\\ 0&=h\cdot(Y\\#1)=2b\beta.\end{array}$ From here if follows that $t=0$. $\Box$ ###### Corollary 3.4 Let $[C(a;t,s)]$, $[C(b;p,q)]$ be in $BQ(k,H_{4})$. Then $[C(a;t,s)]=[C(b;p,q)]$ if and only if $C(a;t,s)\cong C(b;p,q)$. Proof: We analyze the case $t\neq 0$, the other cases are treated similarly. If $[C(a;t,s)]=[C(b;p,q)]$ and $p=0$ then $[C(a;t,s)]\in Im(\iota_{0}),$ contradicting Theorem 3.3. Then $tp\neq 0$ and we may reduce to the case $[C(a;1,s)]=[C(b;1,q)]\in Im(i_{q})$. Applying again Theorem 3.3 we see that $s=q$ and the equality of classes is an equality in $BM(k,H_{4},R_{q})$. Applying $\Phi_{0}^{-1}\Psi_{q}^{-1}\Phi_{q}$ we obtain the equality $[C(a-2^{-1}q;1,0)]=[C(b-2^{-1}q;1,0)]$ in $BM(k,H_{4},R_{0})$. From Proposition 2.3, we obtain $(4a-2q)^{-1}=(4b-2q)^{-1}$ and we have the statement. $\Box$ ###### Theorem 3.5 Let $i_{t}:BM(k,H_{4},R_{t})\to BQ(k,H_{4})$ and $\iota_{s}:BC(k,H_{4},r_{s})\to BQ(k,H_{4})$ be the natural embeddings in $BQ(k,H_{4})$. Then: 1. (1) $Im(i_{t})\cap Im(\iota_{s})\neq i_{0}(BW(k))$ if and only if $ts=1$. If this is the case, then $Im(i_{t})=Im(\iota_{s})$; 2. (2) $Im(i_{t})\cap Im(i_{s})\neq i_{0}(BW(k))$ if and only if $t=s$; 3. (3) $Im(\iota_{t})\cap Im(\iota_{s})\neq i_{0}(BW(k))$ if and only if $t=s$. Proof: This is a consequence of Propositions 2.3, 2.5, 2.6, 3.1 and Theorem 3.3. $\Box$ ## 4 The action of $Aut(H_{4})$ on $Im(i_{t})$ and $Im(\iota_{s})$ For a Hopf algebra $H$, a group morphism from ${\rm Aut}_{\rm Hopf}(H)$ to $BQ(k,H_{4})$ has been constructed in [8], where the case of $H_{4}$ was also analized. The image of an automorphism $\alpha$ can be represented as follows. Let us denote by $H_{\alpha}$ the right $H$-comodule $H$ with left $H$-action $l\cdot m=\alpha(l_{(2)})mS^{-1}(l_{(1)})$. Then $A_{\alpha}={\rm End}(H_{\alpha})$ can be endowed of the $H$-Azumaya algebra structure: $\begin{array}[]{l}(l\cdot f)(m)=l_{(1)}\cdot f(S(l_{(2)})\cdot m),\vspace{2pt}\\\ \rho(f)(m)=\sum f(m_{(0)})_{(0)}\otimes S^{-1}(m_{(1)})f(m_{(0)})_{(1)}.\end{array}$ The assignment $\alpha\mapsto[A_{\alpha^{-1}}]$ defines a group morphism ${\rm Aut}_{\rm Hopf}(H)\to BQ(k,H)$. The image of ${\rm Aut}_{\rm Hopf}(H)$ acts on $BQ(k,H)$ by conjugation. An easy description of $[B(\alpha)]:=[A_{\alpha}][B][A_{\alpha}]^{-1}$ for any representative $B$ has been given in [8, Theorem 4.11]. As an algebra $B(\alpha)$ coincides with $B$, while the $H$-action and $H$-coaction are: $h\cdot_{\alpha}b=\alpha(h)\cdot b,\quad\rho_{\alpha}(b)=b_{(0)}\otimes\alpha^{-1}(b_{(1)}).$ (4.1) When $H=H_{4}$ the Hopf automorphism group is ${\rm Aut}_{\rm Hopf}(H_{4})\cong k^{\cdot}$ and consists of the morphisms that are the identity on $g$ and multiply $h$ by a nonzero scalar $\alpha$. The module $H_{\alpha}$ has action $\begin{array}[]{l}g\cdot g=g,\quad g\cdot h=-h,\vspace{2pt}\\\ h\cdot g=\alpha hg+g^{2}S^{-1}(h)=-(1+\alpha)gh,\quad h\cdot h=0,\end{array}$ and the kernel of the group morphism consists of $\\{\pm 1\\}$. We may thus embed $(k^{\cdot})^{2}\cong k^{\cdot}/\\{\pm 1\\}$ into $BQ(k,H_{4})$ (cf. [19]). We shall denote by $K$ the image of this group morphism. We analyze this action on the classes and subgroups described in the previous sections. ###### Lemma 4.1 Let $\alpha\in k^{\cdot}$. Then: 1. (1) $[A_{\alpha}][C(a;t,s)][A_{\alpha}]^{-1}=[C(a;\alpha t,s\alpha^{-1})]$. 2. (2) $K$ acts trivially on $i_{0}(BW(k))$. In particular, $BM(k,H_{4},R_{l\alpha^{2}})$ is conjugate to $BM(k,H_{4},R_{l})$ in $BQ(k,H_{4})$ while $BM(k,H_{4},R_{0})$ and $BC(k,H_{4},r_{0})$ are normalized by $K$. Proof: (1) It follows from direct computation that $h\cdot_{\alpha}x=\alpha t,\quad g\cdot_{\alpha}x=-x,\quad\rho(x)=x\otimes g+s\alpha^{-1}\otimes h.$ (2) Since: the action of an automorphism of $H_{4}$ is trivial on $g$; the action of $h$ is trivial on a representative of a class in $BW(k)$; and the comodule map on a representative $A$ of a class in $BW(k)$ has image in $A\otimes k{\mathbb{Z}}_{2}$, the formulas in (4.1) do not modify the action and coaction on $A$ therefore $[A]=[A_{\alpha}][A][A_{\alpha}]^{-1}$ for every $[A]\in i_{0}(BW(k))$. Since $Im(i_{l})$ is generated by $i_{0}(BW(k))$ and the classes $[C(a;1,l)]$, we see that $Im(i_{l})$ is conjugate to $Im(i_{\alpha^{2}l})$ in $BQ(k,H_{4})$. If $l=0$ we get the statement concerning $Im(i_{0})$. The statement concerning $BC(k,H_{4},r_{0})$ follows because this group is generated by $i_{0}(BW(k))$ and the classes $[C(a;0,1)]$. $\Box$ ###### Remark 4.2 The observation that $Im(i_{0})$ is normalized by $K$ has already been proved in [21, §4]. Lemma 4.1 should be seen as a generalization of that result. It is shown in [18] that $(H_{4},R_{t})$ is equivalent to $(H_{4},R_{s})$ if and only if $t=\alpha^{2}s$ for some $\alpha\in k^{\cdot}$. The above lemma shows that the Brauer groups of type $BM$ are conjugate in $BQ(k,H_{4})$ if the corresponding triangular structures are equivalent. This is a general fact: ###### Proposition 4.3 Let $R$ and $R^{\prime}$ be two equivalent quasitriangular structures on $H$ and let $\alpha\in{\rm Aut}_{\rm Hopf}(H)$ be such that $(\alpha\otimes\alpha)(R^{\prime})=R$. Then the images of $BM(k,H,R)$ and $BM(k,H,R^{\prime})$ are conjugate by the image of $\alpha$ in $BQ(k,H)$. Proof: If $B$ represents an element in $BM(k,H,R)$ then there will be an action $\cdot$ on $B$ such that the coaction $\rho$ is given by $\rho(b)=(R^{(2)}\cdot b)\otimes R^{(1)}$ for all $b\in B$. The image of $\alpha$ in $BQ(k,H)$ is represented by $A_{\alpha^{-1}}$. A representative of $[A_{\alpha}]^{-1}[B][A_{\alpha}]$ is given by the algebra $B$ with action $h\cdot_{\alpha^{-1}}b=\alpha^{-1}(h)\cdot b$. The coaction is given by $\rho_{\alpha}(b)=(R^{(2)}\cdot b)\otimes\alpha(R^{(1)})=(\alpha(R^{(2)})\cdot_{\alpha}b)\otimes\alpha(R^{(1)})=R^{\prime(2)}\cdot_{\alpha}b\otimes R^{\prime(1)},$ so the coaction on $[A_{\alpha}]^{-1}[B][A_{\alpha}]$ is induced by $R^{\prime}$ and $\cdot_{\alpha}$. $\Box$ For the dual statement, the proof is left to the reader. ###### Proposition 4.4 Let $r$ and $r^{\prime}$ be two equivalent coquasitriangular structures on $H$ and let $\alpha\in{\rm Aut}_{\rm Hopf}(H)$ be such that $r^{\prime}(\alpha\otimes\alpha)=r$. Then the images of $BC(k,H,r)$ and $BM(k,H,r^{\prime})$ are conjugate by the image of $\alpha$ in $BQ(k,H)$. ## 5 The subgroup $BQ_{grad}(k,H_{4})$ In this section we shall analyze the classes that can be represented by $H_{4}$-Azumaya algebras for which the gradings coming from the $g$-action and the comodule structure coincide. They form a subgroup that will be related to the Brauer group $BM(k,E(2),R_{N})$ of Nichols $8$-dimensional Hopf algebra $E(2)$ with respect to the quasitriangular structure $R_{N}$ attached to the $2\times 2$-matrix $N$ with $1$ in the $(1,2)$-entry and zero elsewhere. Let $BQ_{grad}(k,H_{4})$ be the set of classes that can be represented by a $H_{4}$-Azumaya algebra $A$ for which the $|\cdot|$-grading and the $\deg$-grading coincide. In other words, the classes in $BQ_{grad}(k,H_{4})$ can be represented by $D(H_{4})$-module algebras on which the actions of $g$ and $\phi(g)$ coincide. The last defining relation of $D(H_{4})$ in Section 1 implies that the action of $h$ and $\phi(h)$ on such representatives commute. Clearly, $BQ_{grad}(k,H_{4})$ is a subgroup of $BQ(k,H_{4})$. ###### Proposition 5.1 $BQ_{grad}(k,H_{4})$ is normalized by $K$. Proof: Let $[A]\in BQ_{grad}(k,H_{4})$ with $|a|=\deg(a)$ for every $a\in A$ and let $[A_{\alpha}]\in K$. Then $[A_{\alpha}\\#A\\#\overline{A_{\alpha}}]$ is represented by $A$ with action and coaction determined by (4.1). Since $g$ is fixed by all Hopf automorphisms of $H_{4}$ we have $g\cdot_{\alpha}a=g\cdot a,\quad({\rm id}\otimes\pi)\rho_{\alpha}(a)=({\rm id}\otimes\pi)\rho(a),$ so the two gradings are not modified by conjugation by $[A_{\alpha}]$. $\Box$ The subgroup $BQ_{grad}(k,H_{4})$ consists of those classes that can be represented by module algebras for the quotient of $D(H_{4})$ by the Hopf ideal $I$ generated by $\phi(g)\bowtie 1-\varepsilon\bowtie g$. Let us denote by $\pi_{I}$ the canonical projection onto $D(H_{4})/I$. Let $E(2)$ be the Hopf algebra with generators $c,\,x_{1},\,x_{2},$ with relations $c^{2}=1,\quad x_{i}^{2}=0,\quad cx_{i}+x_{i}c=0,\ i=1,2,\quad x_{1}x_{2}+x_{2}x_{1}=0,$ coproduct $\Delta(c)=c\otimes c,\quad\Delta(x_{i})=1\otimes x_{i}+x_{i}\otimes c,$ and antipode $S(c)=c,\quad S(x_{i})=cx_{i}.$ The Hopf algebra morphism $\begin{array}[]{rl}T\colon D(H_{4})&\longrightarrow E(2)\\\ \phi(g)\bowtie 1&\mapsto c\\\ \varepsilon\bowtie g&\mapsto c\\\ \varepsilon\bowtie h&\mapsto x_{1}\\\ \phi(h)\bowtie 1&\mapsto cx_{2}\end{array}$ determines a Hopf algebra isomorphism $D(H_{4})/I\cong E(2)$. The canonical quasitriangular structure ${\cal R}$ on $D(H_{4})$ is $\begin{array}[]{rl}{\cal R}&=\frac{1}{2}[\varepsilon\bowtie(1\otimes 1^{*}+g\otimes g^{*}+h\otimes h^{*}+gh\otimes(gh)^{*})\bowtie 1]\vspace{3pt}\\\ &\hskip 3.0pt+\frac{1}{2}[\varepsilon\bowtie(1\otimes\varepsilon+g\otimes\varepsilon+1\otimes\phi(g)-g\otimes\phi(g)\vspace{3pt}\\\ &\hskip 20.0pt+h\otimes\phi(h)+h\otimes\phi(gh)+gh\otimes\phi(h)-gh\otimes\phi(gh))\bowtie 1]\end{array}$ so $(\pi_{I}\otimes\pi_{I})({\cal R})$ is a quasitriangular structure for $D(H_{4})/I\cong E(2)$. Applying $T\otimes T$ to ${\cal R}$ we have: $\begin{array}[]{rl}(T\otimes T)({\cal R})&=\frac{1}{2}(1\otimes 1+1\otimes c+c\otimes 1-c\otimes c\\\ &\hskip 20.0pt+x_{1}\otimes cx_{2}+x_{1}\otimes x_{2}+cx_{1}\otimes cx_{2}-cx_{1}\otimes x_{2})\end{array}$ (5.1) The quasitriangular structures on $E(n)$ were computed in [17]. They are in bijection with $n\times n$-matrices with entries in $k$. For a given matrix $M$ the corresponding quasitriangular structure is denoted by $R_{M}$. The map $T$ induces a quasitriangular morphism from $(D(H_{4}),{\cal R})$ onto $(E(2),R_{N}),$ where $N$ is the $2\times 2$-matrix with $1$ in the $(1,2)$-entry and zero elsewhere. If $A$ is a representative of a class in $BQ_{grad}(k,H_{4})$ on which the ideal $I$ acts trivially, then $A$ is an $E(2)$-module algebra and the maps $F$ and $G$ on $A\otimes A$ are the same as those induced by $R_{N}$, so $A$ is $(E(2),R_{N})$-Azumaya. ###### Theorem 5.2 The group $BM(k,E(2),R_{N})$ fits into the following exact sequence $\begin{array}[]{l}\begin{CD}1\longrightarrow{\mathbb{Z}}_{2}@>{}>{}>BM(k,E(2),R_{N})@>{T^{*}}>{}>BQ_{grad}(k,H_{4})\longrightarrow 1.\end{CD}\end{array}$ Proof: Restriction of scalars through $T$ provides a group morphism $T^{*}$ from $BM(k,E(2),R_{N})$ to $BQ(k,H)$ whose image is $BQ_{grad}(k,H_{4})$. The kernel of $T^{*}$ consists of those classes $[A]$ such that $A\cong{\rm End}(P)$ as $D(H_{4})$-module algebras, for some $D(H_{4})$-module $P$. The class $[A]$ may be non-trivial only if $g$ and $\phi(g)$ act differently on $P$ even though they act equally on ${\rm End}(P)$. The $\phi(g)$\- and $g$-action on ${\rm End}(P)$ are strongly inner, hence there are elements $U$ and $u$ in ${\rm End}(P)$ such that $\phi(g)\cdot f=UfU^{-1}=ufu^{-1}=g\cdot f$ for every $f\in{\rm End}(P).$ Since ${\rm End}(P)$ is a central algebra, $U^{2}=u^{2}=1$, $uU=Uu$. From here, $U=\pm u,$ and if $[{\rm End}(P)]\neq 1$ in $BM(k,E(2),R_{N})$ we necessarily have $U=-u$. The actions of $g$ and $\phi(g)$ on $P$ are given by the element $u$ and $U$ respectively, so for every non-trivial $[A]$ in ${\rm Ker}(T^{*})$ we have $A\cong{\rm End}(P)$ for some $D(H_{4})$-module $P$ for which $g$ acts as $-\phi(g)$. We claim that there is at most one non-trivial element in ${\rm Ker}(T^{*})$. Given any pair of such elements ${\rm End}(P)$ and ${\rm End}(Q)$ representing classes in ${\rm Ker}(T^{*})$ we have ${\rm End}(P)\\#{\rm End}(Q)\cong{\rm End}(P\otimes Q)$ as $D(H_{4})$-module algebras by [7, Proposition 4.3], where $P\otimes Q$ is a $D(H_{4})$-module. Then, the actions of $g$ and $\phi(g)$ on $P\otimes Q$ coincide, so $P\otimes Q$ is an $E(2)$-module. Thus, $[{\rm End}(P)][{\rm End}(Q)]$ is trivial in $BM(k,E(2),R_{N})$ for every choice of $P$ and $Q$. Therefore, ${\rm Ker}(T^{*})$ is either trivial or isomorphic to ${\mathbb{Z}}_{2}$. The proof is completed once we provide a non-trivial element. Let us consider $P=k^{2}$ on which $g,\,h,\,\phi(g)$ and $\phi(h)$ act via the following matrices $u,\,w,\,U,\,W$, respectively: $u=\left(\begin{array}[]{cc}1&0\\\ 0&-1\end{array}\right),\quad w=\left(\begin{array}[]{cc}0&0\\\ -2&0\end{array}\right),\quad U=-u,\,\quad W=\left(\begin{array}[]{cc}0&1\\\ 0&0\end{array}\right).$ Then $P$ is a $D(H_{4})$-module but not an $E(2)$-module. On the other hand, the $D(H_{4})$-module algebra structure on ${\rm End}(P)$ is in fact an $E(2)$-module algebra structure: $g\cdot f=ufu^{-1}=UfU^{-1}=\phi(g)\cdot f;$ (5.2) $h\cdot f=wfu^{-1}+fuw,\quad\phi(h)\cdot f=Wf-UfU^{-1}W.$ (5.3) Moreover, ${\rm End}(P)$ is $(E(2),R_{N})$-Azumaya because it is $H_{4}$-Azumaya. We claim that the class of ${\rm End}(P)$ is not trivial in $BM(k,E(2),R_{N})$. Indeed, if it were trivial, then the $E(2)$-action on ${\rm End}(P)$ given by $c.f=g.f$, $x_{1}.f=h.f$ and $(cx_{2}).f=\phi(h).f$ would be strongly inner. In other words, there would exist a convolution invertible algebra morphism $p\colon E(2)\to{\rm End}(P)$ for which $l\cdot f=\sum p(l_{(1)})fp^{-1}(l_{(2)})$ for every $l\in E(2)$. Putting $u^{\prime}=p(c)$ we have $c.f=u^{\prime}f(u^{\prime})^{-1}=ufu^{-1}$. Since ${\rm End}(P)$ is a central simple algebra, we necessarily have $u^{\prime}=\lambda u$ and since $(u^{\prime})^{2}=1$ we have $\lambda=\pm 1$. Putting $w^{\prime}=p(x_{1})$ we have $x_{1}.f=w^{\prime}fu^{\prime}-fw^{\prime}u^{\prime}$ and since $u^{\prime}w^{\prime}=-w^{\prime}u^{\prime}$, we have $\lambda w^{\prime}fu+\lambda fuw^{\prime}=x_{1}.f=h.f=wfu+fuw$ for every $f\in{\rm End}(P)$. Using $uw=-wu$ we see that $(\lambda w^{\prime}-w)f=f(\lambda w^{\prime}-w)$ so $w=\lambda w^{\prime}+\mu$ for some $\mu\in k$. Using once more skew-commutativity of $u$ with $w$ and $w^{\prime}$ we see that $\mu=0$. Putting $W^{\prime}=p(cx_{2})$ and using that $u^{\prime}W^{\prime}=-W^{\prime}u^{\prime}$ we see that $W^{\prime}f-ufuW^{\prime}=(cx_{2}).f=\phi(h).f=Wf-ufuW$ for every $f\in{\rm End}(P)$. From here, we deduce that $u(W^{\prime}-W)=\nu\in k$. Using skew- commutativity of $u$ with $W$ and $W^{\prime}$ we conclude that $\nu=0$ so $W^{\prime}=W$. Then $W^{\prime}w^{\prime}-w^{\prime}W^{\prime}=\lambda(Ww- wW)\neq 0$ so that relation $(cx_{2})x_{1}-x_{1}(cx_{2})=0$ in $E(2)$ cannot be respected. Hence, $[{\rm End}(P)]\neq 1$ in $BM(k,E(2),R_{N})$ and ${\rm Ker}(T^{*})\cong{\mathbb{Z}}_{2}$. $\Box$ The following proposition shows that the groups $BM(k,H_{4},R_{l})$ may be viewed inside $BM(k,E(2),R_{N})$ and it also describes the image through $T^{*}$ of them. ###### Proposition 5.3 For every $(\lambda,\mu)\in k\times k$ there is a group homomorphism $\Theta_{\lambda,\mu}\colon BM(k,H_{4},R_{\lambda\mu})\to BM(k,E(2),R_{N})$ satisfying: 1. (1) The image of $\Theta_{0,0}$ is the subgroup isomorphic to $BW(k)$ represented by elements with trivial $x_{1}$\- and $x_{2}$-action and $Ker(\Theta_{0,0})\cong(k,+)$. 2. (2) $\Theta_{\lambda,\mu}$ is injective if and only if $(\lambda,\mu)\neq(0,0)$. 3. (3) For $(\lambda,\mu)\neq(0,0),$ the image of $T^{*}\Theta_{\lambda,\mu}$ is $Im(i_{\mu\lambda^{-1}})$ if $\lambda\neq 0$ and $Im(\iota_{\mu^{-1}\lambda})$ if $\mu\neq 0$. Proof: For every $(\lambda,\mu)\in k\times k$ the map $\theta_{\lambda,\mu}\colon E(2)\to H_{4}$ mapping $c\to g$, $x_{1}\to\lambda h$ and $x_{2}\to\mu h$ is a Hopf algebra projection. A direct computation shows that $(\theta_{\lambda,\mu}\otimes\theta_{\lambda,\mu})(R_{N})=R_{\lambda\mu}$ so the pull-back of $\theta_{\lambda,\mu}$ induces the desired homomorphism $\Theta_{\lambda,\mu}$. (1) Let $(\lambda,\mu)=(0,0)$. Then any element in $BM(k,H_{4},R_{0})$ can be written as a pair of the form $([C(a;t,0)],[B])$ for $[B]\in BW(k)$. The image through $\Theta_{0,0}$ of such an element is $[C(a)][B]\in BW(k)$ with trivial $x_{i}$-action on $C(a)$. Clearly, $BW(k)=Im(\Theta_{0,0})$. That $Ker(\Theta_{0,0})$ is isomorphic to $(k,+)$ follows from the isomorphism $BM(k,H_{4},R_{0})\cong(k,+)\times BW(k)$ and the fact that $(k,+)$ is realized as classes admitting a representative that is trivial when viewed as a $k{\mathbb{Z}}_{2}$-module algebra. (2) Let $(\lambda,\mu)\neq(0,0)$. If $\Theta_{\lambda,\mu}([A])=1$ then $A$ is isomorphic to an endomorphism algebra with strongly inner $E(2)$-action. In other words, $A\cong{\rm End}(P)$ and there is a convolution invertible algebra map $p\colon E(2)\to A$ such that $l\cdot a=\sum p(l_{(1)})ap^{-1}(l_{(2)})$ for every $l\in E(2),a\in A$. There are elements $u,v,w\in A$ with $u$ invertible such that $c\cdot a=g\cdot a=uau^{-1}$, $x_{1}\cdot a=(va-av)u=\lambda h\cdot a$ and $x_{2}\cdot a=(wa-aw)u=\mu h\cdot a$. Then $0=\mu x_{1}\cdot a-\lambda x_{2}\cdot a=((\mu v-\lambda w)a-a(\mu v-\lambda w))u\quad\forall a\in A,$ and since $u$ is invertible and $A$ is central we have $\mu v-\lambda w=\eta$ for some $\eta\in k$. The relation between $v$ and $w$ gives $\eta=0$ and so $\mu v=\lambda w.$ Thus, the same elements $u,v$ and $w$ ensure that the $H_{4}$-action on $A$ is strongly inner. Therefore $[A]=1$ in $BM(k,H_{4},R_{\lambda\mu})$. The converse follows from (1). (3) Let us now assume that $(\lambda,\mu)\neq(0,0).$ It is immediate to see that if $[A]\in BW(k)\subset BM(k,H_{4},R_{\lambda\mu})$ is represented by an algebra with trivial $h$-action, then $\Theta_{\lambda,\mu}([A])$ is represented by an algebra with trivial $x_{1}$\- and $x_{2}$-action. Hence $T^{*}\Theta_{\lambda,\mu}(BM(k,H_{4},R_{\lambda\mu}))\subset i_{0}(BW(k))$ and the restriction of $T^{*}\Theta_{\lambda,\mu}$ to $BW(k)$ is an isomorphism onto $i_{0}(BW(k))$. Let us now consider the class $[C(a;1,\lambda\mu)]\in BM(k,H_{4},R_{\lambda\mu})$. Its image through $\Theta_{\lambda,\mu}$ is the algebra generated by $x$ with $x^{2}=a$, with $c\cdot x=-x$, $x_{1}\cdot x=\lambda$ and $x_{2}\cdot x=\mu$. A direct verification shows that $T^{*}\Theta_{\lambda,\mu}([C(a;1,\lambda\mu)])=[C(a;\lambda,\mu)]$. Then the image of $T^{*}\Theta_{\lambda,\mu}$ is $Im(i_{\mu\lambda^{-1}})$ if $\lambda\neq 0$ and $Im(\iota_{\mu^{-1}\lambda})$ if $\mu\neq 0$. $\Box$ Theorem 5.2 shows that one should understand $BM(k,E(2),R_{N})$ in order to compute $BQ(k,H_{4})$. In view of Proposition 5.3, $BM(k,E(2),R_{N})$ seems to be much more complex that the groups of type BM treated in [10, 11, 20]. ## 6 Appendix This last section is devoted to the analysis of some difficulties occurring in the study of the structure of $(E(2),R_{N})$-Azumaya algebras. We show that the set of classes represented by ${\mathbb{Z}}_{2}$-graded central simple algebras (with respect to the grading induced by the $c$-action) is not a subgroup of $BM(k,E(2),R_{N})$. Let us consider the braiding $\psi_{VW}$ determined by $R_{N}$ between two left $E(2)$-modules $V$ and $W$. Let $v\in V$ and $w\in W$ be homogeneous elements with respect to the ${\mathbb{Z}}_{2}$-grading induced by the $c$-action. By direct computation it is: $\begin{array}[]{l}\psi_{VW}(v\otimes w)=\sum R_{N}^{(2)}\cdot w\otimes R_{N}^{(1)}\cdot v\vspace{2pt}\\\ \hskip 48.36958pt=(-1)^{|v||w|}w\otimes v+(-1)^{|w|+1}(-1)^{(|v|+1)(|w|+1)}(x_{2}\cdot w)\otimes(x_{1}\cdot v).\end{array}$ If we denote by $\psi_{0}$ the braiding associated with the ${\mathbb{Z}}_{2}$-grading we have $\psi_{VW}(v\otimes w)=\psi_{0}(v\otimes w)+(-1)^{|w|+1}\psi_{0}(x_{1}\cdot v\otimes x_{2}\cdot w).$ (6.1) Let $F$ and $G$ be the maps in (1.4) defining an $(E(2),R_{N})$-Azumaya algebra $A$ and let $F_{0}$ and $G_{0}$ be the maps defining an $(E(2),R_{0})$-Azumaya algebra, that is, the maps determining when an $E(2)$-module algebra is ${\mathbb{Z}}_{2}$-graded central simple. It is not hard to verify by direct computation that, for homogeneous $a,\,b,\,d\in A$ with respect to the $c$-action we have: $F(a\\#b)(d)=F_{0}(a\\#b)(d)+(-1)^{|d|+1}F_{0}(a\\#x_{1}\cdot b)(x_{2}\cdot d)$ (6.2) $G(a\\#b)(d)=G_{0}(a\\#b)(d)+(-1)^{|a|+1}F_{0}(x_{2}\cdot a\\#b)(x_{1}\cdot d)$ (6.3) Notice that if either $x_{1}$ or $x_{2}$ acts trivially, then $F=F_{0}$ and $G=G_{0}$. So in this case, $A$ is $(E(2),R_{N})$-Azumaya if and only if it is ${\mathbb{Z}}_{2}$-graded central simple (i.e. $A$ is $(E(2),R_{0})$-Azumaya). We will say that the $x_{i}$-action on an $E(2)$-module algebra $A$ is inner if there exists an odd element $v\in A$ such that $x_{i}\cdot a=v(c\cdot a)-av$ for every $a\in A$. ###### Theorem 6.1 Let $A$ be an $(E(2),R_{N})$-Azumaya algebra. The following assertions are equivalent: 1. (1) The $x_{1}$-action on $A$ is inner; 2. (2) The $x_{2}$-action on $A$ is inner; 3. (3) $A$ is a ${\mathbb{Z}}_{2}$-graded central simple algebra. In addition, the $E(2)$-action on $A$ is inner if and only if $A$ is a central simple algebra. Proof: (1) $\Rightarrow$ (3) Let $v_{1}\in A$ be an odd element such that $x_{1}\cdot a=v_{1}(c\cdot a)-av_{1}$ for all $a\in A$. Applying equality (6.2) to any homogeneous $b$ and $d$ in $A$ gives: $\begin{array}[]{ll}F(a\\#b)(d)&=F_{0}(a\\#b)(d)+F_{0}(a\\#b)((x_{2}\cdot d)v_{1})\vspace{2pt}\\\ &\hskip 10.0pt+(-1)^{|d|}F_{0}(a\\#bv_{1})(x_{2}\cdot d)\end{array}$ (6.4) This equality extends to all elements $a$ and $b$ in $A$. If $A$ were not ${\mathbb{Z}}_{2}$-graded central simple, there would exist an element $0\neq\sum_{i}a_{i}\\#b_{i}$ in $Ker(F_{0})$. Then $(\sum_{i}a_{i}\\#b_{i})(1\\#v_{1})=\sum_{i}a_{i}\\#b_{i}v_{1}\in Ker(F_{0})$ and for every $f$ in $A$ we would have $F_{0}(\sum_{i}a_{i}\\#b_{i})(f)=F_{0}(\sum_{i}a_{i}\\#b_{i}v_{1})(f)=0$. It follows from (6.4) that $\sum_{i}a_{i}\\#b_{i}\in Ker(F),$ contradicting the injectivity of $F$. (2) $\Rightarrow$ (3) Similarly to (1) $\Rightarrow$ (3) replacing $F$ by $G$. (3) $\Rightarrow$ (1), (2) Suppose that $A$ is a ${\mathbb{Z}}_{2}$-graded central simple algebra. If $A$ is a central simple algebra then the $E(2)$-action on $A$ is inner by the Skolem-Noether theorem. If $A$ is not central simple then it is of odd type ([13, Theorem 3.4, Definition 3.5]) and it is $(H_{4},R_{0})$-Azumaya for the subalgebra of $E(2)$, isomorphic to $H_{4}$ generated by $c$ and $x_{i}$. By [1, Theorem 3.4] the $x_{i}$-action is inner. Let us finally assume that the $E(2)$-action on $A$ is inner. Then $A$ is a ${\mathbb{Z}}_{2}$-graded central simple algebra. Since $E(2)$ acts innerly on $A$ then it acts trivially on its center $Z(A)$. Besides it is immediately seen that $Z(A)$ is contained in the right and left $E(2)$-center, that are trivial because $A$ is assumed to be $E(2)$-Azumaya. Hence $Z(A)$ must be trivial and so $A$ is also a central algebra. By the structure theorems of ${\mathbb{Z}}_{2}$-graded central simple algebras ([13, Theorem IV.3.4]), $A$ is central simple. $\Box$ ###### Proposition 6.2 Let $A$ and $B$ be two equivalent $(E(2),R_{N})$-Azumaya algebras. Then the $x_{i}$-action on $A$ is inner if and only if it is so on $B$. Proof: Let $P$ and $Q$ be finite dimensional $E(2)$-modules for which $A\\#{\rm End}(P)\cong B\\#{\rm End}(Q)$. If the $x_{i}$-action on $A$ is inner then it is so on $A\\#{\rm End}(P)$ by [11, Proposition 4.6], hence it is so on $B\\#{\rm End}(Q)$, which is a ${\mathbb{Z}}_{2}$-graded central simple algebra by Theorem 6.1. For $i=1,2$, let $W_{i},v_{i}$ be odd elements in $B\\#{\rm End}(Q)$ and ${\rm End}(Q)$ respectively inducing the $x_{i}$-action. We recall that $x_{j}\cdot v_{i}=0$ because the action on ${\rm End}(Q)$ is strongly inner, while $x_{j}\cdot W_{i}$ is a scalar for every pair $i,j$ because $x_{j}\cdot W_{i}$ belongs to the graded center of $B\\#{\rm End}(Q)$. The odd elements $T_{i}=W_{i}-1\\#v_{i}-(x_{2}\cdot W_{i})(1\\#v_{1})\in B\\#{\rm End}(Q)$ for $i=1,2$ are such that $x_{j}\cdot T_{i}=x_{j}\cdot W_{i}$ for every $i$ and $j$. Moreover, for every homogeneous $f\in{\rm End}(Q)$ with respect to the $c$-action we have: $\begin{array}[]{l}(-1)^{|f|}T_{i}(1\\#f)=W_{i}(c\cdot 1\\#c\cdot f)-1\\#v_{i}(c\cdot f)-(x_{2}\cdot W_{i})(1\\#v_{1}(c\cdot f))\vspace{2pt}\\\ \hskip 36.98866pt=(1\\#f)W_{i}-(1\\#fv_{i})-(x_{2}\cdot W_{i})(1\\#fv_{1})-(x_{2}\cdot W_{i})(x_{1}\cdot(1\\#f))\vspace{2pt}\\\ \hskip 36.98866pt=(1\\#f)[W_{i}-1\\#v_{i}-(x_{2}\cdot W_{i})(1\\#v_{1})]-(x_{2}\cdot W_{i})(x_{1}\cdot(1\\#f))\vspace{2pt}\\\ \hskip 36.98866pt=(1\\#f)T_{i}-(x_{2}\cdot W_{i})(x_{1}\cdot(1\\#f)).\end{array}$ In other words, $(1\\#f)T_{i}=(-1)^{|f||T_{i}|}T_{i}(1\\#f)+(x_{2}\cdot T_{i})(x_{1}\cdot(1\\#f)),$ so by (6.1) the element $T_{i}\in C^{l}_{B\\#{\rm End}(Q)}({\rm End}(Q)),$ the left centralizer of ${\rm End}(Q)$ in $B\\#{\rm End}(Q)$, that is, $T_{i}\in B\\#1$ by the double centralizer theorem [1, Theorem 2.3]. Besides, for every homogeneous $b\in B$ we have: $\begin{array}[]{rl}T_{i}(c\cdot b\\#1)-(b\\#1)T_{i}&=(-1)^{|b|}W_{i}(b\\#1)-(b\\#v_{i})-(x_{2}\cdot W_{i})(b\\#v_{1})\vspace{2pt}\\\ &\hskip 10.0pt-(b\\#1)W_{i}+(b\\#v_{i})+(x_{2}\cdot W_{i})(b\\#v_{1})\vspace{2pt}\\\ &=x_{i}\cdot(b\\#1).\end{array}$ Hence the $x_{i}$-action on $B$ is inner. $\Box$ We conclude by showing that, contrarily to the cases treated in the literature ([10, 11, 20]), a Skolem-Noether-like approach is probably not appropriate for the computation of $BM(k,E(2),R_{N})$ because the set of classes admitting a representative with inner action is not a subgroup. ###### Theorem 6.3 The classes in $BM(k,E(2),R_{N})$ that are represented by ${\mathbb{Z}}_{2}$-graded central simple algebras do not form a subgroup. Proof: Let $t\neq 0,1$ and $q\neq 2$ be in $k$. We consider the representative $C(1;t,2)$ generated by $x$ with $x^{2}=1$, $c\cdot x=-x$, $x_{1}\cdot x=t$ and $x_{2}\cdot x=2$ and the representative $C(1;1,q)$ generated by $y$ with $y^{2}=1$, $c\cdot y=-y$, $x_{1}\cdot y=1$ and $x_{2}\cdot y=q$. Both are $(E(2),R_{N})$-Azumaya because $C(1;1,2t)$ is $(H_{4},R_{2t})$-Azumaya, $C(1;1,q)$ is $(H_{4},R_{q})$-Azumaya and $C(1;t,2),C(1;1,q)$ are obtained from these ones respectively by pulling back through $\theta_{\lambda,\mu}$. They are also ${\mathbb{Z}}_{2}$-graded central simple algebras. Their product $C(1;t,2)\\#C(1;1,q)$ is generated by the odd elements $X$ and $Y$ with $X^{2}=1$, $Y^{2}=1$ and $XY+YX=2$. The element $X-Y$ is easily seen to lie in the ${\mathbb{Z}}_{2}$-graded center, so $C(1;t,2)\\#C(1;1,q)$ is not a ${\mathbb{Z}}_{2}$-graded central simple algebra. If $B$ were another representative of $[C(1;t,2)\\#C(1;1,q)]$ that is a ${\mathbb{Z}}_{2}$-graded central simple algebra, then by Theorem 6.1, the $x_{1}$-action on it would be inner. By Proposition 6.2, $x_{1}$ would act innerly on $C(1;t,2)\\#C(1;1,q)$. Applying again Theorem 6.1, $C(1;t,2)\\#C(1;1,q)$ would be ${\mathbb{Z}}_{2}$-graded central simple. $\Box$ Acknowledgements This research was partially supported by the Azioni Integrate Italia-España AIIS05E34A Algebre, coalgebre, algebre di Hopf e loro rappresentazioni. The second named author is also supported by projects MTM2008-03339 from MCI and FEDER and P07-FQM-03128 from Junta de Andalucía. ## References * [1] Armour A.; Chen H.-X.; Zhang Y. Structure theorems of $H_{4}$-Azumaya algebras. J. Algebra 305 (2006), 360-393. * [2] Beattie, M.; Caenepeel, S. The Brauer-Long group of ${\mathbb{Z}}/p^{t}{\mathbb{Z}}$-dimodule algebras. J. Pure Appl. Algebra 60 (1989), 219-236. * [3] Bichon, J.; Carnovale G. Lazy cohomology: an analogue of the Schur multiplier for arbitrary Hopf algebras. J. Pure Appl. Algebra 204 no. 3 (2006), 627-665. * [4] Caenepeel, S. Computing the Brauer-Long group of a Hopf algebra I: the cohomological theory. Israel J. Math. 72 Nos. 1-2 (1990), 38-83. * [5] Caenepeel, S. Brauer groups, Hopf algebras and Galois Theory. K-Monographs in Mathematics 4. Kluwer Academic Publishers, Dordrecht, 1998. * [6] Caenepeel, S. The Brauer-Long group revisited: the multiplication rules. Algebra and Number Theory (Fez), 61-86. Lecture Notes in Pure Appl. Math 208. Marcel-Dekker, New York, 2000. * [7] Caenepeel, S.; Van Oystaeyen, F.; Zhang, Y. Quantum Yang-Baxter Module Algebras. K-theory 8 no. 3 (1994), 231-255. * [8] Caenepeel, S.; Van Oystaeyen, F.; Zhang, Y. The Brauer group of Yetter-Drinfeld module algebras. Trans. Amer. Math. Soc. 349 no. 9 (1997), 3737-3771. * [9] Carnovale, G. Some isomorphisms for the Brauer groups of a Hopf algebra. Comm. Algebra 29 no. 11 (2001), 5291-5305. * [10] Carnovale, G.; Cuadra, J. The Brauer group of some quasitriangular Hopf algebras. J. Algebra 259 no. 2 (2003), 512-532. * [11] Carnovale, G.; Cuadra, J. Cocycle twisting of $E(n)$-module algebras and applications to the Brauer group. K-Theory 33 (2004), 251–276. * [12] DeMeyer, F.; Ford, T. Computing the Brauer-Long group of ${\mathbb{Z}}_{2}$-dimodule algebras. J. Pure Appl. Algebra 54 (1988), 197-208. * [13] Lam, T. Y. Introduction to Quadratic Forms over Fields, Graduate Studies in Mathematics 67. American Mathematical Society, Providence, RI, 2005. * [14] Long, F.W. A generalization of the Brauer group of graded algebras. Proc. London Math. Soc. 29 no. 3 (1974), 237-256. * [15] Majid, S. Doubles of quasitriangular Hopf algebras. Comm. Algebra 19 (1991), 3061-3073. * [16] Montgomery, S.; Schneider, H.-J. Skew derivations of finite-dimensional algebras and actions of the Taft Hopf algebra. Tsukuba J. Math. 25 no. 2 (2001), 337-358. * [17] Panaite, F; Van Oystaeyen, F. Quasitriangular structures for some pointed Hopf algebras of dimension $2^{n}$. Comm. Algebra 27 no. 10 (1999), 4929-4942. * [18] Radford, D.E. Minimal quasitriangular Hopf algebras. J. Algebra 157 no. 2 (1993), 285-315. * [19] Van Oystaeyen, F.; Zhang, Y. Embedding the Hopf automorphism group into the Brauer group. Can. Math. Bull. 41 (1998), 359-367. * [20] Van Oystaeyen, F.; Zhang, Y. The Brauer group of Sweedler’s Hopf algebra $H_{4}$. Proc. Amer. Math. Soc. 129 no. 2 (2001), 371-380. * [21] Van Oystaeyen, F.; Zhang, Y. Computing subgroups of the Brauer group of $H_{4}$. Comm. Algebra 30 no. 10 (2002), 4699-4709.
arxiv-papers
2009-04-12T21:22:37
2024-09-04T02:49:01.823117
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Giovanna Carnovale, Juan Cuadra", "submitter": "Carnovale Giovanna", "url": "https://arxiv.org/abs/0904.1883" }
0904.2012
# Simplicial Databases David I. Spivak ###### Abstract. In this paper, we define a category ${\bf DB}$, called the category of simplicial databases, whose objects are databases and whose morphisms are data-preserving maps. Along the way we give a precise formulation of the category of relational databases, and prove that it is a full subcategory of ${\bf DB}$. We also prove that limits and colimits always exist in ${\bf DB}$ and that they correspond to queries such as select, join, union, etc. One feature of our construction is that the schema of a simplicial database has a natural geometric structure: an underlying simplicial set. The geometry of a schema is a way of keeping track of relationships between distinct tables, and can be thought of as a system of foreign keys. The shape of a schema is generally intuitive (e.g. the schema for round-trip flights is a circle consisting of an edge from $A$ to $B$ and an edge from $B$ to $A$), and as such, may be useful for analyzing data. We give several applications of our approach, as well as possible advantages it has over the relational model. We also indicate some directions for further research. This project was supported in part by the Office of Naval Research. ###### Contents 1. 1 Introduction 2. 2 The category of Tables 3. 3 Constructions and formal properties of Tables 4. 4 Schemas and databases 5. 5 Constructions and formal properties of Simplicial Databases 6. 6 Applications, advantages, and further research ## 1\. Introduction The theory of relational databases is generally formulated within mathematical logic. We provide a more modern and more flexible approach using methods from category theory and algebraic topology. Category theory is useful both as a language and as a tool, and has been successfully applied to many areas of computer science. Using an inefficient language can hamper ones ability to implement, work with, and reason about a subject. This can be seen as one reason that SQL implements tables, rather than relational databases in their pure form: perhaps mathematical logic is not a sufficiently flexible language for discussing databases as they are used in practice. One reason that relational databases have been so successful is that their definition can be phrased within a precise mathematical language. The definition we provide in this paper is just as precise, if not more so (see the discussion at the beginning of Section 4). However, we go beyond simply defining the objects of study (databases), but instead continue on to define morphisms between databases. With these definitions, we have a category of databases. There are many categories whose objects are databases (the difference being in their morphisms); what makes one definition better than another? First, a good definition should make sense – the morphisms should somehow preserve the structure of the databases. Second, applying common categorical constructions (colimits, limits, etc.) to the category of databases should result in common database constructions, such as unions, joins, etc. Third, the categorical approach should make reasoning about databases, such as that needed for maintaining and restructuring databases, easier. Our formulation accomplishes these three goals (see Remark 4.3.8, and Sections 5 and 6, respectively). As an added bonus, the schemas for our databases have geometric structure (more precisely, the structure of a simplicial set). In other words, the schema is given as a geometric object which one should think of as a kind of Entity-Relationship diagram for the schema. This approach may lead to improvements in query optimization because one can adjust the “shape” of the schema to fit with the purposes of the queries to be taken. The ability to visualize data should also prove useful, because these visualizations seem to “make sense” in practice. Examples of this phenomenon are given in 6.1.1 and 6.1.2, where we respectively discuss round trip flights and a sociological experiment involving 4-cycles in high school partnerships. The data on a given schema is given by a sheaf of sets on that schema. Sheaves are ubiquitous in modern mathematics because they generalize sets and functions and because they have good formal properties. Classical operations on sheaves (such as direct images) allow one to transport data from one schema to another in a functorial way. One of the main purposes of this paper is to provide a good language for discussing databases mathematically, and the consideration of data as a sheaf on a given schema helps to accomplish that goal. Other researchers have formulated databases in terms of category theory (for example, see [RW92],[JRW02],[PS95],[Ber01],[DK94],[Dis96],[GB92]). Of note is work by Cadish and Diskin, and work by Rosebrugh and Wood. There are many differences between previous viewpoints and our own. Most notably, our work uses simplicial methods to give a geometric structure to the schemas of databases and uses sheaves over these spaces to model the data itself. Both of these approaches appear to be new. We assume throughout this paper that the reader has a basic knowledge of category theory which includes knowing the definition of category, functor, limit, and colimit, as well as basic facts such as Yoneda’s lemma. Good references for this material include [ML98],[BW90], and [Bor94a]. We do not assume that the reader has a prior knowledge of sheaves or of simplicial sets. We begin by defining the category of tables, in Section 2. In Section 3, we prove that the category of tables is closed under limits and certain colimits, and that these constructions correspond to joins and unions. We also prove that projections and deletions are easily defined under our formulation. In Section 4, we first give a brief description of simplicial sets. We then proceed to define the category of simplicial databases. In Section 5, we prove that the category of simplicial databases is closed under all limits and colimits and prove that they again correspond to joins and unions. Finally in Section 6, we discuss some applications of our model and directions for future research. ### 1.1. Acknowledgments I would like to thank Paea LePendu for explaining relational databases to me, for suggesting that databases should be categorified, and for his advice and encouragement throughout the process. I would also like to thank Chris Wilson for several useful conversations. ## 2\. The category of Tables It is no accident that SQL uses tables instead of relations: Tables are inherently more useful, yet just as easy to implement. They are disliked by the purists of relational database theory not because they are bad, but because they do not fit in with that theory. In this section we provide a categorical structure to the set of tables, thus firmly grounding it in rigorous mathematics. ### 2.1. Data types In order to define schemas, records, and tables of a given type, we need to define what we mean by “type.” ###### Definition 2.1.1. A type specification is simply a function between sets $\pi\colon U\rightarrow{\bf DT}$. The set ${\bf DT}$ is called the set of data types for $\pi$, and the set $U$ is called the domain bundle for $\pi$. Given any element $T\in{\bf DT}$, the preimage $\pi^{-1}(T)\subset U$ is called the domain of $T$, and an element $x\in\pi^{-1}(T)$ is called an object of type $T$. ###### Example 2.1.2. Let $U$ denote the disjoint union $U\colon=({\mathbb{Z}}\amalg{\mathbb{R}}\amalg{\bf Strings})$ and let ${\bf DT}$ denote the three element set $\\{`{\mathbb{Z}}\textnormal{'},`{\mathbb{R}}\textnormal{'},`{\bf Strings}\textnormal{'}\\}$. Let $\pi\colon U\rightarrow{\bf DT}$ denote the obvious function, which send all of ${\mathbb{Z}}$ to the element $`{\mathbb{Z}}\textnormal{'}$, all of ${\mathbb{R}}$ to $`{\mathbb{R}}\textnormal{'}$, and all of ${\bf Strings}$ to $`{\bf Strings}\textnormal{'}$. The preimage $\pi^{-1}(`{\bf Strings}\textnormal{'})\subset U$, which we have called the domain of the type $`{\bf Strings}\textnormal{'}$, is indeed the set of strings. As another example, the mod 2 function $\pi\colon{\mathbb{Z}}\rightarrow\\{\textnormal{`even'},\textnormal{`odd'}\\}$ is a type specification in which the objects of type ‘even’ are the even integers. ### 2.2. Schemas We quickly recall the definition of fiber product (for sets). ###### Definition 2.2.1. Let $A,B,$ and $C$ be sets, and suppose $f\colon A\rightarrow B$ and $g\colon C\rightarrow B$ are functions with the same codomain. The fiber product of $A$ and $C$ over $B$, denoted $A\times_{B}C$, is the set $A\times_{B}C\colon=\\{(a,c)\in A\times C|f(a)=g(c)\in B\\}.$ The fiber product moreover comes equipped with obvious projection maps making the diagram $\textstyle{A\times_{B}C\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{\prime}}$$\scriptstyle{g^{\prime}}$$\textstyle{\lrcorner}$$\textstyle{C\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{g}$$\textstyle{A\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f}$$\textstyle{B}$ commute. The corner symbol $\lrcorner$ serves to remind the reader that the object in the upper left is a fiber product. We sometimes call $g^{\prime}\colon A\times_{B}C\rightarrow A$ the pullback of $g$ along $f$; similarly $f^{\prime}$ is the pullback of $f$ along $g$. ###### Remark 2.2.2. The fiber product of the diagram $A\xrightarrow{f}B\xleftarrow{g}C$ above should probably be denoted $f\times_{B}g$ instead of $A\times_{B}C$, since it depends on the maps $f$ and $g$, not just their domains. However, this is not often done, and in this paper the maps will be clear from context. ###### Definition 2.2.3. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification. A simple schema of type $\pi$ consists of a pair $(C,\sigma)$, where $C$ is a finite (totally) ordered set and $\sigma\colon C\rightarrow{\bf DT}$ is a function. We sometimes denote the simple schema $(C,\sigma)$ by $\sigma$. We refer to $C$ as the column set or set of attributes for $\sigma$ and $\pi$ as the type specification for $\sigma$. Let $U_{\sigma}\colon=\sigma^{-1}(U)$ denote the fiber product $U\times_{\bf DT}C$. We call the pullback $\pi_{\sigma}\colon U_{\sigma}\rightarrow C$, i.e. the left hand map in the diagram $\textstyle{U_{\sigma}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi_{\sigma}}$$\textstyle{\lrcorner}$$\textstyle{U\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi}$$\textstyle{C\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sigma}$$\textstyle{{\bf DT},}$ the domain bundle on $C$ induced by $\sigma$. ###### Remark 2.2.4. We do not worry much about the ordering on $C$, as evidenced by the fact that we do not record it in the notation $(C,\sigma)$ for the simple schema. In fact the ordering requirement can be dropped from the definition if one so chooses. The reason we include it is first because the columns of a displayed table naturally come with an order (left to right), and second because it results in a more commonly used mathematical object down the road in Section 4. See Remark 4.1.1. ###### Example 2.2.5. Let $\pi\colon U\rightarrow{\bf DT}$ denote the type specification of Example 2.1.2. Let $C=(\textnormal{`First Name', `Last Name',`Age'})$, and define $\sigma\colon C\rightarrow{\bf DT}$ by $\displaystyle\sigma(\textnormal{`First Name'})$ $\displaystyle=`{\bf Strings}\textnormal{'}$ $\displaystyle\sigma(\textnormal{`Last Name'})$ $\displaystyle=`{\bf Strings}\textnormal{'}$ $\displaystyle\sigma(\textnormal{`Age'})$ $\displaystyle=`{\mathbb{Z}}^{\prime}$ We see that $C$ is a set of attributes for the simple schema $\sigma$. We call $C$ the column set because, once we arrange data in terms of tables, the columns of these tables will each be headed by an element of $C$. One can check that the domain bundle $U_{\sigma}\rightarrow C$ induced by $\sigma$ is the obvious function $({\bf Strings}\amalg{\bf Strings}\amalg{\mathbb{Z}})\longrightarrow C.$ Thus an object of type ‘First Name’ is a string in this example. ###### Definition 2.2.6. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification. A morphism of simple schemas (of type $\pi$), written $f\colon(C,\sigma)\rightarrow(C^{\prime},\sigma^{\prime})$, is an order- preserving function $f\colon C\rightarrow C^{\prime}$ such that the triangle --- $\textstyle{C\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f}$$\scriptstyle{\sigma}$$\textstyle{C^{\prime}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sigma^{\prime}}$$\textstyle{\bf DT}$ commutes. The category of simple schemas on $\pi$, denoted $\mathcal{S}^{\pi}$ is the category whose objects are simple schemas and whose morphisms are morphisms thereof. ###### Remark 2.2.7. Let ${\bf\Delta}$ denote the category of finite ordered sets. Let $({\bf\Delta}\downarrow{\bf DT})$ denote the category for which an object is a finite ordered set with a map to ${\bf DT}$ and for which a morphism is an order-preserving function, over ${\bf DT}$. One can easily see that the category $\mathcal{S}^{\pi}$ is isomorphic to $({\bf\Delta}\downarrow{\bf DT})$, regardless of $\pi$. However, we should think of $\pi$ as part of the data for a simple schema. Note that the symbol ${\bf\Delta}$ typically refers to the category of non- empty finite ordered sets; one typically denotes the category of all finite ordered sets as ${\bf\Delta}_{+}$. For typographical reasons, we do not follow the standard convention in this paper. ### 2.3. Records and Tables ###### Definition 2.3.1. Let $(C,\sigma)$ be a simple schema. A record on $(C,\sigma)$ is a function $r\colon C\rightarrow U_{\sigma}$ such that $\pi_{\sigma}\circ r=\textnormal{id}_{C}$, i.e. a section of the domain bundle for $\sigma$. We denote the set of records on $\sigma$ by $\Gamma^{\pi}(\sigma)$, or simply by $\Gamma(\sigma)$ if $\pi$ is understood. In other words, a record must produce, for each attribute $c\in C$, an object of type $\sigma(c)\in{\bf DT}$. ###### Example 2.3.2. Let $\pi$ and $(C,\sigma)$ be as in Example 2.2.5. A record on that simple schema is a section $r$ as depicted in the diagram $\textstyle{{\bf Strings}\amalg{\bf Strings}\amalg{\mathbb{Z}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi_{\sigma}}$$\textstyle{\\{\textnormal{`First Name', `Last Name',`BYear'}\\}.\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{r}$ That is, a record is a way to designate a first name and a last name (in ${\bf Strings}$) and an age (in ${\mathbb{Z}}$). For example (Barack; Obama; 1961) denotes a record on this simple schema; that is, it defines a section of $\pi_{\sigma}$. The set $\Gamma(\sigma)$ of records on $(C,\sigma)$ is simply the set of all possible such sections. In this example $\Gamma(\sigma)={\bf Strings}\times{\bf Strings}\times{\mathbb{Z}}$. ###### Definition 2.3.3. Let $\pi\colon U\rightarrow{\bf DT}$ be a type specification. A table of type $\pi$ consists of a sequence $(K,C,\sigma,\tau)$, where $K$ is a set, $(C,\sigma)$ is a simple schema of type $\pi$, and $\tau\colon K\rightarrow\Gamma(\sigma)$ is a function. We sometimes denote the table $(K,C,\sigma,\tau)$ simply by $\tau$. The set $K$ is called the set of keys of $\tau$, and $(C,\sigma)$ is called the simple schema of $\tau$. ###### Remark 2.3.4. Given a table $(K,C,\sigma,\tau)$, those familiar with SQL should think of the set $K$ of keys as the set of row identifiers for a table. These row ids are always unique identifiers and serve as an internal key system for the table; they are generally not considered as part of the data. ###### Remark 2.3.5. We do not require our tables to have finitely many rows. One could easily enforce such a restriction if desired, and follow the rest of the paper with that restriction in mind. The resulting category would be a full subcategory of the one we present in Definition 2.4.1, it would still be closed under finite limits (etc.), and queries would be taken in precisely the same way as they are here. ###### Example 2.3.6. Given a simple schema $(C,\sigma)$, a table on it is simply a collection of records indexed by a set $K$. The records need not be distinct because the set $K$ keeps track of the distinctions. Continuing with $\pi$ and $(C,\sigma)$ as in Example 2.3.2, we could have $K=\\{1,2,`foo^{\prime}\\}$ and let $\tau\colon K\rightarrow\Gamma(\sigma)$ be the assignment $\displaystyle 1$ $\displaystyle\mapsto\textnormal{(Barack; Obama; 1961)}$ $\displaystyle 2$ $\displaystyle\mapsto\textnormal{(Michelle; Obama; 1964)}$ $\displaystyle`foo^{\prime}$ $\displaystyle\mapsto\textnormal{(Barack; Obama; 1961)}$ This table can be written in more standard form as: K | ‘First Name’ | ‘Last Name’ | ‘BYear’ ---|---|---|--- 1 | Barack | Obama | 1961 2 | Michelle | Obama | 1964 ‘foo’ | Barack | Obama | 1961 We indicate with the double vertical line the fact that this table corresponds to a function whose domain is $K$. ###### Lemma 2.3.7. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification, let $(C_{1},\sigma_{1})$ and $(C_{2},\sigma_{2})$ denote simple schemas on $\pi$, and let $f\colon(C_{2},\sigma_{2})\rightarrow(C_{1},\sigma_{1})$ denote a morphism of simple schemas. There is an induced map on record sets $f^{*}\colon\Gamma(\sigma_{1})\rightarrow\Gamma(\sigma_{2})$. ###### Proof. Consider the diagram $\textstyle{U_{\sigma_{2}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi_{2}}$$\textstyle{\lrcorner}$$\textstyle{U_{\sigma_{1}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi_{1}}$$\textstyle{\lrcorner}$$\textstyle{U\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi}$$\textstyle{C_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f}$$\scriptstyle{\sigma_{2}}$$\textstyle{C_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\sigma_{1}}$$\textstyle{{\bf DT}.}$ Note that the left hand square is a fiber product square. This follows by applying basic category theory (specifically the “pasting lemma” for fiber products; see [ML98]) to the fact that the right hand square and the big rectangle are fiber product squares. We must show that a section $r_{1}\colon C_{1}\rightarrow U_{\sigma_{1}}$ of $\pi_{1}$ induces a section $r_{2}\colon C_{2}\rightarrow U_{\sigma_{2}}$ of $\pi_{2}$, because this assignment will constitute $f^{*}\colon\Gamma(\sigma_{1})\rightarrow\Gamma(\sigma_{2})$. Suppose given $r_{1}$ with $\pi_{1}\circ r_{1}=\textnormal{id}_{C_{1}}$. We have a map $r_{1}\circ f\colon C_{2}\rightarrow U_{\sigma_{1}}$ and a map $\textnormal{id}_{C_{2}}\colon C_{2}\rightarrow C_{2}$ such that $f\circ\textnormal{id}_{C_{2}}=f=\pi_{1}\circ(r_{1}\circ f)$. By the universal property, these two maps define a map $r_{2}\colon C_{2}\rightarrow U_{\sigma_{2}}$ such that, in particular $\pi_{2}\circ r_{2}=\textnormal{id}_{C_{2}}$. This is the desired section of $\pi_{2}$. ∎ Given a morphism $f\colon\sigma_{2}\rightarrow\sigma_{1}$ of simple schemas, the function $f^{*}\colon\Gamma(\sigma_{1})\rightarrow\Gamma(\sigma_{2})$ defined in the above lemma is said to be induced by $f$. ###### Definition 2.3.8. Let $\pi\colon U\rightarrow{\bf DT}$ be a type specification, and let $(K_{1},C_{1},\sigma_{1},\tau_{1})$ and $(K_{2},C_{2},\sigma_{2},\tau_{2})$ denote tables. A morphism of tables $\varphi\colon\tau_{1}\rightarrow\tau_{2}$ consists of a pair $(g,f)$, where $g\colon K_{1}\rightarrow K_{2}$ is a function and $f\colon(C_{2},\sigma_{2})\rightarrow(C_{1},\sigma_{1})$ is a morphism of simple schema such that the diagram of sets (5) commutes, where $f^{*}\colon\Gamma(\sigma_{1})\rightarrow\Gamma(\sigma_{2})$ is the function induced by $f$. ###### Example 2.3.9. Let us continue with Example 2.3.6, except for a slight renaming of objects: $C_{1}\colon=C,\sigma_{1}\colon=\sigma,K_{1}\colon=K,$ and $\tau_{1}\colon=\tau$. Let $C_{2}=\\{\textnormal{`First', `Last'}\\}$ and let $\sigma_{2}$ send both elements to the data type ${\bf Strings}\in{\bf DT}$; thus $\Gamma(\sigma_{2})={\bf Strings}\times{\bf Strings}$. Let $K_{2}=\\{5,6,`bar^{\prime}\\}$ and $\tau_{2}$ be the assignment $\displaystyle 5$ $\displaystyle\mapsto\textnormal{(Barack; Obama)}$ $\displaystyle 6$ $\displaystyle\mapsto\textnormal{(Michelle; Obama)}$ $\displaystyle`bar^{\prime}$ $\displaystyle\mapsto\textnormal{(George; Bush)}.$ A morphism of tables $\varphi\colon\tau_{1}\rightarrow\tau_{2}$ should consist of a map $g\colon K_{1}\rightarrow K_{2}$ and a map $f^{*}\colon\Gamma(C_{1})\rightarrow\Gamma(C_{2})$. We have an obvious map of simple schema $f\colon C_{2}\rightarrow C_{1}$, namely $\textnormal{`First'}\mapsto\textnormal{`First name'}$ and $\textnormal{`Last'}\mapsto\textnormal{`Last name'}$. Then $f^{*}\colon\Gamma(\sigma_{1})\rightarrow\Gamma(\sigma_{2})$ is just the projection ${\bf Strings}\times{\bf Strings}\times{\mathbb{Z}}\rightarrow{\bf Strings}\times{\bf Strings}$. Now, to define a morphism of tables $\varphi\colon\tau_{1}\rightarrow\tau_{2}$, our choice of $g$ must send both of the records $(\textnormal{Barack; Obama; 1961})$ in $\tau_{1}$ to the record $(\textnormal{Barack; Obama})$ and send the record $(\textnormal{Michelle; Obama; 1964})$ to the record $(\textnormal{Michelle; Obama})$. There is a unique such morphism $\phi$ in this case. For a variety of reasons, there does not exist a morphism of tables $\tau_{2}\rightarrow\tau_{1}$. ###### Remark 2.3.10. The morphism of tables in Example 2.3.9 has a common form. As in the example, a morphism of tables often is composed of a projection (in the columns) together with an inclusion (in the rows). The requirement that the square (5) in Definition 2.3.8 commutes is simply the requirement that morphisms preserve the integrity of the data. ### 2.4. The category of tables We have now defined tables and morphisms between tables. Given morphisms depicted $\textstyle{K_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{1}}$$\textstyle{\Gamma(\sigma_{1})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{K_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{2}}$$\textstyle{\Gamma(\sigma_{2})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{K_{3}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{3}}$$\textstyle{\Gamma(\sigma_{3})}$ it is easy to see how composition is defined. It is also easy to understand the identity morphism on a table $\tau\colon K\rightarrow\Gamma(C)$. Thus we have a category. ###### Definition 2.4.1. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification. The category whose objects are tables $K\rightarrow\Gamma(\sigma)$ and whose morphisms are commutative squares as in Definition 2.3.8 is called the category of tables on $\pi$ and is denoted ${\bf Tables}^{\pi}$, or simply ${\bf Tables}$, if $\pi$ is understood. ###### Example 2.4.2. Suppose $\pi\colon U\rightarrow{\bf DT}$ is as in Example 2.2.5. Suppose that $C=\\{c_{1},c_{2}\\}$ and $C^{\prime}=\\{c_{1}^{\prime}\\}$, and that $\sigma\colon C\rightarrow{\bf DT}$ and $\sigma^{\prime}\colon C^{\prime}\rightarrow{\bf DT}$ are the unique maps such that $\Gamma(\sigma)={\mathbb{Z}}\times{\mathbb{Z}}$ and $\Gamma(\sigma^{\prime})={\mathbb{Z}}$. Let $K$ and $K^{\prime}$ be any two sets and $\tau\colon K\rightarrow\Gamma(\sigma)$ and $\tau^{\prime}\colon K^{\prime}\rightarrow\Gamma(\sigma^{\prime})$ be any two tables. For a morphism $\tau_{1}\rightarrow\tau_{2}$ in the category of tables, we are allowed any kind of function between key sets $K\rightarrow K^{\prime}$, but the only permitted maps ${\mathbb{Z}}\times{\mathbb{Z}}\longrightarrow{\mathbb{Z}}$ are the two projections, because they are the only maps which are induced by morphisms of simple schema. ###### Definition 2.4.3. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification and let $\sigma\colon C\rightarrow{\bf DT}$ denote a simple schema. The category of tables on $\sigma$ of type $\pi$, denoted ${\bf Tables}^{\pi}_{\sigma}$ is the category whose objects are tables $\tau\colon K\rightarrow\Gamma(\sigma)$ and whose morphisms are triangles | | ---|---|--- $\textstyle{K_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{1}}$$\scriptstyle{g}$$\textstyle{\Gamma(\sigma)}$$\textstyle{K_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{2}}$ denoted by $g\colon\tau_{1}\rightarrow\tau_{2}$. ### 2.5. Relational tables The most common formulation of databases used today is the relational model, invented by E.F. Codd (see [Cod70]). It is based on the theory of mathematical logic, and more specifically on relations. One can find a modern treatment of the subject in [Dat05]. We define a relation in Definition 2.5.1 as a type of table, where the map $\tau\colon K\rightarrow\Gamma(\sigma)$ is required to be an injection. ###### Definition 2.5.1. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification, and let $\sigma\colon C\rightarrow{\bf DT}$ denote a simple schema on $\pi$. A relation on $\sigma$ is a table $\tau\colon K\rightarrow\Gamma(\sigma)$ for which $\tau$ is an injective function. A morphism of relations is a morphism of tables, for which the source and target tables are relations. That is, the category of relations, denoted ${\bf Rel}^{\pi}$ is the full subcategory of ${\bf Tables}^{\pi}$ spanned by the relations. Similarly, given a simple schema $\sigma$, the category of relations on $\sigma$ is the full subcategory of ${\bf Tables}^{\pi}_{\sigma}$ spanned by the relations. As usual the superscript $\pi$ can be dropped if it is understood. There is a functor ${\bf Rel}\rightarrow{\bf Tables}$ and a functor ${\bf Rel}_{\sigma}\rightarrow{\bf Tables}_{\sigma}$, both of which are simply inclusions of full subcategories. ## 3\. Constructions and formal properties of Tables Our definition for the category of tables (Definition 2.4.1) is sensible because objects are tables and morphisms are data-preserving maps. In this section we show that category-theoretic operations on tables correspond to operations on databases, such as joins and other queries. Fix a type specification $\pi\colon U\rightarrow{\bf DT}$ for the remainder of the section. We will drop $\pi$ as a superscript in this section; for example the category $\mathcal{S}^{\pi}$ of simple schema on $\pi$ will be denoted simply by $\mathcal{S}$. We sometimes refer to the underlying keys or underlying simple schema of a table, so we record these trivial constructions in a remark. ###### Remark 3.1.1. There is a forgetful functor ${\bf Tables}\rightarrow{\bf Sets}$ given by sending a table $\tau\colon K\rightarrow\Gamma(\sigma)$ to the key set $K$ and a morphism of tables to the underlying map of keys. There is another forgetful functor ${\bf Tables}\rightarrow\mathcal{S}^{\textnormal{op}}$ which sends the table $\tau$ to its simple schema $\sigma$ and a morphism $\varphi=(g,f)$ of tables to the underlying morphism of simple schema $f$. ###### Lemma 3.1.2. There exists a final object and an initial object in ${\bf Tables}$. ###### Proof. One checks immediately that if we take $K$ to be a terminal object in ${\bf Sets}$ (i.e. any set $K$ with cardinality 1) and $\sigma$ to be the inital object $\emptyset\rightarrow{\bf DT}$ in $\mathcal{S}$, then there is exactly one table with these as its underlying keys and simple schema, and this table is the terminal object in ${\bf Tables}$. One also checks immediately that if we take $K=\emptyset$ to be the initial object in ${\bf Sets}$ and $\sigma=\textnormal{id}_{{\bf DT}}\colon{\bf DT}\rightarrow{\bf DT}$ to be the final object in $\mathcal{S}$, then there is exactly one table with these as its underlying keys and simple schema, and this table is the initial object in ${\bf Tables}$. ∎ Certain colimits exist in ${\bf Tables}$; namely colimits of diagrams that are constant in the underlying simple schema. ###### Construction 3.1.3. Let $\tau_{1}\colon K_{1}\rightarrow\Gamma(\sigma)$ and $\tau_{2}\colon K_{2}\rightarrow\Gamma(\sigma)$ be two tables with the same simple schema. By taking the disjoint union of $K_{1}$ and $K_{2}$ we get a new table $\tau\colon K_{1}\amalg K_{2}\rightarrow\Gamma(\sigma)$. This query is called UNION ALL in SQL. We can also take the (non-disjoint) union of these two tables, if we know how they overlap. That is, if there is some set $K$ with maps $g_{1}\colon K\rightarrow K_{1}$ and $g_{2}\colon K\rightarrow K_{2}$ in such a way that $\tau_{1}\circ g_{1}=\tau_{2}\circ g_{2}$, then we can obtain a new table $\tau\colon K_{1}\amalg_{K}K_{2}\rightarrow\Gamma(\sigma)$. This query is called UNION in SQL. We will see that limits in the category of tables correspond to generalized joins. ###### Proposition 3.1.4. All finite limits exist in ${\bf Tables}$. ###### Proof. It suffices (see, for example, [MLM94, p. 30]) to show that ${\bf Tables}$ has a terminal object and is closed under taking fiber products; the first of these facts was shown in Lemma 3.1.2. For the second, suppose we have a diagram (12) in ${\bf Tables}$, where $\sigma\colon C\rightarrow{\bf DT}$ and $\sigma_{i}\colon C_{i}\rightarrow{\bf DT}$ for $i=1,2$ are simple schemas. As indicated, the maps $\Gamma(\sigma_{i})\rightarrow\Gamma(\sigma)$ are induced by morphisms of simple schema $f_{i}\colon\sigma\rightarrow\sigma_{i}$, for $i=1,2$. Consider the simple schema $(\sigma_{1}\amalg_{\sigma}\sigma_{2})\colon C_{1}\amalg_{C}C_{2}\longrightarrow{\bf DT}$ induced by taking the colimit of the column sets. We would like to show that the natural function (13) $\displaystyle\Gamma(\sigma_{1}\amalg_{\sigma}\sigma_{2})\longrightarrow\Gamma(\sigma_{1})\times_{\Gamma(\sigma)}\Gamma(\sigma_{2})$ is a bijection. Let us first calculate the set $\Gamma(\sigma_{1}\amalg_{\sigma}\sigma_{2})$. It is the set of all sections $r$ of the map $\pi^{\prime}$ in the diagram $\textstyle{(\sigma_{1}\amalg_{\sigma}\sigma_{2})^{-1}(U)\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\lrcorner}$$\scriptstyle{\pi^{\prime}}$$\textstyle{U\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\pi}$$\textstyle{C_{1}\amalg_{C}C_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{r}$$\scriptstyle{\sigma_{1}\amalg_{\sigma}\sigma_{2}}$$\textstyle{{\bf DT}.}$ To give such a section is to give, for each $c_{1}\in C_{1}$ an element of $\pi^{-1}(\sigma_{1}(c_{1}))$, and for each $c_{2}\in C_{2}$ an element of $\pi^{-1}(\sigma_{2}(c_{2}))$, in such a way that for all $c\in C$, the induced elements in $\pi^{-1}(\sigma_{i}(f_{i}(c)))$ are the same for $i=1,2$. This is precisely the data needed for a unique element of the set $\Gamma(\sigma_{1})\times_{\Gamma(\sigma)}\Gamma(\sigma_{2})$; this proves the claim that the map in (13) is a bijection. It now follows that the fiber product of Diagram (12) is the table $\tau_{1}\times_{\tau}\tau_{2}\colon K_{1}\times_{K}K_{2}\longrightarrow\Gamma(\sigma_{1}\amalg_{\sigma}\sigma_{2})$ obtained by taking the fiber product of sources and targets in (12), and the induced map between them. ∎ Proposition 3.1.4 gives the formula for the join of two tables over a third. As one sees from the construction, the columns of the join are the union of the columns of the given tables, and the key set is the fiber product of the key sets of the given tables. ###### Lemma 3.1.5. Let $\sigma\colon C\rightarrow{\bf DT}$ denote a simple schema. The category ${\bf Tables}_{\sigma}$ of tables on $\sigma$ is closed under small limits and colimits. ###### Proof. The category of sets is closed under small limits and colimits. To take the limit or colimit of a diagram $X\colon I\rightarrow{\bf Tables}_{\sigma}$, simply take the limit or colimit (respectively) of the underlying diagram of key sets – see Definition 3.1.1. This set comes with a natural map to $\Gamma(\sigma)$, and one shows easily that it is the limit or colimit (respectively) of $X$. ∎ ###### Example 3.1.6. Let $\sigma\colon C\rightarrow{\bf DT}$ denote a simple schema. The initial and final objects in ${\bf Tables}_{\sigma}$ are $\emptyset\rightarrow\Gamma(\sigma)$ and $\textnormal{id}_{\Gamma(\sigma)}\colon\Gamma(\sigma)\rightarrow\Gamma(\sigma)$, respectively. ###### Construction 3.1.7. Let $\tau\colon K\rightarrow\Gamma(\sigma)$ be a table with simple schema $\sigma\colon C\rightarrow{\bf DT}$, and let $C^{\prime}\subset C$ be a subset of its column set. There is an induced table $\tau|_{C^{\prime}}\colon K\rightarrow\Gamma(\sigma|_{C^{\prime}}).$ In SQL this construction is called the projection of $\tau$ onto the subset $C^{\prime}\subset C$ of columns. Using the projection query, one can realize a SELECT query as a limit of databases. ###### Construction 3.1.8. Let us construct the SELECT query. One begins with a table $\tau\colon K\rightarrow\Gamma(\sigma)$ with simple schema $\sigma\colon C\rightarrow{\bf DT}$, from which to select. Let $f\colon C^{\prime}\subset C$ be a subset of its columns, and let $\sigma^{\prime}=\sigma|_{C^{\prime}}\colon C^{\prime}\rightarrow{\bf DT}$ be the restricted simple schema. One may select from $\tau$ all records whose restriction to $C^{\prime}$ is a member of some list. We encode this list as a table $\tau^{\prime}\colon K^{\prime}\rightarrow\Gamma(\sigma^{\prime})$ on $\sigma^{\prime}$. In order to select from $\tau$ all records whose restriction to $C^{\prime}$ is in the table $\tau^{\prime}$, take the limit of the diagram $\textstyle{K\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau}$$\scriptstyle{f^{*}\circ\tau}$$\textstyle{\Gamma(\sigma)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}}$$\textstyle{\Gamma(\sigma^{\prime})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$id$\textstyle{\Gamma(\sigma^{\prime})}$$\textstyle{K^{\prime}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau^{\prime}}$$\scriptstyle{\tau^{\prime}}$$\textstyle{\Gamma(\sigma^{\prime}).\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$id This limit is the desired SELECT query. ###### Example 3.1.9. Let $\tau\colon K\rightarrow\Gamma(\sigma)$ be the table from Example 2.3.6. To select all instances for which the first name is Barack, let $C^{\prime}=\\{\textnormal{`First Name'}\\}$. Let $\tau^{\prime}$ denote the one-row table K’ | ‘First Name’ ---|--- k’ | Barack Both $\tau$ and $\tau^{\prime}$ have a canonical map to the terminal table on $C^{\prime}$, the table with one column (‘First Name’) and with a row for each element of ${\bf Strings}$. Of course, this terminal table is too big to write down, but we do not need it. The fiber product is easily computed to be the table K | ‘First Name’ | ‘Last Name’ | ‘BYear’ ---|---|---|--- 1 | Barack | Obama | 1961 ‘foo’ | Barack | Obama | 1961 We conclude this section by a quick remark on the category-theoretic properties of the relational tables. ###### Remark 3.1.10. Relations behave much like ordinary tables. Limits exist in ${\bf Rel}$ and ${\bf Rel}_{\sigma}$. The functor ${\bf Rel}\rightarrow{\bf Tables}$ preserves limits, and the functor ${\bf Rel}_{\sigma}\rightarrow{\bf Tables}_{\sigma}$ preserves limits but does not preserve colimits. We take the viewpoint that the “correct” way to take a colimit of a diagram $X\colon I\rightarrow{\bf Rel}_{\sigma}$ is to pass to the diagram $I\rightarrow{\bf Tables}_{\sigma}$ and take its colimit instead. This claim, in particular, says that sometimes UNION ALL is more appropriate than UNION is. Since UNION ALL is not legal in the strict relational database theory (or it would be the same as UNION), our viewpoint could be seen as controversial to purists of the relational model. ## 4\. Schemas and databases A relational database is a set of relations, together with a system of keys and foreign keys which link the relations together. The definition of relations themselves is, of course, quite mathematically precise. However, the precise way in which these relations are allowed to be linked together is rarely written down as a mathematical structure in its own right, either in research papers or textbooks (we could not find it in [Dat05] or [EN07], for example). For example, ER diagrams are exemplified or even defined, but not as a mathematical object (like relations are). There are exceptions, such as [RW92, 2.1], but as far as we know, these definitions are not actually the ones used, either by practitioners or by theorists. In this section we will define simplicial databases in a rigorous way (see Definition 4.3.3). Although examples will be plentiful, they will never stand in for precise definitions. We will also define morphisms of databases, thus making explicit the idea of “data-preserving maps.” Providing a precise definition of the category of databases may be useful to database theorists, as well as to people interested in studying mathematical informatics. ### 4.1. Schemas Roughly, a simplicial set is a picture that can be drawn with vertices, edges, solid triangles, solid tetrahedra, and solid “higher-dimensional tetrahedra.” For any integer $n\geq 0$, an $n$-dimensional solid tetrahedron, or $n$-simplex, is the “diagonal triangle” shape in ${\mathbb{R}}^{n+1}$ given by the algebraic equation $x_{1}+x_{2}+\cdots+x_{n+1}=1$ and the inequalities $x_{i}\geq 0$ for $1\leq i\leq n+1$. To draw with these shapes is to connect various tetrahedra together along their faces (or subfaces). For example, one could connect four triangles together along various faces to obtain an empty tetrahedron, the boundary of the 3-simplex. Simplicial sets are a fundamental tool in algebraic topology, and are important in many other fields within mathematics, such as combinatorial commutative algebra. See [Fri08] or [GJ99] for details. A database is a system of tables which are connected together via foreign keys. This information is part of the schema for the database. In our formulation, we keep track of this information using (something akin to) simplicial sets as our schema. Tables are connected together when the corresponding simplices are connected. We use a slight variant of simplicial sets, which we will define in Definition 4.1.2. Namely, since columns can only take entries in a given data type, we must keep track of this information. For this reason, the simplicial sets we use as schema have labeled vertices, where each label is an element of ${\bf DT}$. We do not define schemas exactly this way, however, because a more generalizable way to phrase it may be useful for future generalizations. ###### Remark 4.1.1. As mentioned in Remark 2.2.4, some prefer the columns of each table in a database to be unordered, whereas we have chosen to consider them as an ordered set. Simply using symmetric simplicial sets, a variant of simplicial sets in which vertices are unordered, will solve any such issue. See [Gra01] for details on symmetric simplicial sets. ###### Definition 4.1.2. Let ${\bf\Delta}$ denote the category of finite ordered sets, let $\pi\colon U\rightarrow{\bf DT}$ be a type specification, and let $\mathcal{S}\cong({\bf\Delta}\downarrow{\bf DT})$ denote the category of simple schema on $\pi$ (see Definition 2.2.3 and Remark 2.2.7). We define the category of schema on $\pi$, denoted ${\bf Sch}^{\pi}$ to be the category whose objects are functors $X\colon\mathcal{S}^{\textnormal{op}}\rightarrow{\bf Sets}$ and whose morphisms are natural transformations of functors. Let $X\in{\bf Sch}^{\pi}$ denote a schema. Given a simple schema $\sigma\colon C\rightarrow{\bf DT}$, the $\sigma$-simplices of $X$ are the elements of the set $X(\sigma)$, and we write $X_{\sigma}$ to denote $X(\sigma)$. ###### Remark 4.1.3. Given a category $\mathcal{C}$, the category whose objects are functors $\mathcal{C}^{\textnormal{op}}\rightarrow{\bf Sets}$ and whose morphisms are natural transformations of functors is called the category of presheaves on $\mathcal{C}$ and denoted ${\bf Pre}(\mathcal{C})$. It is a common mathematical construction which “formally adds all colimits to $\mathcal{C}$.” That is, ${\bf Pre}(\mathcal{C})$ is closed under taking colimits, and for any functor $\mathcal{C}\rightarrow\mathcal{D}$ to a category $\mathcal{D}$ which is closed under taking colimits, there is a unique colimit-preserving functor ${\bf Pre}(\mathcal{C})\rightarrow\mathcal{D}$ over $\mathcal{C}$. See, for example, [MLM94, I.5.4]. Thus, we have ${\bf Sch}^{\pi}={\bf Pre}(\mathcal{S}^{\pi})$. Since $\mathcal{S}^{\pi}$ signifies the category of ways to set up columns of a tables, ${\bf Pre}(\mathcal{S}^{\pi})$ is the category of ways to glue such things together. ###### Remark 4.1.4. The category of (augmented) simplicial sets is the category ${\bf Pre}({\bf\Delta})$. The only difference between it and ${\bf Pre}(\mathcal{S}^{\pi})\cong{\bf Pre}({\bf\Delta}\downarrow{\bf DT})$ is that each simplex in ${\bf Sch}^{\pi}$ has labeled vertices, whereas simplices in ${\bf Pre}({\bf\Delta})$ do not. In the introduction to this section we described simplicial sets in terms of tetrahedra. After making the necessary modifications, we see that a schema is constructed by gluing together labeled tetrahedra along their faces, where we only allow these tetrahedra to be glued if their labels match. If $X$ is a schema, we sometimes refer to the simplices of its underlying simplicial set as simplices of $X$. Thus, the $n$-simplices of $X$ is the union of all $\sigma$-simplices of $X$, where $\sigma\colon C\rightarrow{\bf DT}$ is a simple schema with cardinality $\textnormal{card}(C)=n+1$. That is, we write $X_{n}=\coprod_{\\{\sigma\colon C\rightarrow{\bf DT}|\textnormal{card}(C)=n+1\\}}X_{\sigma}.$ There is a classifying map $s\colon X_{0}=\amalg_{a\in{\bf DT}}(X_{a})\rightarrow{\bf DT}$ which sends all of $X_{a}$ to $a$, for each $a\in{\bf DT}$. One of the best features of the schema we are presenting here is their geometric nature, as described in the first paragraph of this section. Unfortunately, Definition 4.1.2 does not make the geometry explicit at all. Hopefully the next few examples will help make it more clear. ###### Example 4.1.5. Let $\sigma\colon C\rightarrow{\bf DT}$ denote a simple schema. It naturally defines a schema $X=\Delta^{\sigma}$ as the functor which sends a simple schema $\sigma^{\prime}\colon C^{\prime}\rightarrow{\bf DT}$ to the set $X_{\sigma^{\prime}}=\textnormal{Hom}_{\mathcal{S}}(\sigma^{\prime},\sigma)$. If $C$ has $n+1$ elements, one visualizes $\Delta^{\sigma}$ as an $n$-dimensional tetrahedron whose vertices are labeled by elements in the image of $\sigma$. This is not just a heuristic: there is a geometric realization functor $Re:{\bf Sch}\rightarrow{\bf Top}$ which realizes every schema as a topological space in a natural way, and behaves as we have described for simplices $\Delta^{\sigma}$. As an example, suppose $C$ has two elements and their images under $\sigma$ are $a,b\in{\bf DT}$. We imagine $\Delta^{\sigma}$ as a line segment, whose vertices are labeled $a$ and $b$. If $C^{\prime}$ has three elements and $\sigma^{\prime}$ sends two of them to $a$ and one of them to $b$, we imagine $\Delta^{\sigma^{\prime}}$ as a filled-in triangle, whose vertices are labeled $a,a,$ and $b$. The figures we have imagined are the images of $\sigma$ and $\sigma^{\prime}$ under $Re$. ###### Definition 4.1.6. Let $\sigma\in\mathcal{S}$ denote a simple schema. The schema $\Delta^{\sigma}\in{\bf Sch}$ defined in Example 4.1.5 is called the $\sigma$-simplex and, as a functor $\mathcal{S}^{\textnormal{op}}\rightarrow{\bf Sets}$, is said to be represented by $\sigma$. ###### Example 4.1.7. We have mentioned that every object in ${\bf Sch}^{\pi}$ can be obtained by gluing together simplices. This is proven in [Bor94a, 2.15.6]. Let us explain how we would construct the union $X$ of two edges along a common vertex. Suppose that the common vertex is labeled $b$ and the other vertices are labeled $a$ and $c$. The schema $X$ is obtained as the colimit of the diagram $\Delta^{(a,b)}\leftarrow\Delta^{(b)}\rightarrow\Delta^{(b,c)}$ taken in ${\bf Sch}^{\pi}$. We will now write down this schema explicitly as a presheaf on $\mathcal{S}^{\pi}$, i.e. as a functor $X\colon({\bf\Delta}\downarrow{\bf DT})^{\textnormal{op}}\rightarrow{\bf Sets}$. Given $\sigma\colon C\rightarrow{\bf DT}$, we let $X_{\sigma}$ be a single element if the image of $\sigma$ is contained in $\\{a,b\\}$ or contained in $\\{b,c\\}$. Otherwise we take $X_{\sigma}$ to be the empty set. ###### Example 4.1.8. A basic example of a schema is that of a set of labeled vertices with no edges or higher simplices connecting them. This is obtained as a coproduct of $0$-simplices (see Remark 4.1.3), and it is called a discrete schema. ### 4.2. Sheaves on a schema ###### Definition 4.2.1. Let $X\in{\bf Sch}^{\pi}$ denote a schema. A subschema of $X$ consists of a schema $X^{\prime}\in{\bf Sch}^{\pi}$ such that for every $\sigma\in\mathcal{S}^{\pi}$ we have $X^{\prime}_{\sigma}\subset X_{\sigma}$. The subschemas of $X$ form a category ${\bf Sub}(X)$, in which there is a morphism $X^{\prime\prime}\rightarrow X^{\prime}$ in ${\bf Sub}(X)$ if and only if $X^{\prime\prime}$ is a subschema of $X^{\prime}$. We will soon be discussing colimits in the category ${\bf Sub}(X)$. One should note that ${\bf Sub}(X)$ is particularly nice, in that the colimit of any diagram $D\colon I\rightarrow{\bf Sub}(X)$ is the smallest subschema $X^{\prime}\subset X$ which contains $D(i)$ for all $i\in I$. In the language of lattices or locales, one writes $\mathop{\textnormal{colim}}(D)=\bigvee_{i\in I}D(i)$. See [Bor94b, 1.3]. ###### Definition 4.2.2. We define a sheaf on $X$ to be a functor $\mathcal{K}\colon{\bf Sub}(X)^{\textnormal{op}}\rightarrow{\bf Sets}$ such that, for every diagram $D\colon I\rightarrow{\bf Sub}(X)$, the natural map $\mathcal{K}(\mathop{\textnormal{colim}}(D))\longrightarrow\lim(\mathcal{K}(D))$ is an isomorphism. That is, $\mathcal{K}$ must send colimits of subschema to corresponding limits of sets. A morphism of sheaves on $X$ is a natural transformation of functors ${\bf Sub}(X)^{\textnormal{op}}\rightarrow{\bf Sets}$. Let ${\bf Shv}(X)$ denote the category of sheaves on $X$. ###### Remark 4.2.3. Category theory experts will recognize ${\bf Shv}(X)$ as the category of sheaves on a certain Grothendieck site (the locale of subobjects of $X$). It is well known that ${\bf Shv}(X)$ is therefore closed under small limits and colimits. Moreover, there is an adjunction $\textstyle{{\bf Pre}(X)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{Sh}$$\textstyle{{\bf Shv}(X)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$ for which the right adjoint is the forgetful functor and the left adjoint is called sheafification. Roughly, one sheafifies a presheaf on a schema by replacing its value on each union of simplices by the fiber product of its values on those simplices. See [MLM94] for details. ###### Example 4.2.4. For any schema $X$, there is an object $\emptyset\in{\bf Sub}(X)$, which is the colimit of the empty diagram on ${\bf Sub}(X)$. Hence if $\mathcal{K}$ is to be a sheaf on $X$, one must have $\mathcal{K}(\emptyset)\cong\\{*\\}$. If $X$ is a discrete schema (see Example 4.1.8), then $X$ is the coproduct its $0$-simplices. Thus, if $\mathcal{K}$ is to be a sheaf on $X$, we must have $\mathcal{K}(X)=\prod_{x\in X_{0}}\mathcal{K}(x).$ ###### Example 4.2.5. Suppose that $X\in{\bf Sch}^{\pi}$ is the schema $\Delta^{(`{\bf Str}\textnormal{'},`{\mathbb{Z}}\textnormal{'})}$, which looks like this: $\textstyle{~{}^{`{\bf Str}\textnormal{'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\bullet^{`{\mathbb{Z}}\textnormal{'}}.}$ The category ${\bf Sub}(X)$ is a partially ordered set with five objects: $\emptyset$, $\bullet^{`{\bf Str}\textnormal{'}}$,$\bullet^{`{\mathbb{Z}}\textnormal{'}}$, $(\bullet^{`{\bf Str}\textnormal{'}},\bullet^{`{\mathbb{Z}}\textnormal{'}})$, and $X$ itself; ${\bf Sub}(X)$ has inclusions as morphisms. A sheaf $\mathcal{K}\in{\bf Shv}(X)$ assigns a set to each of these five objects, and functions to each inclusion. However, by Example 4.2.4, it must assign to $\emptyset$ the terminal set, $\mathcal{K}(\emptyset)=\\{*\\}$, and it must assign to $(\bullet^{`{\bf Str}\textnormal{'}},\bullet^{`{\mathbb{Z}}\textnormal{'}})$ the product $\mathcal{K}(\bullet^{`{\bf Str}\textnormal{'}})\times\mathcal{K}(\bullet^{`{\mathbb{Z}}\textnormal{'}})$. Thus, to specify a sheaf, we need only specify two values, and one morphism, namely $\mathcal{K}(X)\rightarrow\mathcal{K}(\bullet^{`{\bf Str}\textnormal{'}})\times\mathcal{K}(\bullet^{`{\mathbb{Z}}\textnormal{'}})$. For example we may choose on objects the assignments $\mathcal{K}(X)=\\{4,cc,10\\}$, $\mathcal{K}(\bullet^{`{\bf Str}\textnormal{'}})=\\{1,2\\}$, and $\mathcal{K}(\bullet^{`{\mathbb{Z}}\textnormal{'}})=\\{x,y,z\\}$; this implies $\mathcal{K}((\bullet^{`{\bf Str}\textnormal{'}},\bullet^{`{\mathbb{Z}}\textnormal{'}}))$ is isomorphic to $\\{1x,1y,1z,2x,2y,2z\\}$. Any function from $\\{4,cc,10\\}$ to this six element set, say $4\mapsto 1x,cc\mapsto 2z,10\mapsto 2z$, defines the restriction maps in our sheaf $\mathcal{K}$. These restriction maps can be thought of as “foreign keys.” ###### Definition 4.2.6. Given a schema $X\in{\bf Sch}^{\pi}$, we have been working with the category ${\bf Sub}(X)$ of subschemas of $X$. There is a related category, called the category of nonempty non-degenerate simple schemas over $X$ and denoted ${\bf ND}(X)$, whose objects are monomorphisms $\Delta^{\sigma}\hookrightarrow X$ in ${\bf Sch}^{\pi}$, where $\sigma\colon C\rightarrow{\bf DT}$ is a schema with $C\neq\emptyset$ (see Example 4.1.5), and whose morphisms are commutative triangles. Every simplex in a schema has a unique underlying non-degenerate simplex (of which it is the degeneracy), so one can define a functor ${\bf ND}\colon{\bf Sch}^{\pi}\rightarrow{\bf Cat}$. Since every injection $\Delta^{\sigma}\hookrightarrow X$ is in particular a subschema, there is an obvious functor ${\bf ND}(X)\rightarrow{\bf Sub}(X).$ This induces an adjunction $\textstyle{{\bf Pre}({\bf ND}(X))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{{\bf Pre}({\bf Sub}(X)).\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$ No nontrivial unions exist in ${\bf ND}(X)$, so this adjunction becomes $\textstyle{{\bf Pre}({\bf ND}(X))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{L}$$\textstyle{{\bf Shv}({\bf Sub}(X)),\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{R}$ where ${\bf Pre}({\bf ND}(X))$ is the category of presheaves ${\bf ND}(X)^{\textnormal{op}}\rightarrow{\bf Sets}$. See [Joh02, C.1.4.3] for more details on this type of construction. ###### Proposition 4.2.7. Let $X\in{\bf Sch}^{\pi}$ be a schema, and let ${\bf ND}(X)$ denote the category of non-degenerate nonempty simple schema over $X$. The adjunction $\textstyle{{\bf Pre}({\bf ND}(X))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{L}$$\textstyle{{\bf Shv}({\bf Sub}(X)),\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{R}$ is an equivalence of categories. ###### Proof. It is an easy exercise to show that the composition $L\circ R$ is equal to the identity on ${\bf Pre}({\bf ND}(X))$ and that $K\circ L$ is canonically isomorphic to the identity on ${\bf Shv}({\bf Sub}(X))$. ∎ Proposition 4.2.7 says that one does not have to worry about sheaves: the category ${\bf Shv}(X)$ is equivalent to a category of functors (without “sheaf” requirements). ###### Lemma 4.2.8. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification and let $f\colon X\rightarrow Y$ denote a morphism of schema on $\pi$. There is an adjunction $\textstyle{{\bf Shv}({\bf Sub}(Y))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}}$$\textstyle{{\bf Shv}({\bf Sub}(X))\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f_{*}}$ defined as follows for sheaves $\mathcal{K}_{X}\in{\bf Shv}({\bf Sub}(X))$ and $\mathcal{K}_{Y}\in{\bf Shv}({\bf Sub}(Y))$. For any $U\in{\bf Sub}(X)$ we take $f^{*}\mathcal{K}_{Y}(U)\colon=\mathcal{K}_{Y}(f(U)),$ where $f(U)\in{\bf Sub}(Y)$ is the image of $U$ in $Y$. For any $V\in{\bf Sub}(Y)$ we take $f_{*}\mathcal{K}_{X}(V)\colon=\mathcal{K}_{X}(f^{-1}(V)),$ where $f^{-1}(V)$ is the preimage of $V$ in $X$. ###### Proof. Colimits of presheaves are computed objectwise, and it follows from Proposition 4.2.7 that the functor $f^{*}$, defined above, preserves colimits. Hence, it suffices to show that for any representable sheaf $rY^{\prime}=\textnormal{Hom}_{{\bf Sub}(Y)}(-,Y^{\prime})\in{\bf Shv}({\bf Sub}(Y))$ and sheaf $T\in{\bf Shv}({\bf Sub}(X))$, one has an isomorphism $\textnormal{Hom}(f^{*}(rY^{\prime}),T)\cong^{?}\textnormal{Hom}(rY^{\prime},f_{*}T).$ To begin, note that for any $U\in{\bf Sub}(X)$ one has a chain of natural isomorphisms $\displaystyle f^{*}(rY^{\prime})(U)\colon=(rY^{\prime})(f(U))$ $\displaystyle\cong\textnormal{Hom}_{{\bf Sub}(Y)}(f(U),Y^{\prime})$ $\displaystyle\cong\textnormal{Hom}_{{\bf Sub}(X)}(U,f^{-1}(Y^{\prime}))\cong r(f^{-1}(Y^{\prime}))(U).$ That is, $f^{*}(rY^{\prime})\cong r(f^{-1}(Y^{\prime})).$ By another chain of natural isomorphisms, we have $\displaystyle\textnormal{Hom}(f^{*}(rY^{\prime}),T)$ $\displaystyle\cong\textnormal{Hom}(r(f^{-1}(Y^{\prime})),T)$ $\displaystyle\cong T(f^{-1}(Y^{\prime}))$ $\displaystyle=:f_{*}T(Y^{\prime})=\textnormal{Hom}(rY^{\prime},f_{*}T).$ This proves the lemma. ∎ ### 4.3. Simplicial databases We think of a schema as a way of organizing the data in a database. Before we say what a database is, let us give one more example of a schema. In some sense it will be the fundamental example of a schema; however, it should not really be thought of as a way to organize the data, but as the meaning of the data itself. ###### Example 4.3.1. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification, and let $\mathcal{S}=\mathcal{S}^{\pi}$ denote the category of simple schema on $\pi$. Let $\Gamma^{\pi}\colon\mathcal{S}^{\textnormal{op}}\rightarrow{\bf Sets}$ denote the functor which assigns to a schema $\sigma\colon C\rightarrow{\bf DT}$ the set $\Gamma^{\pi}(\sigma)$ of records on $\sigma$ (see Definition 2.3.1). By Lemma 2.3.7, a map $\sigma\rightarrow\sigma^{\prime}$ induces a function $\Gamma^{\pi}(\sigma^{\prime})\rightarrow\Gamma^{\pi}(\sigma)$, so $\Gamma^{\pi}$ is indeed a contravariant functor. By definition we can consider $\Gamma^{\pi}$ as a schema on $\pi$ and write $\Gamma^{\pi}\in{\bf Sch}^{\pi}$. We call $\Gamma^{\pi}$ the universal record on $\pi$, for reasons which will be clear soon. If the type specification $\pi\colon U\rightarrow{\bf DT}$ is obvious from context, we may denote $\Gamma^{\pi}$ simply by $\Gamma$. ###### Definition 4.3.2. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification, let $\Gamma^{\pi}$ denote the universal record on $\pi$, and let $X\in{\bf Sch}^{\pi}$ denote a schema on $\pi$. The universal sheaf on $X$ of type $\pi$ is the sheaf $\mathcal{U}^{\pi}$ whose value on a subschema $X^{\prime}\subset X$ is the set $\mathcal{U}^{\pi}(X^{\prime})=\textnormal{Hom}_{{\bf Sch}^{\pi}}(X^{\prime},\Gamma^{\pi}).$ Each element of $\mathcal{U}^{\pi}(X^{\prime})$ is called a record on $X^{\prime}$ of type $\pi$. If $\pi$ is clear from context, we may write $\mathcal{U}$ to denote $\mathcal{U}^{\pi}$. Now let $X,Y\in{\bf Sch}^{\pi}$ be schema and let $\mathcal{U}_{X}$ and $\mathcal{U}_{Y}$ denote the universal sheaf of type $\pi$ on $X$ and $Y$, respectively. A map of schema $f\colon Y\rightarrow X$ induces a morphism $\mathcal{U}_{f}\colon f^{*}\mathcal{U}_{X}\rightarrow\mathcal{U}_{Y}$ as follows. Let $Y^{\prime}\subset Y$ denote an object in ${\bf Sub}(Y)$; then composing with $f$ induces a natural map $f^{*}\mathcal{U}_{X}(Y^{\prime})=\textnormal{Hom}_{{\bf Sch}^{\pi}}(f(Y^{\prime}),\Gamma^{\pi})\longrightarrow\textnormal{Hom}_{{\bf Sch}^{\pi}}(Y^{\prime},\Gamma^{\pi})=\mathcal{U}_{Y}(Y^{\prime}),$ which we denote $\mathcal{U}_{f}$; it is similarly defined on morphisms. ###### Definition 4.3.3. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification. A simplicial database (or simply database) of type $\pi$ is a triple $(X,\mathcal{K},\tau)$ where $X\in{\bf Sch}^{\pi}$ is a schema of type $\pi$, $\mathcal{K}\in{\bf Shv}(X)$ is a sheaf of sets on ${\bf Sub}(X)$, and $\tau\colon\mathcal{K}\rightarrow\mathcal{U}_{X}$ is a morphism of sheaves on $X$ (see Definition 4.3.2). We refer to $X$ as the schema, $\mathcal{K}$ as the sheaf of keys, and $\tau$ as the data of the database $(X,\mathcal{K},\tau)$. ###### Remark 4.3.4. Given a set of ways to measure objects, it often happens that we have several objects with the same measurements. For example, we may have three green apples, or two 1999 Toyota Corollas. In relational databases, if two objects have the same attributes, then they are taken to be the same instance. To keep them distinct, one introduces a unique identifier, an artificial key, which becomes part of the data. This causes problems with database integration, because the arbitrarily-chosen artificial keys in one database will generally not match with those in another. In our definition, the keys for the data are kept separate, as the sheaf of sets $\mathcal{K}$. Different names for the keys in no way affect the data itself and therefore do not interfere with database integration. We say more about this in Section 5.3. ###### Example 4.3.5. In Example 4.2.5, we wrote down a sheaf $\mathcal{K}\in{\bf Shv}(X)$ on the schema $X=\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 11.36163pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&\crcr}}}\ignorespaces{\hbox{\kern-11.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{~{}^{`{\bf Str}\textnormal{'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 35.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{\bullet^{`{\mathbb{Z}}\textnormal{'}},}$}}}}}}}\ignorespaces}}}}\ignorespaces$ and we will continue to use it in this example. To specify a database on $X$ of type $\pi$, we must give a morphism $\tau\colon\mathcal{K}\rightarrow\mathcal{U}^{\pi}$ of sheaves on $X$. We defined the universal sheaf $\mathcal{U}_{X}$ of type $\pi$ on $X$ in Definition 4.3.2. We have $\displaystyle\mathcal{U}_{X}(X)=\mathcal{U}_{X}((\bullet^{`{\bf Str}\textnormal{'}},\bullet^{`{\mathbb{Z}}\textnormal{'}}))$ $\displaystyle={\bf Str}\times{\mathbb{Z}}$ $\displaystyle\mathcal{U}_{X}(\bullet^{`{\bf Str}\textnormal{'}})$ $\displaystyle={\bf Str}$ $\displaystyle\mathcal{U}_{X}(\bullet^{`{\mathbb{Z}}\textnormal{'}})$ $\displaystyle={\mathbb{Z}}$ $\displaystyle\mathcal{U}_{X}(\emptyset)$ $\displaystyle=\\{*\\}.$ To define a map $\tau\colon\mathcal{K}\rightarrow\mathcal{U}_{X}$, we must give maps $\begin{array}[]{lll}\tau(\bullet^{`{\bf Str}\textnormal{'}})\colon\mathcal{K}(\bullet^{`{\bf Str}\textnormal{'}})\rightarrow\mathcal{U}_{X}(\bullet^{`{\bf Str}\textnormal{'}}),&&\tau(\bullet^{`{\mathbb{Z}}\textnormal{'}})\colon\mathcal{K}(\bullet^{`{\mathbb{Z}}\textnormal{'}})\rightarrow\mathcal{U}_{X}(\bullet^{`{\mathbb{Z}}\textnormal{'}})\end{array}$ and $\tau(X)\colon\mathcal{K}(X)\rightarrow\mathcal{U}_{X}(X)$ that compose correctly with the restriction maps. We arbitrarily assign $\begin{array}[]{lllllll}\tau(1)&=&\textnormal{Barack}&&\tau(x)&=&1961\\\ \tau(2)&=&\textnormal{Michelle}&&\tau(y)&=&1946\\\ &&&&\tau(z)&=&1964.\end{array}$ Now $\mathcal{K}(X)=\\{4,cc,10\\}$, and the restriction map sends $4\mapsto 1x$, $cc\mapsto 2z$, and $10\mapsto 2z$. This forces $\tau(4)=\textnormal{(Barack; 1961)}$ and $\tau(cc)=\tau(10)=\textnormal{(Michelle; 1964)}$. The other values and restriction maps for $\mathcal{K}$ are now also forced. ###### Example 4.3.6. In Example 4.3.5, we followed the definitions very closely, perhaps to the detriment of the big ideas. In this example, we write down how the sheaf “looks” as a collection of tables. Let us first change the schema $X$ very slightly, by instead using the schema $\sigma\colon\\{\textnormal{First, BYear}\\}\rightarrow{\bf DT}$, where $\sigma(\textnormal{First})=\textnormal{`Str'}$ and $\sigma(\textnormal{BYear})=`{\mathbb{Z}}$’, and now taking $X=\Delta^{\sigma}$. The only difference is that we have labeled our columns by more specific attribute names. We write $\tau(X)\colon\mathcal{K}(X)\rightarrow\mathcal{U}_{X}(X)$ as the table $\tau(X)=\begin{tabular}[]{|l||l|l|}\hline\cr$\mathcal{K}(X)$&First&BYear\\\ \hline\cr\hline\cr 4&Barack&1961\\\ \hline\cr cc&Michelle&1964\\\ \hline\cr 10&Michelle&1964\\\ \hline\cr\end{tabular}$ We write $\tau(\bullet^{\textnormal{First}})$ and $\tau(\bullet^{\textnormal{BYear}})$ as the tables $\tau(\bullet^{\textnormal{First}})=\begin{tabular}[]{|l||l|}\hline\cr$\mathcal{K}(\bullet^{\textnormal{First}})$&First\\\ \hline\cr\hline\cr 1&Barack\\\ \hline\cr 2&Michelle\\\ \hline\cr\end{tabular}\hskip 36.135pt\tau(\bullet^{\textnormal{BYear}})=\begin{tabular}[]{|l||l|}\hline\cr$\mathcal{K}(\bullet^{\textnormal{BYear}})$&BYear\\\ \hline\cr\hline\cr x&1961\\\ \hline\cr y&1946\\\ \hline\cr z&1964\\\ \hline\cr\end{tabular}$ We can consider the restriction maps $\mathcal{K}(X)\rightarrow\mathcal{K}(\bullet^{\textnormal{First}})$ and $\mathcal{K}(X)\rightarrow\mathcal{K}(\bullet^{\textnormal{BYear}})$ as foreign keys attached to the $\tau(X)$ table. The way things are set up, this foreign key information is kept in the restriction maps of the sheaf $\mathcal{K}$. See Example 4.2.5. ###### Definition 4.3.7. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification, let $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})$ and $\mathcal{Y}=(Y,\mathcal{K}_{Y},\tau_{Y})$ denote databases of type $\pi$, and let $\mathcal{U}_{X}$ and $\mathcal{U}_{Y}$ denote the universal sheaf on $X$ and $Y$ (see Definition 4.3.2). A morphism of databases, denoted $(f,f^{\sharp})\colon\mathcal{X}\rightarrow\mathcal{Y},$ consists of a map $f\colon Y\rightarrow X$ of schema (see Definition 4.1.2) and a morphism of sheaves $f^{\sharp}\colon f^{*}\mathcal{K}_{X}\rightarrow\mathcal{K}_{Y}$ on $Y$ such that the diagram of sheaves (18) commutes. The category of simplicial databases on $\pi$, whose objects are simplicial databases as defined in Definition 4.3.3 and whose morphisms have just been defined, is denoted ${\bf DB}^{\pi}$, or simply ${\bf DB}$ if $\pi$ is understood. Fixing a schema $X$, the category of databases on $X$, denoted ${\bf DB}_{X}$, is the category whose objects are databases with schema $X$ and whose morphisms are identity on $X$. ###### Remark 4.3.8. A database is roughly a bunch of tables glued together by foreign key mappings. A morphism of databases is a way to coherently assign to each table in one database, a table in another database, and a morphism between the two tables. Recall that a morphism of tables is a “data-preserving map” (see Definition 2.3.8, Example 2.3.9, and Remark 2.3.10). Thus, a morphism of databases should be thought of as a coherent system of data-preserving maps. We might make the following definition. A morphism without integrity is a pair $(f,f^{\sharp})\colon\mathcal{X}\rightarrow\mathcal{Y}$ as above, but without the requirement that diagram (18) commute. ###### Remark 4.3.9. Let $Y$ be a schema and let $\mathcal{U}_{Y}$ denote the universal database on $Y$. One can identify ${\bf DB}_{Y}$ with the category ${\bf Shv}(Y)_{/\mathcal{U}_{Y}}$ of sheaves over $\mathcal{U}_{Y}$. Explicitly, this is the category whose objects are arrows $\mathcal{K}\rightarrow\mathcal{U}_{Y}$ and whose morphisms are commutative triangles. ### 4.4. Relational simplicial databases In this subsection, we present a category of relational databases as a full subcategory of the category ${\bf DB}$ of simplicial databases. We also give an adjunction which allows one to convert a database in our sense to a relational database in a functorial way. ###### Definition 4.4.1. Let $\pi$ denote a type specification. A simplicial database $\mathcal{X}=(X,\mathcal{K},\tau)$ on $\pi$ is called relational if $\tau\colon\mathcal{K}\rightarrow\mathcal{U}_{X}$ is a monomorphism of sheaves. The category of relational simplicial databases, denoted ${\bf\mathcal{R}el}^{\pi}$ is the full subcategory of ${\bf DB}^{\pi}$ spanned by the relational simplicial databases. Note the precise similarity of this definition with Definition 2.5.1: the schema $X$ is a gluing together of simple schema $\sigma$, the sheaf $\mathcal{U}_{X}$ evaluated on a simplex $\Delta^{\sigma}\subset X$ is $\Gamma(\sigma)$, and a monomorphism of sheaves is a morphism which restricts to an injective function on each simplex. Every function $f\colon A\rightarrow B$ between sets has an image $\textnormal{im}(f)\subset B$ and an injection $f^{m}\colon\textnormal{im}(f)\rightarrow B$; similarly, given a schema $X$, every morphism $f\colon\mathcal{A}\rightarrow\mathcal{B}$ of sheaves of sets on $X$ has an image sheaf denoted $\textnormal{im}(f)\subset\mathcal{B}$ and a monomorphism of sheaves $f^{m}\colon\textnormal{im}(f)\rightarrow\mathcal{B}$. If $\mathcal{X}=(X,\mathcal{K},\tau)$ is a database, we can take the image sheaf $\textnormal{im}(\tau)$ of $\tau\colon\mathcal{K}\rightarrow\mathcal{U}_{X}$, and the database $(X,\textnormal{im}(\tau),\tau^{m})$ will be a relational simplicial database. ###### Lemma 4.4.2. Let $\pi$ denote a type specification. There is an adjunction $\textstyle{{\bf DB}^{\pi}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{{\bf\mathcal{R}el}^{\pi}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$ in which the left adjoint is given by $(X,\mathcal{K},\tau)\mapsto(X,\textnormal{im}(\tau),\tau^{m})$ and the right adjoint is the forgetful functor which realizes a relational simplicial database as a simplicial database. ###### Proof. This is a simple exercise that reduces to the fact that the image functor, which sends the category of sets and functions to the category of sets and injections, is a left adjoint to the forgetful functor. ∎ Since the forgetful functor ${\bf\mathcal{R}el}^{\pi}\rightarrow{\bf DB}^{\pi}$ is fully faithful, the counit of the adjunction in Lemma 4.4.2 is the identity functor on ${\bf\mathcal{R}el}^{\pi}$. Another way to say this is that one does not lose information when considering a relational database as a simplicial database, but one often does lose information when converting a simplicial database to a relational database. Strictly “more information” can be contained in a simplicial database than in a relational database. ### 4.5. Tables vs. simplicial databases In this last subsection we present the functor $F\colon{\bf Tables}\rightarrow{\bf DB}$ which realizes a table as a simplicial database. We will also present the “global table” construction, which roughly takes a database and joins everything together to make one big (unnormalized!) table. ###### Construction 4.5.1. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification and $(K,C,\sigma,\tau)$ a table on $\pi$ (see Definition 2.3.3). Let $X=\Delta^{\sigma}\in{\bf Sch}^{\pi}$ be the associated schema, let $\mathcal{U}_{X}$ denote the universal database on $X$, and let $\mathcal{K}_{X}$ denote the constant sheaf on ${\bf Sub}(X)$ which takes each subschema to the set $K$. Define $\tau_{X}\colon\mathcal{K}_{X}\rightarrow\mathcal{U}_{X}$ in the unique way such that $\tau_{X}(X)\colon\mathcal{K}_{X}(X)\rightarrow\mathcal{U}_{X}(X)$ is the function $\tau\colon K\rightarrow\Gamma(\sigma)$. We are ready to assign $F((K,C,\sigma,\tau))\colon=(X,\mathcal{K}_{X},\tau_{X}).$ Given a map of tables $\varphi\colon(K_{1},C_{1},\sigma_{1},\tau_{1})\rightarrow(K_{2},C_{2},\sigma_{2},\tau_{2})$, we will now show that there is a canonical map of simplicial databases $(X_{1},\mathcal{K}_{1},\tau_{1})\rightarrow(X_{2},\mathcal{K}_{2},\tau_{2})$. Recall from Definition 2.3.8 that $\varphi=(g,f)$ where $g\colon K_{1}\rightarrow K_{2}$ is a function and $f\colon\sigma_{2}\rightarrow\sigma_{1}$ is a morphism of simple schema such that Diagram (5), rewritten for the readers convenience here: $\textstyle{K_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{1}}$$\scriptstyle{g}$$\textstyle{\Gamma(\sigma_{1})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}}$$\textstyle{K_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{2}}$$\textstyle{\Gamma(\sigma_{2}),}$ commutes. The morphism $f\colon\sigma_{2}\rightarrow\sigma_{1}$ of simple schema induces a morphism $\Delta^{\sigma_{2}}\rightarrow\Delta^{\sigma_{1}}$ of schema, i.e. a map $f\colon X_{2}\rightarrow X_{1}$. The sheaf $f^{*}\mathcal{K}_{1}$ on $X_{2}$ is the constant sheaf with value $K_{1}$, so $g$ gives a map $f^{\sharp}\colon f^{*}\mathcal{K}_{1}\rightarrow\mathcal{K}_{2}$. We will skip some details, but one can easily show that the commutativity of the Diagram (18) is equivalent to the commutativity of Diagram (5), completing the construction. We can also extract a single table from a simplicial database, by looking at its global sections. This requires a functor called $f_{+}$ defined in Section 5.1. We include the construction here, rather than later, in order to keep like topics together, and conclude nicely with Remark 4.5.3. ###### Construction 4.5.2. Let $\mathcal{X}=(X,\mathcal{K},\tau)$ denote a simplicial database. Recall from Remark 4.1.4 that there is an induced classification map $s\colon X_{0}\rightarrow{\bf DT}$. Assuming that $X$ has finitely many vertices, we can construct a table whose simple schema is $s$. To do so, we need only note that there is a unique map of schema $f\colon X\rightarrow\Delta^{s}$. Indeed, given any simplex in $X$, its set of vertices classifies a unique simplex in $\Delta^{s}$; this defines $f$. If we write $K=\mathcal{K}(X)=f_{+}\mathcal{K}(\Delta^{s})$ and $t=f_{+}\tau_{X}(\Delta^{s})\colon K\rightarrow\Gamma(s)$, then we are ready to construct the table $(K,X_{0},s,t)\in{\bf Tables}.$ Its columns are given by the vertices $X_{0}$ of $X$; its rows are difficult to describe in general, but in specific cases are quite sensible. ###### Remark 4.5.3. It is not hard to show that the two above constructions establish an adjunction $\textstyle{{\bf Tables}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{{\bf DB}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$ Given a database $\mathcal{X}$, the table obtained by the right adjoint will be called the global table on $\mathcal{X}$. ## 5\. Constructions and formal properties of Simplicial Databases The point of the formalism in Section 4 is to find a language in which to describe databases such that the typical operations performed when working with databases are sensible in the language. In other words, queries of databases should make sense as categorical constructions, as they did in Section 3 for tables. ### 5.1. Changing the schema Let us begin with some ways that one can import data from one schema into another. In Lemma 4.2.8 we discussed the adjunction (21) induced by a map of schema $f\colon Y\rightarrow X$. Given a database $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})$ on $X$ there is an induced database $(Y,f^{*}\mathcal{K}_{X},\mathcal{U}_{f}\circ(f^{*}\tau_{X}))$, denoted $f^{*}\mathcal{X}$; see Definition 4.3.2 and refer to the diagram $\textstyle{f^{*}\mathcal{K}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}\tau_{X}}$$\textstyle{f^{*}\mathcal{U}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\mathcal{U}_{f}}$$\textstyle{\mathcal{U}_{Y}.}$ A slightly more complicated construction creates a database on $X$ from a database $\mathcal{Y}=(Y,\mathcal{K}_{Y},\tau_{Y})$ on $Y$ and a map of schema $f\colon Y\rightarrow X$. By the adjunction (21), we have the diagram (26) but since there is no canonical map $f_{*}\mathcal{K}_{Y}\rightarrow\mathcal{U}_{X}$, we have not yet constructed a database on $X$. To do so, let $f_{+}(\mathcal{K}_{Y})$ denote the limit of Diagram (26). This sheaf comes with a canonical map to $\mathcal{U}_{X}$, which we denote $f_{+}\tau_{Y}\colon f_{+}\mathcal{K}_{Y}\rightarrow\mathcal{U}_{X}$. The triple $(X,f_{+}\mathcal{K}_{Y},f_{+}\tau_{Y})$ is a database on $X$, which we denote $f_{+}\mathcal{Y}$. ###### Proposition 5.1.1. Let $\pi$ denote a type specification, and let $f\colon Y\rightarrow X$ be a morphism of schema of type $\pi$. The functors $f^{*}$ and $f_{+}$ define an adjunction $\textstyle{{\bf DB}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}}$$\textstyle{{\bf DB}_{Y}.\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f_{+}}$ ###### Proof. Let $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})$ and $\mathcal{Y}=(Y,\mathcal{K}_{Y},\tau_{Y})$ be databases. Giving a morphism $f^{*}\mathcal{X}\rightarrow\mathcal{Y}$ of databases over $Y$ amounts to a giving a map $\alpha$ of sheaves making the diagram $\textstyle{f^{*}\mathcal{K}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f^{*}\tau_{X}}$$\scriptstyle{\alpha}$$\textstyle{f^{*}\mathcal{U}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\mathcal{U}_{f}}$$\textstyle{\mathcal{K}_{Y}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{Y}}$$\textstyle{\mathcal{U}_{Y}}$ commute. By the adjunction (21) this diagram is equivalent to the diagram $\textstyle{\mathcal{K}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\tau_{X}}$$\scriptstyle{\alpha}$$\textstyle{\mathcal{U}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\mathcal{U}_{f}}$$\textstyle{f_{*}\mathcal{K}_{Y}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{f_{*}\tau_{Y}}$$\textstyle{f_{*}\mathcal{U}_{Y},}$ by Lemma 4.2.8. Supplying a morphism $\alpha$ making this diagram commute is equivalent to supplying a morphism $\mathcal{K}_{X}\rightarrow f_{+}\mathcal{K}_{Y}$ over $\mathcal{U}_{X}$, because $f_{+}\mathcal{K}_{Y}$ is the limit of Diagram 26. The proof now follows from Remark 4.3.9. ∎ ###### Definition 5.1.2. Let $\pi$ denote a type specification, and let $f\colon Y\rightarrow X$ be a morphism of schema of type $\pi$. The functor $f^{*}\colon{\bf DB}_{X}\rightarrow{\bf DB}_{Y}$, defined above, is called the pullback functor, and the functor $f_{+}\colon{\bf DB}_{Y}\rightarrow{\bf DB}_{X}$, defined above, is called the push-forward functor. Given a sheaf of sets $\mathcal{K}_{X}$ on $X$, we also refer to $f^{*}\mathcal{K}_{X}\in{\bf Shv}(Y)$ as the pullback of $\mathcal{K}_{X}$, and given a sheaf of sets $\mathcal{K}_{Y}$ on $Y$, we also refer to $f_{+}\mathcal{K}_{Y}\in{\bf Shv}(X)$ as the push-forward of $\mathcal{K}_{Y}$. ###### Example 5.1.3. Let $X$ and $Y$ be the schema $X\colon=\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 11.36163pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&\crcr}}}\ignorespaces{\hbox{\kern-11.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{~{}^{`{\bf Str}\textnormal{'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 35.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{\bullet^{`{\mathbb{Z}}\textnormal{'}},}$}}}}}}}\ignorespaces}}}}\ignorespaces\hskip 36.135ptY\colon=\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 11.36163pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&\crcr}}}\ignorespaces{\hbox{\kern-11.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{~{}^{`{\bf Str}\textnormal{'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 35.36163pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{\bullet^{`{\bf Str}\textnormal{'}},}$}}}}}}}\ignorespaces}}}}\ignorespaces$ and let $f\colon Y\rightarrow X$ be the unique morphism of schema between them. By Remark 4.3.9, a database on $X$ is given by a morphism of sheaves $\tau_{X}\colon\mathcal{K}_{X}\rightarrow\mathcal{U}_{X}$, for some sheaf of sets $\mathcal{K}_{X}$. We roughly think of it as a table of strings and integers, with some values not filled in. (In fact, $\tau_{X}$ has more information because, for example, two keys in $\mathcal{K}(X)$ might be sent to the same key in $\mathcal{K}(\bullet^{`{\bf Str}\textnormal{'}})$). The pullback database $f^{*}\tau_{X}\colon f^{*}\mathcal{K}_{X}\rightarrow\mathcal{U}_{Y}$ is degenerate in the sense that every row has the same string repeated in two columns. In some sense, this is to be expected. Now suppose that $\tau_{Y}\colon\mathcal{K}_{Y}\rightarrow\mathcal{U}_{Y}$ is a database on $Y$. We roughly think of it as a table whose rows are pairs of strings. The push-forward $f_{+}\tau_{Y}$ consists of three tables: one has two columns (strings and integers) and the other two just have one column. The one column table of integers $f_{+}\tau_{Y}(\bullet^{`{\mathbb{Z}}\textnormal{'}})$ is empty. The one column table of strings $f_{+}\tau_{Y}(\bullet^{`{\bf Str}\textnormal{'}})$ consists of those strings $S$ for which there is a row in $\tau_{Y}(Y)$ consisting of a repeated string $(S,S)$. Finally, the two column table $f_{+}\tau_{Y}(X)$ consists of an element $(S,n)$ for every row $S$ in the one-column table of strings and every integer $n\in{\mathbb{Z}}$. One sees that by this example that if $f\colon Y\rightarrow X$ is not surjective, then the pushforward functor $f_{+}$ results in huge tables. It is not meant to be implemented as a hash table but as a theoretical construct. Given a map of schemas $f\colon Y\rightarrow X$, there is one more important way to send a database on $X$ to a database on $Y$, but only if $f$ is a monomorphism of schema. A monomorphism of schema corresponds to the relationship often known as “is a”, in which every object of type $x$ “is an” object of type $y$. In this situation, there is a functor which takes as input a database of $y$’s, and produces as output a database of $x$’s with all of the $y$-information filled in, but nothing else. The functor that accomplishes this task is denoted $f_{!}\colon{\bf DB}_{Y}\rightarrow{\bf DB}_{X}$ and is called “extension by $\emptyset$,” meaning that on every simplex in $X$ that is not in $f(Y)$, the value of the sheaf there is an empty table. To define $f_{!}$ rigorously, we first notice that $f^{*}\colon{\bf Shv}(X)\rightarrow{\bf Shv}(Y)$ not only has a right adjoint ($f_{*}$), but a left adjoint as well, which we also denote $f_{!}\colon{\bf Shv}(Y)\rightarrow{\bf Shv}(X)$. If $f$ is a monomorphism, then every subschema $Y^{\prime}\subset Y$ is sent to a subschema $f(Y^{\prime})\subset X$. Let us define $f_{!}\mathcal{U}_{Y}$ and its canonical map to $\mathcal{U}_{X}$. Every subschema $X^{\prime}\subset X$ is either of the form $X^{\prime}=f(Y^{\prime})$ or not. If so, we set $f_{!}\mathcal{U}_{Y}(X^{\prime})=\mathcal{U}_{Y}(Y^{\prime})=\mathcal{U}_{X}(X^{\prime})$. If not, we set $f_{!}\mathcal{U}_{Y}(X^{\prime})=\emptyset$. There is a canonical map $a_{f}\colon f_{!}\mathcal{U}_{Y}\rightarrow\mathcal{U}_{X}$ which is the identity map on $X^{\prime}=f(Y^{\prime})$ and which is $\emptyset\rightarrow\mathcal{U}_{X}(X^{\prime})$ when $X^{\prime}\not\in\textnormal{im}(f)$. Now that we have a canonical map $a_{f}\colon f_{!}\mathcal{U}_{Y}\rightarrow\mathcal{U}_{X}$ in the case that $f\colon Y\rightarrow X$ is an inclusion, we can define $f_{!}\colon{\bf DB}_{Y}\rightarrow{\bf DB}_{X}$ to be given by $f_{!}(Y,\mathcal{K}_{Y},\tau_{Y})\colon=(X,f_{!}\mathcal{K}_{Y},a_{f}\circ\tau_{Y}).$ The functor $f_{!}$ is left adjoint to the functor $f^{*}\colon{\bf DB}_{X}\rightarrow{\bf DB}_{Y}$ (but $f_{!}$ is defined only when $f\colon Y\rightarrow X$ is an injection.) ### 5.2. Nulls Nulls do not conform with the mathematical logic that underlies the strict theoretical foundation of relational databases. They are easy enough to deal with, however, by use of foreign keys. That is, for each column $c\in C$ of a schema $\sigma\colon C\rightarrow{\bf DT}$ for which a table may contain a null, one creates a new schema $\sigma^{\prime}$ on columns $C^{\prime}=C-\\{c\\}$. By an easy use of foreign keys, one considers objects classified by $\sigma$ to be also classified by $\sigma^{\prime}$. This is a way to get around the problem of nulls. Other approaches can be found in [JR03]. The same technique is done (automatically) in simplicial databases. Over a simplex $\Delta^{\sigma}$, one puts objects for which the value on each column is known. If the value on some set of columns is unknown for a certain object, it is represented as a record on the subsimplex for which it is total. If one so desired, he or she could implement simplicial databases so that local sections of the database (records over subschema) appeared as global sections of the database (records over the whole schema) by putting the value “Null” in appropriate places. From our perspective it is preferable just to leave local data as local data and not try to promote it to global data, at least for theoretical purposes. ### 5.3. Duplicate records SQL allows for a table to have the same record in two different rows. Therefore, tables are not relations and SQL does not strictly implement relational databases. One could argue that SQL is “wrong” in not conforming to the theory (see [Dat05, p. 14]), but perhaps the pure relational theory is overly strict; this is the position we take. Simplicial database allow for duplicate entries. This should not be threatening because internal keys ensure the integrity of the data. If $\Gamma=A\times B\times C$, then relations on this simple schema are subsets $K\subset\Gamma$. In the theory of simplicial databases, we allow non- injective functions $\tau\colon K\rightarrow\Gamma$, called tables. Philosophically, we see the relational model as “confusing the object with its attributes.” A schema, or set of attributes, gives a set of ways to measure a collection of objects. It is entirely possible that two objects in that collection could have the same measurements according to the schema. In the relational model, these two objects would be identified in the sense that only one row of the table would be representing both. From now on, the database and its users will have no choice but to consider these objects to be the same. The only alternative to this is to introduce arbitrary identifiers. These artificial keys are not part of the data being measured about the objects. In our view, it is best to keep these arbitrary identifiers “internal” to the database management system. Among several advantages, the most obvious is database integration, in which it is important to know what aspects of the data are “measured” and invariant, and what aspects are contrived. We will say more about this in Section 6.5.3. ### 5.4. Limits and colimits of databases We will see shortly that limits and colimits taken in the category of simplicial databases have meaning in terms of the general theory of databases, such as joins and unions. ###### Theorem 5.4.1. Let $\pi\colon U\rightarrow{\bf DT}$ denote a type specification. The category ${\bf DB}^{\pi}$ of databases of type $\pi$ is closed under taking small colimits and small limits. ###### Proof. Let $I$ denote a small category and let $\mathcal{X}\colon I\rightarrow{\bf DB}$ denote an $I$-shaped diagram in ${\bf DB}={\bf DB}^{\pi}$. There is a functor ${\bf DB}\rightarrow{\bf Sch}^{\textnormal{op}}$ taking a database $(A,\mathcal{K}_{A},\tau_{A})$ to its underlying schema $A$, and composing this functor with $\mathcal{X}$ gives a functor which we denote $X\colon I\rightarrow{\bf Sch}^{\textnormal{op}}$. For an object $i\in I$, we denote the database $\mathcal{X}(i)$ by $\mathcal{X}_{i}$ and write $\mathcal{X}_{i}=(X_{i},\mathcal{K}_{i},\tau_{i}).$ To define the colimit (respectively limit) of the diagram $\mathcal{X}$, we must first specify its schema. Since ${\bf Sch}={\bf Pre}(\mathcal{S})$, where $\mathcal{S}$ is the category of simple schema (see Definition 2.2.6), it is closed under colimits and limits ([MLM94, p. 22]); hence so is ${\bf Sch}^{\textnormal{op}}$. Let $C=\mathop{\textnormal{colim}}(X)$ (resp. $L=\lim(X)$) denote the colimit (resp. limit) of the diagram $X\colon I\rightarrow{\bf Sch}^{\textnormal{op}}$. Let $\mathcal{U}_{C}$ and $\mathcal{U}_{L}$ denote the universal databases on $C$ and $L$, respectively. As a colimit in ${\bf Sch}^{\textnormal{op}}$, the schema $C$ comes equipped with morphisms in $c_{i}\colon C\rightarrow X_{i}$ in ${\bf Sch}$, for each $i\in I$, making the appropriate diagrams commute. There is a pullback sheaf $c_{i}^{*}\tau\colon c_{i}^{*}\mathcal{K}_{i}\rightarrow\mathcal{U}_{C}$. If $f\colon i\rightarrow j$ is a morphism in $I$, then the map $X_{j}\rightarrow X_{i}$ in ${\bf Sch}$ induces a morphism $c_{i}^{*}\mathcal{K}_{i}\rightarrow c_{j}^{*}\mathcal{K}_{j}$ of pullback sheaves over $\mathcal{U}_{C}$ on $C$. Let $c^{*}\colon I\rightarrow{\bf Shv}(C)_{/\mathcal{U}_{C}}$ denote the $I$-shaped diagram of these pullback sheaves over $\mathcal{U}_{C}$. Define $\tau_{C}\colon\mathcal{K}_{C}\rightarrow\mathcal{U}_{C}$ to be the colimit of this diagram. Then the database $\mathcal{C}=(C,\mathcal{K}_{C},\tau_{C})$ is our candidate for the colimit of the diagram $\mathcal{X}$. It is a matter of tracing through the construction to show that $\mathcal{C}$ has the necessary universal property. Defining the limit of $\mathcal{X}$ is similar. As a limit in ${\bf Sch}^{\textnormal{op}}$, the schema $L$ comes equipped with morphisms $\ell_{i}\colon X_{i}\rightarrow L$ in ${\bf Sch}$, for each $i\in I$, making the appropriate diagrams commute. There is a push-forward sheaf $(\ell_{i})_{+}\mathcal{K}_{i}$ on $L$, which comes equipped with a map $(\ell_{i})_{+}\tau\colon(\ell_{i})_{+}\mathcal{K}_{i}\rightarrow\mathcal{U}_{L}$. If $f\colon i\rightarrow j$ is a morphism in $I$, then the map $X_{j}\rightarrow X_{i}$ in ${\bf Sch}$ induces a morphism $(\ell_{i})_{+}\mathcal{K}_{i}\rightarrow(\ell_{j})_{+}\mathcal{K}_{j}$ of push-forward sheaves over $\mathcal{U}_{L}$ on $L$. Let $(\ell_{+})\colon I\rightarrow{\bf Shv}(L)_{/\mathcal{U}_{L}}$ denote the $I$-shaped diagram of these push-forward sheaves over $\mathcal{U}_{L}$. Define $\tau_{L}\colon\mathcal{K}_{L}\rightarrow\mathcal{U}_{L}$ to be the limit of this diagram. Then the database $\mathcal{L}=(L,\mathcal{K}_{L},\tau_{L})$ is our candidate for the limit of the diagram $\mathcal{X}$. Again, it is a matter of tracing through the construction to show that $\mathcal{L}$ has the necessary universal property. This completes the proof. ∎ ###### Remark 5.4.2. The final object in the category ${\bf DB}^{\pi}$ of databases on $\pi\colon U\rightarrow{\bf DT}$ is the empty database (with empty schema and trivial sheaf). The initial object $(X,\mathcal{K},\tau)$ in ${\bf DB}^{\pi}$ has, as its schema $X$, a single $n$-simplex for every map $\sigma\colon\\{0,1,\ldots,n\\}\rightarrow{\bf DT}$; the sheaf is $\mathcal{K}=\mathcal{U}_{X}$, and the map $\tau\colon\mathcal{U}_{X}\rightarrow\mathcal{U}_{X}$ is the identity. If one knows the $\check{\textnormal{C}}$ech nerve construction, one can realize the initial object in those terms, by applying the $\check{\textnormal{C}}$ech nerve functor to $\pi\colon U\rightarrow{\bf DT}$. See [Spi08, 3.1] for details. ###### Corollary 5.4.3. Let $X\in{\bf Sch}$ be a schema and let ${\bf DB}_{X}$ denote the category of databases with schema $X$ and with morphisms which restrict to the identity on $X$. Colimits and limits exist in ${\bf DB}_{X}$; in particular ${\bf DB}_{X}$ has an initial object and a final object. ###### Proof. Given a non-empty diagram which restricts to the identity on a certain schema $X$, one sees by the construction of limits and colimits in the proof of Theorem 5.4.1 that the limit and the colimit of that diagram will also have schema $X$. The limit (respectively the colimit) of the empty diagram in ${\bf DB}_{X}$, if it exists, is the final (resp. initial) object in ${\bf DB}_{X}$; we must show it does exist. One immediately sees that the final object is $(X,\mathcal{U}_{X},\textnormal{id}_{\mathcal{U}_{X}})$, and the initial object is $(X,\emptyset,\emptyset\rightarrow\mathcal{U}_{X})$, where $\emptyset$ here denotes the sheaf on $X$ whose value is constantly the empty set, and where $\emptyset\rightarrow\mathcal{U}_{X}$ is the unique morphism of sheaves. ∎ ### 5.5. Projections This query is built into the theory of simplicial databases. Given a database $(X,\mathcal{K},\tau)$ and a subschema $X^{\prime}\subset X$, we have the database $(X^{\prime},\mathcal{K}|_{X^{\prime}}\tau|_{X^{\prime}})$ given by restricting the sheaf $\mathcal{K}$ and the map of sheaves $\tau\colon\mathcal{K}\rightarrow\mathcal{U}$ to the subschema $X^{\prime}$. One can view it as a table using Construction 4.5.2. ### 5.6. Unions and insertions Given two databases with the same schema, one can apply the UNION query. To do so, one keeps the same columns but takes the union of the rows. An insertion is a special kind of union; namely it is a union of two databases on the same schema, where one of the databases consists only of a single row. We have a few more options in simplicial databases than one does in relational databases; these differences are analogous to the difference between the UNION query and the UNION ALL query in SQL. That is, since we allow duplicate entries (see Section 5.3), the user can decide when an object in one database is the same as an object with the same attributes stored in another database and when it is different. Let us make all of this precise. We can represent unions, insertions, and more by taking colimits of various diagrams of databases. Let $\mathcal{X}=(X,\mathcal{K},\tau)$ denote a simplicial database, and let $\mathcal{X}^{\prime}=(X,\mathcal{K}^{\prime},\tau^{\prime})$ be a database with the same schema, $X$. Both receive a map from the initial database on $X$, and the coproduct will be $(X,\mathcal{K}\amalg\mathcal{K}^{\prime},\tau\amalg\tau^{\prime})$ as desired. (See the proof of Theorem 5.4.1 for details on the colimit construction.) The above construction gives a UNION ALL query: duplicated tuples will remain distinct. There are two ways of having that not be the case. The first is to simply eliminate the duplicates by converting the database to a relational database; see Lemma 4.4.2. However, this may result in information loss if there really were two entities with the same attributes, because these duplicates will be eliminated. The other way can occur if the user has more information about which instances in the first database correspond to instances in the second database. This can be accomplished by having a third database $\mathcal{X}^{\prime\prime}=(X,\mathcal{K}^{\prime\prime},\tau^{\prime\prime})$ and maps from it to $\mathcal{X}$ and $\mathcal{X}^{\prime}$. The colimit of this diagram, $(X,\mathcal{K}\amalg_{\mathcal{K}^{\prime\prime}}\mathcal{K}^{\prime},\tau\amalg_{\tau^{\prime\prime}}\tau^{\prime})$, will be the union of the records in $\mathcal{X}$ with those in $\mathcal{X}^{\prime}$, and will identify two records if they agree in $\mathcal{X}^{\prime\prime}$. As mentioned above, inserting a row is a special case of taking the union of databases. We can take much more general colimits than those mentioned above, all of which were constant in the schema. These constructions appear to be new; perhaps they can provide useful ways to analyze and assemble data. ### 5.7. Join Two databases can be joined together by specifying a common sub-schema of each and “gluing together” along that sub-schema. If no common sub-schema is mentioned we take the initial schema, which is empty, and join along that; the result is called the natural join. The concept of gluing is rigorously formulated as taking limits of certain diagrams in ${\bf Sch}^{\textnormal{op}}$; thus the point we are making is that joining databases in the usual sense can be accomplished by taking limits in the category of simplicial databases. Let us make all of this precise. Recall from Theorem 5.4.1 that the limit of the diagram of databases $(X_{1},\mathcal{K}_{1},\tau_{1})\longrightarrow(X,\mathcal{K},\tau)\longleftarrow(X_{2},\mathcal{K}_{2},\tau_{2})$ has schema $X^{\prime}=X_{1}\amalg_{X}X_{2}$. This induces a diagram $\textstyle{X\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{X_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{X_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{X^{\prime}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\ulcorner}$ in ${\bf Sch}$. We can thus push-forward $\mathcal{K}_{1}$, $\mathcal{K}$, and $\mathcal{K}_{2}$ to $X^{\prime}$ and get a diagram of push-forward sheaves there (see Definition 5.1.2), all naturally mapping to $\mathcal{U}_{X^{\prime}}$. For typographical reasons, we leave out the fact that these are push-forwards and write the diagram $\mathcal{K}_{1}\rightarrow\mathcal{K}\leftarrow\mathcal{K}_{2}$ over $\mathcal{U}_{X^{\prime}}$. We are ready to write the limit database as $(X_{1}\amalg_{X}X_{2},\mathcal{K}_{1}\times_{\mathcal{K}}\mathcal{K}_{2},\tau^{\prime}),$ where $\tau^{\prime}\colon\mathcal{K}_{1}\times_{\mathcal{K}}\mathcal{K}_{2}\rightarrow\mathcal{U}_{X^{\prime}}$ is the structure map. ###### Example 5.7.1. Suppose we have the two schemas pictured here: $X_{1}\colon=\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 12.89386pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&\crcr}}}\ignorespaces{\hbox{\kern-12.89386pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{~{}^{\textnormal{`First'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 36.89386pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{\bullet^{\textnormal{`Last'}}}$}}}}}}}\ignorespaces}}}}\ignorespaces,\hskip 36.135ptX_{2}\colon=\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 16.60385pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&\crcr}}}\ignorespaces{\hbox{\kern-16.60385pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{~{}^{\textnormal{`L.Name'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 40.60385pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 1.0pt\raise 0.0pt\hbox{$\textstyle{\bullet^{\textnormal{`BYear'}},}$}}}}}}}\ignorespaces}}}}\ignorespaces$ and wish to join them together by equating ‘Last’ with ‘L.Name’ (both of which have the same data type, namely ${\bf Str}$). To do so, we use the schema $X=\bullet^{`{\bf Str}^{\prime}}$, which maps to each of $X_{1}$ and $X_{2}$ in an obvious way. Now given any databases $\mathcal{X}_{1}=(X_{1},\mathcal{K}_{1},\tau_{1})$ and $\mathcal{X}_{2}=(X_{2},\mathcal{K}_{2},\tau_{2})$ on $X_{1}$ and $X_{2}$, we can join them by taking the limit of the solid arrow diagram $\textstyle{\mathcal{X}_{1}\times_{\mathcal{X}}\mathcal{X}_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathcal{X}_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathcal{X}_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathcal{X}}$ where $\mathcal{X}=(X,\mathcal{U}_{X},\textnormal{id}_{\mathcal{U}_{X}})$ is the final database on $X$. The schema of the resulting database is ‘First’‘Last’=‘LName’‘BYear’ This does not represent a table with three columns, but two tables, each with two columns, and each projecting to a common 1-column table. However, its global table does have three columns (see Remark 4.5.3). Its records are those triples of the form (First,Last,BYear) for which there is a (First,Last) pair in $\mathcal{X}_{1}$ and a (Last,BYear) pair in $\mathcal{X}_{2}$ with matching values of Last. This is indeed their join. ###### Remark 5.7.2. The “join” we are working with here could be thought of as a combination of equi-join and outer join. Because databases are sheaves on a schema, they do not have just one table but a system of tables, and the idea of nulls is built into the theory (see Section 5.2). More precisely, if $\mathcal{X}_{1}\rightarrow\mathcal{X}\leftarrow\mathcal{X}_{2}$ is a diagram of databases, the limit $\mathcal{X}^{\prime}$ represents the join of $\mathcal{X}_{1}$ and $\mathcal{X}_{2}$ along a shared set of columns (those of $\mathcal{X}$). Its schema is roughly the union of the schemas of $\mathcal{X}_{1}$ and $\mathcal{X}_{2}$. Its global table will be the equi- join of the global tables for $\mathcal{X}_{1}$ and $\mathcal{X}_{2}$. The point of this remark, however, is that the new table $\mathcal{X}^{\prime}$ does not only contain global information, but local information as well. Much of the data of $\mathcal{X}_{1}$ (respectively $\mathcal{X}_{2}$) is preserved upon passage to $\mathcal{X}^{\prime}$, and that which cannot be extended to global data could still be viewed globally if one uses Null values. It is in this sense that colimits in ${\bf DB}$ are related to outer joins. When joining databases together, one first chooses a set $C$ of columns to equate. When two distinct objects have the same $C$-attributes, then the join is “lossy” in the sense that there will be false information in the join. To remedy this, one must be careful to distinguish between objects, even when considered only in terms of $C$. The following example will hopefully make this more clear. ###### Example 5.7.3. Suppose one wants to join the following two tables: $\tau_{1}$ Title LastName 1 Dr. Marx 2 Mr. Marx $\tau_{2}$ FirstName LastName A Karl Marx B Groucho Marx The outcome will be the following table: Title | FirstName | LastName ---|---|--- Dr. | Karl | Marx Dr. | Groucho | Marx Mr. | Karl | Marx Mr. | Groucho | Marx This table has four entries, two of which are “accurate,” in that they describe real instances, and two of which are not. This occurs because the relational database cannot distinguish between the two instances of the last name Marx. Achieving a lossless join is easy, when databases are allowed to have duplicate entries with the same attributes. Consider the table $\tau$ | LastName ---|--- x | Marx y | Marx which accepts maps from both $\tau_{1}$ and $\tau_{2}$ by sending both $1$ and $A$ to $x$, and sending both $2$ and $B$ to $y$ (see Definition 2.3.8). The limit of this diagram is the table Title | FirstName | LastName ---|---|--- Dr. | Karl | Marx Mr. | Groucho | Marx as desired. In the example above, the table $\tau$ has two instances of the same string. This is not superfluous because there are two people named Marx. They are differentiated by their internal keys, but not by their attributes. Keeping distinct objects distinct, even if they have the same attributes is very useful in practice. It not only allows for lossless joins, but it is well- suited for database integration as well. ### 5.8. Select In Example 3.1.9, we selected from a table $\tau$ with columns $C=\\{\textnormal{`First Name', `Last Name', `BYear'}\\}$ all instances for which the value of ‘First Name’ was “Barack.” This was computed as follows. First, we made a table $\tau^{\prime}$ whose column set $C^{\prime}$ consisted of a single element, labeled ‘First Name’, and filled in $\tau^{\prime}$ with a single entry, ‘Barack’. We might call this table the selection table. The SELECT operation was performed by taking the fiber product $\tau\rightarrow\textnormal{id}_{C^{\prime}}\leftarrow\tau^{\prime}$, where $\textnormal{id}_{C^{\prime}}$ denotes the table of all possible values of ‘First Name’. Performing SELECT operations in a general simplicial database has the same flavor, in that it is always computed as a certain kind of fiber product. Denote the database from which we are selecting as $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})$, let $S\subset X$ denote a subschema and $\mathcal{S}=(S,\mathcal{K}_{S},\tau_{S})$ a relational table on $S$, to serve as the selection table. That is, we will be selecting from $X$ all instances that have the designated $S$-attributes. Finally, we let $1_{\mathcal{S}}=(S,\mathcal{U}_{S},\textnormal{id}_{\mathcal{U}_{S}})$ denote the final database on the schema $S$. The fiber product $\mathcal{X}_{\mathcal{S}}$ in the diagram $\textstyle{\mathcal{X}_{\mathcal{S}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\lrcorner}$$\textstyle{\mathcal{S}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathcal{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{1_{\mathcal{S}}}$ is the desired result. ### 5.9. Deletions Deletion can be subtle. If one deletes entries over a subschema, the action must “cascade” up the hierarchy, deleting entries in larger schemas when they refer or point to the deleted entries. To that end, we define the following construction. ###### Definition 5.9.1. Suppose given a schema $X$ and a subsheaf $\mathcal{K}_{1}\subset\mathcal{K}$ on $X$. Let $\overline{\mathcal{K}_{1}}\subset\mathcal{K}$ denote the presheaf on $X$ with $\overline{\mathcal{K}_{1}}(X^{\prime})\colon=\\{r\in\mathcal{K}(X^{\prime})|\exists X^{\prime\prime}\subset X^{\prime},X^{\prime\prime}\neq\emptyset,r_{X^{\prime\prime}}\in\mathcal{K}_{1}(X^{\prime\prime})\\}$ for subschema $X^{\prime}\in{\bf Sub}(X)$. Here $r_{X^{\prime\prime}}$ denotes the image of $r$ under the restriction map $\mathcal{K}(X^{\prime})\rightarrow\mathcal{K}(X^{\prime\prime})$. We call $\overline{\mathcal{K}_{1}}$ the closure of $\mathcal{K}_{1}$ in $\mathcal{K}$. Suppose now we want to delete all entries of a given type from a database. More concretely, suppose $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})$ is a database with schema $X$, that $i\colon S\subset X$ is a subschema, and that $\mathcal{S}=(S,\mathcal{K}_{S},\tau_{S})$ is a relational database of objects of this subtype, all of which we would like to delete from $X$. As explained in Section 5.8, we can select the rows of $\mathcal{X}$ of the type specified by $\mathcal{S}$ by defining $\mathcal{X}_{S}$ to be the limit as in the diagram $\textstyle{\mathcal{X}_{S}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\lrcorner}$$\textstyle{\mathcal{S}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathcal{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{(S,\mathcal{U}_{S},\textnormal{id}_{\mathcal{U}_{S}}).}$ We know that $\mathcal{X}_{\mathcal{S}}$ has schema $X=X\amalg_{S}S$ and we momentarily invent notation and write $\mathcal{X}_{\mathcal{S}}=(X,\mathcal{K}_{\mathcal{S}\subset\mathcal{X}},\tau_{\mathcal{S}\subset\mathcal{X}})$. The map $\mathcal{X}_{\mathcal{S}}\rightarrow\mathcal{X}$ defines an inclusion of sheaves $\mathcal{K}_{\mathcal{S}\subset\mathcal{X}}\subset\mathcal{K}_{X}$ on $X$, and we take its closure $\overline{\mathcal{K}_{\mathcal{S}\subset\mathcal{X}}}\subset\mathcal{K}_{X}$. By construction we can now delete this subsheaf objectwise on ${\bf Sub}(X)$. That is, we define for $X^{\prime}\subset X$ $\mathcal{K}_{\mathcal{X}\backslash\mathcal{S}}(X^{\prime})=\mathcal{K}_{X}(X^{\prime})\backslash\mathcal{K}_{\mathcal{S}\subset\mathcal{X}}(X^{\prime}),$ where $A\backslash B$ denotes the maximal subset of $A$ which contains no elements in $B$. The database $\mathcal{X}^{\prime}\colon=(X,\mathcal{K}_{\mathcal{X}\backslash\mathcal{S}},\tau),$ where $\tau$ is shorthand for $\tau|_{\mathcal{K}_{\mathcal{X}\backslash\mathcal{S}}}\colon\mathcal{K}_{\mathcal{X}\backslash\mathcal{S}}\rightarrow\mathcal{U}_{X}$, is the deletion of $\mathcal{S}$ from $\mathcal{X}$. There is a canonical map $\mathcal{X}^{\prime}\rightarrow\mathcal{X}$ in ${\bf DB}$, and one can show that $\mathcal{X}^{\prime}$ is the final object under $\mathcal{X}$ whose join with $\mathcal{S}$ is empty. ## 6\. Applications, advantages, and further research In this section, we discuss the applications of the category of simplicial databases. First, simplicial databases can be used wherever relational databases are used; though simplicial databases are more general, they are still closed under applying the usual queries. On the other hand, there are many advantages to using simplicial databases as opposed to relational ones. In Section 6.1, we discuss how the geometry of a schema can provide an intuitive picture for the content and layout of a database. As an example of using category theory to reason about databases, we show in Section 6.2 that query equivalences are trivially verified when one phrases them in categorical language. In Section 6.3 we discuss how diagrams of databases can give various users different privileges in terms of accessing and modifying data. In Section 6.4 we address the issue of comparing our categorification of databases to others versions. Finally, in Section 6.5, we discuss further research on the subject and open questions. ### 6.1. Geometric intuition In Section 4.1, we defined the category ${\bf Sch}^{\pi}$ of schemas for a given type specification $\pi$. They are based on geometric objects called simplicial sets. In this section, we show that the geometry of these objects is intuitive and therefore useful in practice. ###### Example 6.1.1. In this example, we consider a simplified situation in which one keeps track of the cities from which airplane flights take off and those at which they land. So suppose we have only one type, ${\bf DT}=\\{\textnormal{`City'}\\}$ and $U$ is the set of cities in the world that have airports. Let $X$ be the schema $\textstyle{~{}^{\textnormal{`City'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\bullet^{\textnormal{`City'}}}$ For our sheaf of keys $\mathcal{K}$, we take $\mathcal{K}(\textnormal{`City'})=U$. Over the 1-simplex $X$ take $\mathcal{K}(X)$ to be the set of pairs $(c_{1},c_{2})$ for which $c_{1}$ is the city of departure and $c_{2}$ is the city of arrival for some flight. Let $\mathcal{X}$ denote this database of flights. Now, joining this database with itself yields a database with schema ‘City’‘City’‘City’ whose global sections are “flights with layover,” i.e. pairs of flights with the destination city of the first flight equal to the departing city of the second flight. Similarly, the database of multi-city trips of a given length $n$ is simply the union (colimit) of $n$ copies of the database of flights $\mathcal{X}$ in this way. Moreover, if we want to use $\mathcal{X}$ to find the set of available round- trips, we simply join the ends of the schema in Diagram 6.1.1 to make a circle ‘City’‘City’ This is not just heuristic; we have literally taken the indicated limit of databases. The result is a new database whose global sections are precisely the pairs of flights which constitute a round-trip. The point is that one can intuit this result by visualizing round-trips as circles, and then applying that vision to the schemas themselves. ###### Example 6.1.2. In 2004, Bearman et al. [BMS04] present data which shows that at a certain high school called “Jefferson High,” there is a statistically small number of sexual couples that later switch partners. That is, if $B_{1}$ and $G_{1}$ are sexual partners and $B_{2}$ and $G_{2}$ are sexual partners, then it rarely happens that later $B_{1}$ mates with $G_{2}$ and $B_{2}$ mates with $G_{1}$. As they say “…we find many cycles of length 4 in the simulated networks, but few in Jefferson…” Suppose then that we take their raw data and put it on the schema $\textstyle{~{}^{\textnormal{`Boyfriend'}}\\!\bullet\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\bullet^{\textnormal{`Girlfriend'}}}$ which we denote $X$. Visually, we represent two boys and two girls who switch partners as follows: (33) (where, say, horizontal lines represent the original partnerships and diagonal lines represent the new partnerships). And indeed, we can take the union of four copies of $X$ along various vertices to obtain a database with the above 4-cycle schema. In other words, there is a way to take raw data over a line segment, representing partnerships, and automatically generate data over the “switch schema,” Diagram (33), just by taking the indicated limit of databases. The global sections of this new “switched partners” database are precisely what is being studied in Bearman’s paper. As in Example 6.1.1, the point is that the shape of the schema is intuitive. Using schemas that are geometrically intuitive may enhance the ability of users to manipulate and make sense out of the raw data. ### 6.2. Query equivalences It is well known that joining tables together is very costly. If one only wishes to consider certain rows or columns of a join, he or she should isolate those rows or columns before performing the join, not after. For that reason, one is taught to “push selects and projects,” i.e. to do these operations first. How does one prove that projecting first and then joining will result in the same database as will joining first and then projecting? The proofs of results like these are generally tedious. In this section, we do not claim any new results. We merely show that these simple query equivalences are obvious when one uses the language of simplicial databases and knows basic category theory. For example, it is a standard category-theoretic fact that, in any category $\mathcal{C}$ with limits, there is a natural isomorphism (34) $\displaystyle(A\times_{B}C)\times_{D}E\cong(C\times_{D}E)\times_{B}A.$ Note that both joins and selects are examples of such limits (see Sections 5.7 and 5.8). The formula (34) in particular applies to the category ${\bf DB}$ of databases and proves that “selecting $E$ from a join of $A$ and $C$ gives the same result as first selecting $E$ from $C$ and then joining the result with $A$. Projecting a database to a subschema is easy to describe in the theory of simplicial databases: one simply restricts the sheaf $\mathcal{K}$ and the map $\tau$ to that subschema (see Section 5.5). The fact that projects commute with joins follows from basic sheaf theory, e.g. that the limit of a diagram of sheaves is the same as the limit of the underlying diagram of presheaves. ### 6.3. Privileges The sheaf-theoretic nature of our conception of databases lends itself nicely to the idea of privileges. It often happens that one wishes to give a particular user the ability to modify certain sections of the database but not others. If $X$ is the schema for a database $\mathcal{X}$, perhaps we wish to give a particular user the ability to modify data on the subschema $i\colon X^{\prime}\subset X$. To accomplish this, note that there is a map of databases $\mathcal{X}=(X,\mathcal{K}_{X},\tau_{X})\longrightarrow(X^{\prime},i^{*}\mathcal{K}_{X},i^{*}\tau_{X})=\mathcal{X}^{\prime}$ We allow the user to see $\mathcal{X}^{\prime}$ as a database and make changes to it (we could also limit the ways in which this user can modify $\mathcal{X}^{\prime}$ – only allow insertions, for example). At any given time, the user only sees the sub-database $\mathcal{X}^{\prime}$. Suppose he or she adds a few lines to the sheaf $i^{*}\mathcal{K}_{X}$ to make it $i^{*}\mathcal{K}_{X}\cup\mathcal{L}$. To update the main database, we take the colimit of the diagram of sheaves --- $\textstyle{i_{!}i^{*}\mathcal{K}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{i_{!}(i^{*}\mathcal{K}_{X}\cup\mathcal{L})}$$\textstyle{\mathcal{K}_{X}}$ and the result will be a new sheaf on $X$ with the appropriate insertions. Deletions are handled in a somewhat different way, but the idea is the same. If the user deletes data from the sheaf $i^{*}\mathcal{K}_{X}$ to obtain the sheaf $i^{*}\mathcal{K}_{X}\backslash\overline{\mathcal{D}}$, then to update the main database may require us to delete entries from larger schemas (see Section 5.9). The updated sheaf on $X$ will be the limit of the diagram $\textstyle{\mathcal{K}_{X}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{i_{+}(i^{*}\mathcal{K}_{X}\backslash\overline{\mathcal{D}})\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{i_{+}i^{*}\mathcal{K}_{X}.}$ Again, we are not claiming that privileges of this type are anything new. We are claiming that they are naturally phrased in this categorical language, thus bringing a new and powerful mathematical tool to bear on the problems of the subject. ### 6.4. Comparison to other categories of databases As mentioned in the introduction, many other categorifications of databases have been presented over the years. One of the nice features of category theory is that one can compare various categories using functors. Given another categorical formulation of databases, we could try to produce a functor from it to ${\bf DB}$ and from ${\bf DB}$ back to it. The way that these functors behave (e.g. if they are adjoint, or if one or the other is fully faithful) will tell us about the relative expressive power of the models, as well as understand how to translate between them. We hope to work on such a comparison in the future. ### 6.5. Further research The category-theoretic and also geometric nature of simplicial databases opens up many directions for future research. We present a few in this subsection that we intend to pursue. Many of these ideas were suggested to us by Paea LePendu. #### 6.5.1. Topological methods First, we would like to consider how we might use methods from algebraic topology to study databases. Recall from Example 4.1.5 that there is a functor ${\bf Sch}\rightarrow{\bf Top}$ called topological realization that allows one to naturally view any schema as a topological space. Furthermore, we already saw in Example 6.1.2 that importing topological ideas can have real world meaning: topological 4-cycles represented pairs of mating couples that switched partners. Another example of the usefulness of topological methods is given by “lifting problems.” Problems of this sort include the famous question “are there three foods, each pair of which taste good when eaten together, but the threesome of which tastes bad when eaten together?” To phrase this in terms of social networks, suppose that for any $n$ people, either this group is said to be a friendship group or it is not. The above lifting problem becomes: “are there three people, each pair of which is a friendship group, but the triple is not?” These types of phenomena can be represented geometrically, so having simplicial sets as schema may be useful for their study. Homotopical methods from algebraic topology may also be useful. When one object “morphs” into another over the course of time (such as a child becoming an adult), it is difficult to know how to treat that object in a database. Homotopy theory is the study of gradual transformation through time, and the author sees some potential for using it to study real-world phenomena. Finally, the geometric nature of our schema may be useful for query optimization. Schemas can be classified according to their geometric structure. It may be that in performing many queries, a database management system learns that some geometric structures are being used more often than others. The patterns which emerge may be only visible when one uses schemas that have this higher dimensional geometric nature. #### 6.5.2. Functional dependencies and normal forms In this paper we have not discussed functional dependencies or normal forms. It is appealing to ask the following question: ###### Question 6.5.1. Let $X\in{\bf Sch}$ denote a schema; it should be thought of as having a shape (again, via the topological realization functor ${\bf Sch}\rightarrow{\bf Top}$), namely a union of tetrahedra. We wonder: 1. (1) Given a set of functional dependencies, is there a natural way to annotate the shape $X$ so that these dependencies are made visual? 2. (2) Given a schema $X$ that has been annotated in this way, can one easily determine whether it is in a certain normal form? 3. (3) If an annotated schema is not in normal form, do the annotations help in finding the normalization? If the answer to these questions is affirmative, we will have more evidence that the geometric nature of our schema is useful for database design and management. We hope to address these questions in the near future. #### 6.5.3. Database integration We believe that having a rigorous definition for morphisms of databases (see Definition 4.3.7) will be of use in the problem of database integration. The morphisms of databases can account for simultaneous changes in schema and in data. It is also easy to allow changes in data types as well, a topic we will address in later work. Also, as mentioned in Remark 4.3.4 and Section 5.3, the use of internal keys should prove immensely valuable. Instead of including an arbitrarily chosen identifier for an object as part of the data for that object, as required in the theory of relational databases, our theory keeps these arbitrary identifiers separate. When attempting to integrate databases, it is imperative that one know which sections of the data are observed and invariant properties of the objects being classified, and which sections of the data are arbitrarily assigned for management reasons. Our theory keeps these sections of the data distinct, by use of a sheaf of keys $\mathcal{K}$ that is not considered part of the data. In future research, we hope to show that database integration is made substantially easier when one works with a rigorous and geometric model like the one we present here. Before we do so, we need to explain how to work with a change in type specifications, which is not hard, and how to deal with constraints in the data. See Section 6.5.5 for our plans in this direction. #### 6.5.4. Ontologies and networks One intuitively knows that there is a connection between databases and ontologies. An ontology is meant for organizing knowledge, a database is meant for organizing information, and there is a strong correlation between the two. In order to make this correlation precise, one must first find precise definitions of ontologies and databases. Further, these definitions should be phrased in the same language so that they can be compared. Category theory was invented for the purposes of comparing different mathematical structures, and as such provides a good setting for this project. Our plan (see [Spi09])) for a categorical definition of communication networks involves annotating the simplices of a simplicial set with databases. That is, each node in a network has access to a database of “what it knows,” and connections between nodes allows communication via a common language and set of shared knowledge. In order to make this precise, we need a precise definition for a category of databases, for which Definition 4.3.7 suffices. #### 6.5.5. More exotic types Throughout this paper, we have fixed a type specification $\pi\colon U\rightarrow{\bf DT}$, where ${\bf DT}$ is a set of data types, and $U$ is the disjoint union of the corresponding domains. This allows for types like strings, characters, dates, integers, etc. It also allows for more general types like “functions from $A$ to $B$” or “probability distributions on a space.” However, as flexible as our type specifications may be, the situation can be generalized considerably by allowing $\pi$ to be a functor between categories, rather than a function between sets. The simplest application is one that is already implicitly used, namely sorting data. The set of strings is in fact an ordered set, and so can be represented as a category (with a morphism from $A$ to $B$ if $B$ is lexicographically larger than $A$). Another application comes from putting constraints in the data, like if we only allow (city, state) pairs for which the city is within the state. By generalizing type specifications to include categories rather than sets, we open up many new possibilities for making sense of data. Causal relationships can be represented, as can processes. In short, morphisms make the theory more dynamic. ## References * [Ber01] Philip A. Bernstein, _Generic model management: A database infrastructure for schema manipulation_ , pp. 1–6, Springer Berlin/Heidelberg, 2001. * [BMS04] P.S. Bearman, J. Moody, and K. Stovel, _Chains of affections: the structure of adolescent romantic and sexual networks_ , American Journal of Sociology 110 (2004), 44–91. * [Bor94a] Francis Borceux, _Handbook of categorical algebra. 1_ , Encyclopedia of Mathematics and its Applications, vol. 50, Cambridge University Press, Cambridge, 1994, Basic category theory. MR MR1291599 (96g:18001a) * [Bor94b] by same author, _Handbook of categorical algebra. 3_ , Encyclopedia of Mathematics and its Applications, vol. 52, Cambridge University Press, Cambridge, 1994, Categories of sheaves. MR MR1315049 (96g:18001c) * [BW90] Michael Barr and Charles Wells, _Category theory for computing science_ , Prentice Hall International Series in Computer Science, Prentice Hall International, New York, 1990. MR MR1094561 (92g:18001) * [Cod70] E.F. Codd, _A relational model of data for large shared data banks_ , Communications of the ACM 13 (1970), 377–387. * [Dat05] C.J. Date, _Database in depth_ , O’Reilly, 2005. * [Dis96] Zinovy Diskin, _Databases as diagram algebras: Specifying queries and views via the graph-based logic of sketches_ , Tech. report, Frame Inform Systems, 1996. * [DK94] Zinovy Diskin and Boris Kadish, _Algebraic graph-oriented=category-theory-based manifesto of categorizing data base theory_ , Tech. report, Frame Inform Systems, 1994. * [EN07] Ramez Elmasri and Shamkant Navathe, _Fundamentals of database systems_ , 5th ed., Pearson; Addison Wesley, San Francisco, 2007. * [Fri08] Greg Friedman, _An elementary illustrated introduction to simplicial sets_ , ePrint available at http://arxiv.org/pdf/0809.4221.pdf, 2008. * [GB92] Joseph A. Goguen and Rod M. Burstall, _Institutions: abstract model theory for specification and programming_ , J. Assoc. Comput. Mach. 39 (1992), no. 1, 95–146. MR MR1147298 (93h:03056) * [GJ99] Paul G. Goerss and John F. Jardine, _Simplicial homotopy theory_ , Progress in Mathematics, vol. 174, Birkhäuser Verlag, Basel, 1999. MR MR1711612 (2001d:55012) * [Gra01] Marco Grandis, _Finite sets and symmetric simplicial sets_ , Theory Appl. Categ. 8 (2001), 244–252 (electronic). MR MR1825431 (2002c:18010) * [Joh02] Peter T. Johnstone, _Sketches of an elephant: a topos theory compendium. Vol. 2_ , Oxford Logic Guides, vol. 44, The Clarendon Press Oxford University Press, Oxford, 2002. MR MR2063092 (2005g:18007) * [JR03] M. Johnson and R. Rosebrugh, _Three approaches to partiality in the sketch data model_ , Electronic Notes in Theoretical Computer Science 78 (2003), 1–18. * [JRW02] Michael Johnson, Robert Rosebrugh, and R. J. Wood, _Entity-relationship-attribute designs and sketches_ , Theory Appl. Categ. 10 (2002), 94–112 (electronic). MR MR1883480 (2002m:18004) * [ML98] Saunders Mac Lane, _Categories for the working mathematician_ , second ed., Graduate Texts in Mathematics, vol. 5, Springer-Verlag, New York, 1998. MR MR1712872 (2001j:18001) * [MLM94] Saunders Mac Lane and Ieke Moerdijk, _Sheaves in geometry and logic_ , Universitext, Springer-Verlag, New York, 1994, A first introduction to topos theory, Corrected reprint of the 1992 edition. MR MR1300636 (96c:03119) * [PS95] Frank Piessens and Eric Steegmans, _Categorical data-specifications_ , Theory Appl. Categ. 1 (1995), No. 8, 156–173 (electronic). MR MR1356700 (97b:18001) * [RW92] Robert Rosebrugh and R. J. Wood, _Relational databases and indexed categories_ , Category theory 1991 (Montreal, PQ, 1991), CMS Conf. Proc., vol. 13, Amer. Math. Soc., Providence, RI, 1992, pp. 391–407. MR MR1192160 (93i:68054) * [Spi08] David Spivak, _Geometric databases_ , Algebraic Topological Methods in Computer Science, application pending, 2008. * [Spi09] by same author, _Geometric networks: A higher-dimensional approach to networks and databases._ , Technical Proposal for ONR grant, available at http://www.uoregon.edu/$\sim$dspivak/technical.pdf, 2009.
arxiv-papers
2009-04-13T21:20:57
2024-09-04T02:49:01.836186
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "David I. Spivak", "submitter": "David Spivak", "url": "https://arxiv.org/abs/0904.2012" }
0904.2047
# $Z^{\prime}$ Boson Mixings with $Z\\!-\\!\gamma$ and Charge Assignments Ying Zhang1, Qing Wang2,3111Corresponding author at: Department of Physics, Tsinghua University, Beijing 100084, P.R.China Email address: wangq@mail.tsinghua.edu.cn (Q.Wang). 1School of Science, Xi’an Jiaotong University, Xi’an, 710049, P.R.China 2Center for High Energy Physics, Tsinghua University, Beijing 100084, P.R.china 3Department of Physics,Tsinghua University,Beijing 100084,P.R.China (May 17, 2009) ###### Abstract Based on the general description for $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixing as derived from the electroweak chiral Lagrangian, we characterize and classify the various new physics models involving the $Z^{\prime}$ boson that have appeared in the literature into five classes: 1. Models with minimal $Z^{\prime}\\!-\\!Z$ mass mixing; 2. Models with minimal $Z^{\prime}\\!-\\!Z$ kinetic mixing; 3\. Models with general $Z^{\prime}\\!-\\!Z$ mixing; 4. Models with $Z^{\prime}\\!-\\!\gamma$ kinetic and $Z^{\prime}\\!-\\!Z$ mixing; and 5. Models with Stueckelberg-type mixing. The corresponding mixing matrices are explicitly evaluated for each of these classes. We constrain and classify the $Z^{\prime}$ boson charges with respect to quark-leptons by anomaly cancellation conditions. PACS numbers: 12.60.Cn; 14.70.Pw; 11.30.Ly; 12.39.Fe ## I Introduction With the running of the LHC at CERN Geneva, a TeV energy era begins and researchers are anxiously expecting a possible new revolution in particle physics. There are various predictions from both the Standard Model (SM) and new physics models. Among these the appearance of possible new underlying interactions beyond conventional strong/weak/electromagnetic gauge interactions is of special interest. From knowledge accumulated in resent years in particle physics, we know that the expected new interactions at least must govern the electroweak symmetry breaking that result in the massive $W^{\pm}$ and $Z^{0}$ bosons and may further be responsible for the origin of masses for ordinary quarks and leptons. Theoreticians have also touted various ambitious alternative sources of these new interactions, such as unifications, supersymmetries, and extra dimensions. With the exception of the well-known scalar-type interactions which suffer unnaturalness, triviality and hierarchy problems, the typical new interaction that avoids the shortcomings of elementary scalar fields is a gauge interaction and minimal such kind of interaction involves an additional so-called $U(1)^{\prime}$ gauge interaction. In most instances this extra $U(1)^{\prime}$ gauge force is a ”relic” of some larger underlying new physics gauge interactions such as those occurring in GUT models, string theories, left-right symmetric models and models deconstructed from extra space dimensions. Alternatively, in some special models, the $U(1)^{\prime}$ gauge force takes on a special role: for example 1) in little Higgs type models, it can partially remove the quadratic divergence from the SM Higgs mass at the one loop levelRizzoARXIV2006 ; 2) in topcolor-assisted technicolor (TC2) models, it ensures top quark condensation while not for the bottom quark Hill ; Lane ; Chiv ; 3) in SUSY models, it can mediate SUSY breakingZ'SUSY ; and 4) in models based on string theory, it mediates particles communicating between the hidden and visible sectors CasselARXIV2009 . This represents but a sampling of new physics models involving additional $U(1)^{\prime}$ factors: a recent review of others can be found in Ref.Langacker . Phenomenologically, we are interested in the possibility of experimentally finding the carrier, an electrically-neutral color singlet spin-one boson $Z^{\prime}$, of this additional gauge force especially at the LHC. As a detection has not been made so far, this boson has to be massive and the corresponding $U(1)^{\prime}$ gauge symmetry must be violated. The more preferred and exciting experimental finding would be that the $Z^{\prime}$ mass is relatively light compared with the other new physics particles, for then it might arise as a first signature of the new physics beyond SM at the LHC. This prospect heightens the need for theoretical studies of such a light $Z^{\prime}$ boson and its interactions with known particles would also be of the special importance in new physics research. Physically, one main effect of the $Z^{\prime}$ boson derives from its mixings with conventional $Z$ boson and $\gamma$ photon; another stems from its gauge couplings to ordinary quarks and leptons, which leads to various charge assignments. There exist a diversity of new physics models involving the $Z^{\prime}$ boson, each model has its own arrangement of $Z^{\prime}-Z-\gamma$ mixings and $Z^{\prime}$ coupling to ordinary quarks and leptons. To compare models, a model independent investigation is needed of these Z’ boson interactions with known particles, particularly in classifying and comparing the role of the Z’ boson within each model. The electroweak chiral Lagrangian (EWCL) method provides such a platform to perform model independent research. In our previous paper Z'our , we have written down the bosonic part up to order $p^{4}$ of the most genral EWCL involving the $Z^{\prime}$ boson222In the Lagrangian, terms involving a neutral Higgs boson that only plays a passive role are also included to help in matching unitarity requirements within the theory. and known particles. This EWCL alos describes the most general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings, and with it we can further classify the various $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings that appear in each model enabling us to compare and discriminate between the different new physics models333It should be emphasized that a $p^{4}$ order EWCL provides some special degrees of freedom for the $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings. For example, all kinetic mixings are from $p^{4}$ order terms in EWCL (see Eq.(II)), as a $p^{2}$ order EWCL only cannot offer the most general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings. . Here the classification categorizes the general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings into several simplifying cases that appear in the new physics models in the literature. The reason in doing this is because the general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings is too complex to be discussed analytically, while we will show that for all simplifying cases presented in this paper, mixings can be diagonalized exactly. This improves on the approximate diagonalization result usually used in the literature and we can exhibit explicitly the relationship between the various simplifying cases. The main purpose of this paper is to present these finding s and moreover to generalize the EWCL given in Ref.Z'our to include the $Z^{\prime}$ boson couplings to ordinary quarks and leptons for the most general charge assignments. In terms of these charges, new physics models involving the $Z^{\prime}$ boson can also be classified. Because most of the experimental searches for the $Z^{\prime}$ boson depend heavily on these charge assignments and on how $Z^{\prime}$ mixes with $Z$ and $\gamma$, we combine a discussions on these two issues in present paper. This paper is organized as follows. In Sec.II, we first give a short review of the bosonic part of the EWCL involving the $Z^{\prime}$ boson and general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings. In Sec.III, we classify the various models involving the $Z^{\prime}$ boson that have appear in the literatures according to their arrangements of the $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings. In Sec.IV, we set up the general $Z^{\prime}$ boson charge assignments to the ordinary quarks and leptons in terms of the anomaly cancellation conditions. Sec.V provides a summary of the paper. ## II The Bosonic part of the EWCL involving the $Z^{\prime}$ boson and $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings As given in Ref.Z'our , the covariant derivative in the EWCL including the $Z^{\prime}$ boson is $\displaystyle D_{\mu}\hat{U}=\partial_{\mu}\hat{U}+igW_{\mu}\hat{U}-i\hat{U}\frac{\tau_{3}}{2}g^{\prime}B_{\mu}-i\hat{U}(\tilde{g}^{\prime}B_{\mu}+g^{\prime\prime}X_{\mu})I\;,$ (1) where the two by two unitary field $\hat{U}$ represents four Goldstone boson degrees of freedom resulting from spontaneous symmetry breaking of $SU(2)_{L}\otimes U(1)_{Y}\otimes U(1)^{\prime}\rightarrow U(1)_{em}$, and $\tilde{g}^{\prime}$ is a Stueckelberg-type coupling constant associated with which is a special kind of $U(1)$. To help in understanding this choice of covariant derivative, we denote $SU(2)_{L}\otimes U(1)_{Y}\otimes U(1)^{\prime}$ group elements as $(e^{i\theta^{a}t^{a}_{L}+i\theta^{\prime}t^{\prime}},e^{i\theta t})$ for which the Hermitian matrices $t^{a}_{L}$ ($\theta^{a}$) with $a=1,2,3$, $t$ ($\theta$) and $t^{\prime}$ ($\theta^{\prime}$) are generators (group parameters) of $SU(2)_{L}$, $U(1)_{Y}$ and an extra $U(1)^{\prime}$ respectively. The electromagnetic $U(1)_{\mathrm{em}}$ group generator has now been generalized from its traditional expression to $t_{\mathrm{em}}\equiv t_{L}^{3}+t+ct^{\prime}$ depending on an additional arbitrary parameter $c$. This generator results in the $U(1)_{\mathrm{em}}$ group element $(e^{i\theta_{\mathrm{em}}(t^{3}_{L}+ct^{\prime})},e^{i\theta_{\mathrm{em}}t})$ and we can label the representative element for the corresponding coset by $(\hat{U},1)$. Group theory tells us that each symmetry breaking generator corresponds to a coset which can be represented by introducing a representative element for each coset. Denoting the representative element by $n$, its transformation rule to $n^{\prime}$ under the action of an arbitrary group element $g$ is then $gn=n^{\prime}h$ where $h$ is an element belonging to the un-broken subgroup. Specifically for the above gauge group, this transformation rule then stipulates that $\displaystyle(e^{i\theta^{a}t_{L}^{a}+i\theta^{\prime}t^{\prime}},~{}e^{i\theta t})(\hat{U},1)\stackrel{{\scriptstyle gn=n^{\prime}h}}{{=====}}(\underbrace{e^{i\theta^{a}t_{L}^{a}+i\theta^{\prime}t^{\prime}}\hat{U}e^{-i\theta(t_{L}^{3}+ct^{\prime})}}_{\hat{U}^{\prime}},~{}1)\underbrace{(e^{i\theta(t_{L}^{3}+ct^{\prime})},~{}e^{i\theta t})}_{U(1)_{\mathrm{em}}}$ (2) which yields the following transformation rule for the Goldstone field $\hat{U}$ under $SU(2)_{L}\otimes U(1)\otimes U(1)^{\prime}$ $\displaystyle\hat{U}^{\prime}=e^{i\theta^{a}t_{L}^{a}+i\theta^{\prime}t^{\prime}}~{}\hat{U}~{}e^{-i\theta(t_{L}^{3}+ct^{\prime})}\;.$ (3) The choice of the Goldstone field in the two dimensional internal space corresponds in taking the generator $t_{L}^{a}=\tau^{a}/2$, $t=t^{\prime}=1$ (Note, according to our arrangement of group elements, $t$ and $t^{\prime}$ act on different spaces, so $t=t^{\prime}=1$ will not cause confusion). With (3) and the standard $SU(2)_{L}\otimes U(1)_{Y}\otimes U(1)^{\prime}$ transformation rule for electroweak gauge fields $W_{\mu},B_{\mu}$ and the extra $U(1)^{\prime}$ gauge field $X_{\mu}$, we derive the action of the covariant derivative on the Goldstone field $\hat{U}$ as: $D_{\mu}\hat{U}=\partial_{\mu}\hat{U}+i(gW_{\mu}+g_{X}X_{\mu})\hat{U}-i\hat{U}(\frac{\tau^{3}}{2}g^{\prime}+cg^{\prime})B_{\mu}$. Further identifying $g_{X}\equiv-g"$ and $cg^{\prime}\equiv\tilde{g}^{\prime}$, we obtain the result given in Eq.(1). With symmetry breaking pattern $SU(2)_{L}\otimes U(1)_{Y}\otimes U(1)^{\prime}\rightarrow U(1)_{em}$, the Higgs mechanism ensures that the Goldstone bosons represented by the $\hat{U}$ field will be eaten out by the electroweak gauge bosons $W^{\pm},Z^{0}$ and $Z^{\prime}$ which then acquire mass. Here $W_{\mu}$, $B_{\mu}$ and $X_{\mu}$ are respectively the gauge fields of $SU(2)_{L}$, $U(1)_{Y}$ and $U(1)^{\prime}$ before mixing. The full bosonic part of the Lagrangian up to order $p^{4}$ is $\displaystyle\mathcal{L}_{Stueck-SU(2)_{L}\otimes U(1)_{Y}\otimes U(1)^{\prime}\rightarrow U(1)_{em}}=\mathcal{L}_{0}+\mathcal{L}_{2}+\mathcal{L}_{4}\;,$ (4) with each term in the Lagrangian defined as $\displaystyle\mathcal{L}_{0}$ $\displaystyle=$ $\displaystyle-V(h)\;,$ (5) $\displaystyle\mathcal{L}_{2}$ $\displaystyle=$ $\displaystyle\frac{1}{2}(\partial_{\mu}h)^{2}-\frac{1}{4}f^{2}\mathrm{tr}[\hat{V}_{\mu}\hat{V}^{\mu}]+\frac{1}{4}\beta_{1}f^{2}\mathrm{tr}[T\hat{V}_{\mu}]\mathrm{tr}[T\hat{V}^{\mu}]+\frac{1}{4}\beta_{2}f^{2}\mathrm{tr}[\hat{V}_{\mu}]\mathrm{tr}[T\hat{V}^{\mu}]$ (6) $\displaystyle+\frac{1}{4}\beta_{3}f^{2}\mathrm{tr}[\hat{V}_{\mu}]\mathrm{tr}[\hat{V}^{\mu}]+\beta_{4}f(\partial^{\mu}h)\mathrm{tr}[\hat{V}_{\mu}]\;,$ $\displaystyle\mathcal{L}_{4}$ $\displaystyle=$ $\displaystyle\mathcal{L}_{K}+\mathcal{L}_{B}+\mathcal{L}_{H}+\mathcal{L}_{A}\;,$ (7) where $T\equiv\hat{U}\tau_{3}\hat{U}^{\dagger}$ and $\hat{V}_{\mu}\equiv(\hat{D}_{\mu}\hat{U})\hat{U}^{\dagger}$. Here the Higgs field $h$ is treated as $p^{0}$ order and $\displaystyle\mathcal{L}_{K}$ $\displaystyle=$ $\displaystyle-\frac{1}{4}B_{\mu\nu}B^{\mu\nu}-\frac{1}{2}\mathrm{tr}[W_{\mu\nu}W^{\mu\nu}]-\frac{1}{4}X_{\mu\nu}X^{\mu\nu}\;$ $\displaystyle\mathcal{L}_{B}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\alpha_{1}gg^{\prime}B_{\mu\nu}\mathrm{tr}[TW^{\mu\nu}]+\frac{i}{2}\alpha_{2}g^{\prime}B_{\mu\nu}\mathrm{tr}[T[\hat{V}^{\mu},\hat{V}^{\nu}]]+i\alpha_{3}g\mathrm{tr}[W^{\mu\nu}[\hat{V}^{\mu},\hat{V}^{\nu}]]+\ldots$ $\displaystyle\mathcal{L}_{H}$ $\displaystyle=$ $\displaystyle(\partial_{\mu}h)\Big{\\{}\alpha_{H,1}\mathrm{tr}[T\hat{V}^{\mu}]\mathrm{tr}[\hat{V}_{\nu}\hat{V}^{\nu}]+\alpha_{H,2}\mathrm{tr}[T\hat{V}_{\nu}]\mathrm{tr}[\hat{V}^{\mu}\hat{V}^{\nu}]+\alpha_{H,3}\mathrm{tr}[T\hat{V}_{\nu}]\mathrm{tr}[T[\hat{V}^{\mu},\hat{V}^{\nu}]]+\ldots\Big{\\}}\;.$ All coefficients in above Lagrangian are functions of Higgs field $h$. Detailed expressions can be found in Ref.Z'our . Mixings among $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ come from the gauge boson mass term $\mathcal{L}_{M}$ and kinetic term $\mathcal{L}_{K}$. In the unitary gauge $\hat{U}=1$, they become $\displaystyle\mathcal{L}_{M,Z^{\prime}-Z-\gamma}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{8}(1\\!-\\!2\beta_{1})(gW^{3}_{\mu}\\!-g^{\prime}B_{\mu})^{2}+\frac{f^{2}}{2}(1\\!-\\!2\beta_{3})(g^{\prime\prime}X_{\mu}\\!+\tilde{g}^{\prime}B_{\mu})^{2}$ (8) $\displaystyle+\frac{f^{2}}{2}\beta_{2}(g^{\prime\prime}X_{\mu}+\tilde{g}^{\prime}B_{\mu})(gW^{3,\mu}-g^{\prime}B^{\mu})\;,$ $\displaystyle\mathcal{L}_{K,Z^{\prime}-Z-\gamma}$ $\displaystyle=$ $\displaystyle-\frac{1}{4}B_{\mu\nu}B_{\mu\nu}-\frac{1}{4}X_{\mu\nu}X^{\mu\nu}-\frac{1}{4}(1\\!-\\!\alpha_{8}g^{2})(\partial_{\mu}W^{3}_{\nu}\\!-\partial_{\nu}W^{3}_{\mu})^{2}$ $\displaystyle+\frac{1}{2}\alpha_{1}gg^{\prime}B_{\mu\nu}(\partial_{\mu}W^{3}_{\nu}\\!-\partial_{\nu}W^{3}_{\mu})+gg^{\prime\prime}\alpha_{24}X^{\mu\nu}(\partial_{\mu}W^{3}_{\nu}-\partial_{\nu}W^{3}_{\mu})+g^{\prime}g^{\prime\prime}\alpha_{25}B_{\mu\nu}X^{\mu\nu}\;.$ Apart from the four gauge couplings $g,g^{\prime},g^{\prime\prime},\tilde{g}^{\prime}$, seven extra dimensionless parameters $\beta_{1},\beta_{2},\beta_{3}$ and $\alpha_{1},\alpha_{8},\alpha_{24},\alpha_{25}$ determine the mixing terms. Of these eleven, $\alpha_{8}$ can be absorbed into the redefinition of field $W^{3}_{\mu}$ and coupling constant $g$ by $\displaystyle W^{3}_{\mu}\rightarrow\frac{W^{3}_{\mu}}{\sqrt{1-\alpha_{8}g^{2}}}\hskip 56.9055ptg\rightarrow g\sqrt{1-\alpha_{8}g^{2}}\;.$ (10) Hence we are left with ten parameters, and on eliminating the three gauge couplings $g,g^{\prime},g^{\prime\prime}$, leaves us seven independent parameters $\tilde{g}^{\prime},\beta_{1},\beta_{2},\beta_{3},\alpha_{1},\alpha_{24},\alpha_{25}$ that are related to mixings. However, the mixing masses and kinetic terms given by (8) and (II) are so complex that to diagonalize them we must exploit the general $3\times 3$ rotation matrix $U_{ij}$ $\displaystyle(W^{3}_{\mu},~{}B_{\mu},~{}X_{\mu})^{T}=U(Z_{\mu},~{}A_{\mu},~{}Z^{\prime}_{\mu})^{T}\;,$ (11) which has nine matrix elements. The fact that no correction terms arise for the kinetic terms $-\frac{1}{4}B_{\mu\nu}B_{\mu\nu}$ and $-\frac{1}{4}X_{\mu\nu}X^{\mu\nu}$ leads to two constraints on the matrix elements of $U$, $\displaystyle(U^{-1,T}U^{-1})_{22}=(U^{-1,T}U^{-1})_{33}=1\;,$ (12) which imply that there are only seven independent matrix elements. This is consistent with the earlier result that there are at most seven parameters $\tilde{g}^{\prime},\beta_{1},\beta_{2},\beta_{3},\alpha_{1},\alpha_{24},\alpha_{25}$ related to mixings. In Ref.Z'our , we had obtained a set of relations between matrix elements $U_{ij}$ and parameters $g,g^{\prime},g^{\prime\prime},\tilde{g}^{\prime}$, $\beta_{1},\beta_{2},\beta_{3}$, $\alpha_{1},\alpha_{8},\alpha_{24},\alpha_{25}$ as follows $\displaystyle U\equiv\left(\begin{array}[]{ccc}\frac{1}{2g}c_{\alpha}&\frac{1}{2g}&-\frac{1}{2g}s_{\alpha}\\\ -\frac{1}{2g^{\prime}}c_{\alpha}&\frac{1}{2g^{\prime}}&\frac{1}{2g^{\prime}}s_{\alpha}\\\ \frac{1}{g^{\prime\prime}}(s_{\alpha}+\frac{\tilde{g}^{\prime}}{2g^{\prime}}c_{\alpha})&-\frac{\tilde{g}^{\prime}}{2g^{\prime\prime}g^{\prime}}&\frac{1}{g^{\prime\prime}}(c_{\alpha}-\frac{\tilde{g}^{\prime}}{2g^{\prime}}s_{\alpha})\end{array}\right)\left(\begin{array}[]{ccc}\frac{c_{\beta}}{A_{1}}&0&\frac{s_{\beta}}{A_{1}}\\\ ga&gb&gc\\\ -\frac{s_{\beta}}{A_{2}}&0&\frac{c_{\beta}}{A_{2}}\end{array}\right)\left(\begin{array}[]{ccc}\frac{M_{Z}}{f}&0&0\\\ 0&1&0\\\ 0&0&\frac{M_{Z^{\prime}}}{f}\end{array}\right)\;,~{}~{}~{}~{}~{}$ (22) where $c_{\alpha}\equiv\cos\alpha_{Z^{\prime}}$, $s_{\alpha}\equiv\sin\alpha_{Z^{\prime}}$, $s_{\beta}=\sin\beta_{Z^{\prime}}$, $c_{\beta}=\cos\beta_{Z^{\prime}}$ as well as the following definitions $\displaystyle A_{1}^{2}=\frac{1}{4}(1\\!-\\!2\beta_{1})c_{\alpha}^{2}+\beta_{2}s_{\alpha}c_{\alpha}+(1\\!-\\!2\beta_{3})s_{\alpha}^{2}\hskip 28.45274ptA_{2}^{2}=\frac{1}{4}(1\\!-\\!2\beta_{1})s_{\alpha}^{2}-\beta_{2}s_{\alpha}c_{\alpha}+(1-2\beta_{3})c_{\alpha}^{2}\;,~{}~{}~{}$ (23) $\displaystyle\tan\alpha_{Z^{\prime}}=\frac{3+2\beta_{1}-8\beta_{3}-\sqrt{(3+2\beta_{1}-8\beta_{3})^{2}+16\beta_{2}^{2}}}{4\beta_{2}}\hskip 28.45274pt\tan\beta_{Z^{\prime}}=\frac{-G_{2}+\sqrt{G_{2}^{2}+4G_{0}^{2}}}{2G_{0}}~{}~{}~{}~{}~{}~{}$ (24) $\displaystyle a$ $\displaystyle=$ $\displaystyle\frac{1}{gA_{1}A_{2}[{g^{\prime}}^{2}{g^{\prime\prime}}^{2}-{g}^{2}{g^{\prime}}^{2}{g^{\prime\prime}}^{2}(2\alpha_{1}+\alpha_{8})+g^{2}{g^{\prime\prime}}^{2}-4g^{2}g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}(\alpha_{24}+\alpha_{25})+g^{2}\tilde{g}^{\prime 2}]}$ $\displaystyle\times\Big{\\{}[g^{2}{g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}-g^{\prime 2}{g^{\prime\prime}}^{2}+g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}\alpha_{8}+4g^{2}g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}\alpha_{25}](s_{\alpha}s_{\beta}A_{1}+c_{\alpha}c_{\beta}A_{2})$ $\displaystyle+[2g^{2}g^{\prime}\tilde{g}^{\prime}+4g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}(\alpha_{24}+\alpha_{25})](-c_{\alpha}s_{\beta}A_{1}+s_{\alpha}c_{\beta}A_{2})\Big{\\}}\;.$ $\displaystyle b^{2}$ $\displaystyle=$ $\displaystyle\frac{4{g^{\prime}}^{2}{g^{\prime\prime}}^{2}}{(g^{2}+{g^{\prime}}^{2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}-{g}^{2}{g^{\prime}}^{2}{g^{\prime\prime}}^{2}(2\alpha_{1}+\alpha_{8})+4g^{2}g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}(\alpha_{24}+\alpha_{25})}\;.$ $\displaystyle c$ $\displaystyle=$ $\displaystyle\frac{1}{gA_{1}A_{2}[{g^{\prime}}^{2}{g^{\prime\prime}}^{2}-{g}^{2}{g^{\prime}}^{2}{g^{\prime\prime}}^{2}(2\alpha_{1}+\alpha_{8})+g^{2}{g^{\prime\prime}}^{2}-4g^{2}g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}(\alpha_{24}+\alpha_{25})+g^{2}\tilde{g}^{\prime 2}]}$ $\displaystyle\times\Big{\\{}[g^{2}{g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}-g^{\prime 2}{g^{\prime\prime}}^{2}+g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}\alpha_{8}+4g^{2}g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}\alpha_{25}](-s_{\alpha}c_{\beta}A_{1}+c_{\alpha}s_{\beta}A_{2})$ $\displaystyle+[2g^{2}g^{\prime}\tilde{g}^{\prime}+4g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}(\alpha_{24}+\alpha_{25})](c_{\alpha}c_{\beta}A_{1}+s_{\alpha}s_{\beta}A_{2})\Big{\\}}\;.~{}~{}~{}~{}$ $\displaystyle G_{0}$ $\displaystyle=$ $\displaystyle- A_{1}A_{2}\Big{\\{}(-g^{2}-g^{\prime 2}+{g^{\prime\prime}}^{2}+(\tilde{g}^{\prime})^{2})c_{\alpha}s_{\alpha}+g^{\prime}\tilde{g}^{\prime}(s_{\alpha}^{2}-c_{\alpha}^{2})+g^{2}[2g^{\prime 2}c_{\alpha}s_{\alpha}+g^{\prime}\tilde{g}^{\prime}(c_{\alpha}^{2}-s_{\alpha}^{2})]\alpha_{1}$ $\displaystyle+g^{2}[(g^{\prime 2}-{g^{\prime\prime}}^{2}-(\tilde{g}^{\prime})^{2})c_{\alpha}s_{\alpha}-g^{\prime}\tilde{g}^{\prime}(s_{\alpha}^{2}-c_{\alpha}^{2})]\alpha_{8}+2g^{2}{g^{\prime\prime}}^{2}(c_{\alpha}^{2}-s_{\alpha}^{2})(\alpha_{24}+g^{\prime 2}\alpha_{1}\alpha_{25})$ $\displaystyle+{g^{\prime\prime}}^{2}[-4g^{\prime}\tilde{g}^{\prime}c_{\alpha}s_{\alpha}+2g^{\prime 2}(c_{\alpha}^{2}-s_{\alpha}^{2})][g^{2}(\alpha_{8}\alpha_{25}-\alpha_{1}\alpha_{24})-\alpha_{25}]+g^{2}{g^{\prime\prime}}^{2}[8g^{\prime 2}s_{\alpha}c_{\alpha}$ $\displaystyle+4g^{\prime}\tilde{g}^{\prime}(c_{\alpha}^{2}-s_{\alpha}^{2})]\alpha_{24}\alpha_{25}+g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}s_{\alpha}c_{\alpha}(4\alpha_{25}^{2}-\alpha_{1}^{2})+4g^{2}{g^{\prime\prime}}^{2}(g^{\prime}s_{\alpha}+\tilde{g}^{\prime}c_{\alpha})(g^{\prime}c_{\alpha}-\tilde{g}^{\prime}s_{\alpha})\alpha_{24}^{2}\Big{\\}}$ $\displaystyle G_{2}$ $\displaystyle=$ $\displaystyle A_{1}^{2}\Big{\\{}(g^{2}+g^{\prime 2})c_{\alpha}^{2}+({g^{\prime\prime}}^{2}+(\tilde{g}^{\prime})^{2})s_{\alpha}^{2}(1-g^{2}\alpha_{8})-g^{2}g^{\prime 2}c_{\alpha}^{2}(2\alpha_{1}+\alpha_{8})+4g^{\prime}{g^{\prime\prime}}^{2}\tilde{g}^{\prime}s_{\alpha}^{2}\alpha_{25}$ (25) $\displaystyle-4g^{2}g^{\prime 2}{g^{\prime\prime}}^{2}c_{\alpha}^{2}(\alpha_{24}^{2}+\alpha_{25}^{2}+2\alpha_{24}\alpha_{25})-g^{2}{g^{\prime\prime}}^{2}s_{\alpha}^{2}[g^{\prime 2}\alpha_{1}^{2}+4(\tilde{g}^{\prime})^{2}\alpha_{24}^{2}+4g^{\prime}\tilde{g}^{\prime}(\alpha_{8}\alpha_{25}-\alpha_{1}\alpha_{24})]\Big{\\}}$ $\displaystyle-[A_{1}\rightarrow A_{2},c_{\alpha}\leftrightarrow s_{\alpha}]+s_{\alpha}c_{\alpha}(A_{1}^{2}+A_{2}^{2})\Big{\\{}-2g^{\prime}\tilde{g}^{\prime}[1-g^{2}(\alpha_{1}+\alpha_{8})]$ $\displaystyle+4g^{2}{g^{\prime\prime}}^{2}[(\alpha_{24}-\alpha_{25})(1-{g^{\prime\prime}}^{2}\alpha_{1})+2g^{\prime}\tilde{g}^{\prime}\alpha_{24}^{2}+{g^{\prime\prime}}^{2}\alpha_{8}\alpha_{25}]\Big{\\}}\;.$ Finally the masses of $Z$ and $Z^{\prime}$ bosons are determined from $\displaystyle\mathbf{K}_{11}=-\frac{1}{4}\hskip 28.45274pt\mathbf{K}_{33}=-\frac{1}{4}\;,$ (26) with $\displaystyle\mathbf{K}\equiv U^{T}\left(\begin{array}[]{ccc}-\frac{1}{4}(1-\alpha_{8}g^{2})&\frac{1}{4}\alpha_{1}gg^{\prime}&\frac{1}{2}gg^{\prime\prime}\alpha_{24}\\\ \frac{1}{4}\alpha_{1}gg^{\prime}&-\frac{1}{4}&\frac{1}{2}g^{\prime}g^{\prime\prime}\alpha_{25}\\\ \frac{1}{2}gg^{\prime\prime}\alpha_{24}&\frac{1}{2}g^{\prime}g^{\prime\prime}\alpha_{25}&-\frac{1}{4}\\\ \end{array}\right)U\;.~{}~{}~{}~{}~{}~{}~{}~{}$ (30) General expressions for the mixing matrix elements $U_{ij}$ are too complicated to be written analytically. In Ref.Z'our , we listed results for $U_{ij}$, $M_{Z}$ and $M_{Z^{\prime}}$ expanded up to order $p^{4}$ and linear in $\tilde{g}^{\prime}$. In real new physics models appearing in the literature, the $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings are often not so complex. In the next section, we identify and discuss typical $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings appearing in various new physics models. ## III Classification of models in terms of their $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings In this section, we organize the various new physics models that can be found in the literature involving the $Z^{\prime}$ boson according to their $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings. Unlike the most general case reviewed in the last section, these mixings are special $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings for which the mixing matrix elements $U_{ij}$ and $M_{Z}$, $M_{Z^{\prime}}$ can all be work out exactly. Below we consider five situations. 1. 1. Minimal $Z^{\prime}\\!-\\!Z$ mass mixing RizzoARXIV2006 ; FranziniPRD1987 ; RizzoPRD1991 ; LangackerPRD1992 ; ChiappettaPRD1996 ; FramptonPRD1996 ; ErlerPRL2000 ; AnokaNPB2004 ; KozlovPRD2005 ; BassoARXIV2008 ; ChanowitzARXIV2008 ; AppelquistPRD2003 ; FerrogliaAP2007 ; CarenaPRD2004 : This kind of model provides minimal mixing by ignoring all mixings in the kinetic terms and $Z\\!-\\!\gamma$, $Z^{\prime}\\!-\\!\gamma$ mixings in the mass terms. They correspond to the vanishing five parameters $\displaystyle\tilde{g}^{\prime}=\alpha_{1}=\alpha_{8}=\alpha_{24}=\alpha_{25}=0\;.$ (31) With the exception of gauge couplings $g,g^{\prime},g^{\prime\prime}$, the remaining three nontrivial parameters are denoted by the $Z^{\prime}\\!-\\!Z$ mass matrix $\displaystyle\mathcal{M}^{2}=\left(\begin{array}[]{cc}M_{Z_{0}}^{2}&M_{ZZ^{\prime}}^{2}\\\ M_{ZZ^{\prime}}^{2}&M_{Z^{\prime}_{0}}^{2}\end{array}\right)\hskip 28.45274ptZ_{0}^{\mu}\equiv\frac{gW^{3}_{\mu}\\!-g^{\prime}B_{\mu}}{\sqrt{g^{2}\\!+g^{\prime 2}}}\hskip 14.22636ptA_{0}^{\mu}\equiv\frac{g^{\prime}W^{3}_{\mu}\\!+gB_{\mu}}{\sqrt{g^{2}\\!+g^{\prime 2}}}\hskip 14.22636ptZ_{0}^{\prime\mu}\equiv X^{\mu},~{}~{}~{}~{}$ (34) where mass parameters $M_{Z_{0}}^{2}$, $M_{Z^{\prime}_{0}}^{2}$ and $M_{ZZ^{\prime}}^{2}$ are related to $\beta_{1},\beta_{2},\beta_{3}$ as $\displaystyle\frac{f^{2}}{4}(1\\!-\\!2\beta_{1})(g^{2}\\!+\\!g^{\prime 2})\equiv M_{Z_{0}}^{2}\hskip 17.07182ptf^{2}(1\\!-\\!2\beta_{3})g^{\prime\prime 2}\equiv M_{Z_{0}^{\prime}}^{2}\hskip 17.07182pt\frac{f^{2}}{2}\beta_{2}g^{\prime\prime}\sqrt{g^{2}\\!+\\!g^{\prime 2}}\equiv M_{ZZ^{\prime}}^{2}\;.~{}~{}~{}~{}~{}$ (35) Refs.AppelquistPRD2003 ; FerrogliaAP2007 use an alternative expression which corresponds to setting $\displaystyle f=v_{H}\hskip 14.22636ptg^{\prime}=g_{Y}\hskip 14.22636ptg^{\prime\prime}=g_{z}\hskip 14.22636pt\beta_{1}=0\hskip 14.22636pt\beta_{2}=-\frac{1}{2}z_{H}\hskip 14.22636pt1-2\beta_{3}=\frac{1}{4}(z_{H}^{2}+\frac{v_{\phi}^{2}}{f^{2}})\;.~{}~{}~{}~{}~{}~{}~{}~{}~{}$ Ref.CarenaPRD2004 further generalizes this which leads then to $\displaystyle g^{\prime}\\!=g_{Y}\hskip 11.38092ptg^{\prime\prime}\\!\\!=g_{z}\hskip 11.38092pt1-2\beta_{1}=\frac{v_{H_{1}}^{2}+v_{H_{2}}^{2}}{f^{2}}~{}~{}~{}\beta_{2}\\!=-\frac{z_{H_{1}}v_{H_{1}}^{2}\\!\\!+\\!z_{H_{2}}v_{H_{2}}^{2}}{2f^{2}}\hskip 11.38092pt$ $\displaystyle 1\\!-\\!2\beta_{3}\\!=\frac{1}{4f^{2}}(z_{H_{1}}^{2}v_{H_{1}}^{2}\\!\\!+\\!z_{H_{2}}^{2}v_{H_{2}}^{2}\\!\\!+\\!v_{\phi}^{2})\;.~{}~{}~{}~{}~{}~{}~{}~{}~{}$ In this kind of model, the key $Z^{\prime}\\!-\\!Z$ mixing parameter is $\beta_{2}$ which yields a non-vanishing off-diagonal element $M_{ZZ^{\prime}}^{2}$ in the $Z^{\prime}\\!-\\!Z$ mass matrix. This element further generates the seesaw splitting between the original $Z$ and $Z^{\prime}$ masses, $\displaystyle M_{Z}^{2}$ $\displaystyle=$ $\displaystyle\frac{1}{2}[M_{Z_{0}}^{2}\\!+M_{Z_{0}^{\prime}}^{2}\\!-\sqrt{(M_{Z_{0}}^{2}\\!-M_{Z_{0}^{\prime}}^{2})^{2}\\!+4M_{ZZ^{\prime}}^{4}}]\approx M_{Z_{0}}^{2}-\frac{M_{ZZ^{\prime}}^{4}}{M_{Z_{0}^{\prime}}^{2}\\!-M_{Z_{0}}^{2}}$ (36) $\displaystyle M_{Z^{\prime}}^{2}$ $\displaystyle=$ $\displaystyle\frac{1}{2}[M_{Z_{0}}^{2}\\!+M_{Z_{0}^{\prime}}^{2}\\!+\sqrt{(M_{Z_{0}}^{2}\\!-M_{Z_{0}^{\prime}}^{2})^{2}\\!+4M_{ZZ^{\prime}}^{4}}]\approx M_{Z_{0}^{\prime}}^{2}+\frac{M_{ZZ^{\prime}}^{4}}{M_{Z_{0}^{\prime}}^{2}\\!-M_{Z_{0}}^{2}}\;.~{}~{}~{}~{}$ (37) Meanwhile the $Z^{\prime}\\!-\\!Z$ mixing can be parameterized by mixing angle $\theta^{\prime}$ $\displaystyle\left(\begin{array}[]{c}Z_{0}^{\mu}\\\ Z_{0}^{\prime\mu}\end{array}\right)=\left(\begin{array}[]{cc}\cos\theta^{\prime}&\sin\theta^{\prime}\\\ -\sin\theta^{\prime}&\cos\theta^{\prime}\end{array}\right)\left(\begin{array}[]{c}Z^{\mu}\\\ Z^{\prime\mu}\end{array}\right)\hskip 28.45274pt\tan 2\theta^{\prime}=\frac{2M_{ZZ^{\prime}}^{2}}{M_{Z_{0}^{\prime}}^{2}\\!-M_{Z_{0}}^{2}}\;.~{}~{}~{}~{}$ (44) leading to a rotation matrix introduced in (11) of the form $\displaystyle U_{\mbox{\tiny Minimal $Z^{\prime}\\!\\!\\!-\\!\\!Z$ mass mixing}}$ $\displaystyle=$ $\displaystyle\left(\begin{array}[]{ccc}\cos\theta_{W}&\sin\theta_{W}&0\\\ -\sin\theta_{W}&\cos\theta_{W}&0\\\ 0&0&1\end{array}\right)\left(\begin{array}[]{ccc}\cos\theta^{\prime}&0&\sin\theta^{\prime}\\\ 0&1&0\\\ -\sin\theta^{\prime}&0&\cos\theta^{\prime}\end{array}\right)$ (51) $\displaystyle=$ $\displaystyle\left(\begin{array}[]{ccc}\cos\theta_{W}\cos\theta^{\prime}&\sin\theta_{W}&\cos\theta_{W}\sin\theta^{\prime}\\\ -\sin\theta_{W}\cos\theta&\cos\theta_{W}&-\sin\theta_{W}\sin\theta^{\prime}\\\ -\sin\theta^{\prime}&0&\cos\theta^{\prime}\end{array}\right)\;,$ (55) with an electroweak mixing angle $\tan\theta_{W}=g^{\prime}/g$. 2. 2. Minimal $Z^{\prime}\\!-\\!Z$ kinetic mixing RizzoARXIV1998 ; LangackerPRD2008 ; LangackerPRL2008 : This kind of model provides minimal mixing by ignoring all mixings in the mass terms and $Z\\!-\\!\gamma$, $Z^{\prime}\\!-\\!\gamma$ mixings in the kinetic terms leading to the vanishing of seven parameters $\displaystyle\tilde{g}^{\prime}=\beta_{1}=\beta_{2}=\beta_{3}=\alpha_{1}=\alpha_{8}=\alpha_{24}=0\;.$ (56) Again with the exception of gauge couplings $g,g^{\prime},g^{\prime\prime}$, the one remaining nontrivial parameter is denoted by $\displaystyle g^{\prime}g^{\prime\prime}\alpha_{25}\equiv-\frac{\sin\chi}{2}\;.$ (57) following Ref.RizzoARXIV1998 , we redefine the gauge fields as $\displaystyle B^{\mu}=B_{0}^{\mu}-\tan\chi Z^{\prime\mu}_{0}\hskip 56.9055ptX^{\mu}=\frac{Z^{\prime\mu}_{0}}{\cos\chi}\;,$ (58) in terms of the fields $B_{0}^{\mu},Z_{0}^{\prime\mu},W^{3\mu}$, the kinetic term appears diagonalized and the model reduces to a minimal $Z^{\prime}-Z$ mass mixing model discussed above444This detail was not pointed out in Ref.RizzoARXIV1998 . with $\displaystyle M_{Z_{0}}^{2}=\frac{f^{2}}{4}(g^{2}\\!+\\!g^{\prime 2})\hskip 17.07182ptM_{Z_{0}^{\prime}}^{2}=\frac{f^{2}[g^{\prime 2}\sin^{2}\chi\\!+\\!4g^{\prime\prime 2}]}{4\cos^{2}\chi}\hskip 17.07182ptM_{ZZ^{\prime}}^{2}=\frac{f^{2}}{4}g^{\prime}\sqrt{g^{2}\\!+\\!g^{\prime 2}}\tan\chi\;.~{}~{}~{}~{}~{}$ (59) The rotation matrix introduced in (11) takes the form $\displaystyle U_{\mbox{\tiny Minimal $Z^{\prime}\\!\\!\\!-\\!\\!Z$ kinetic mixing}}=\left(\begin{array}[]{ccc}1&0&0\\\ 0&1&-\tan\chi\\\ 0&0&\frac{1}{\cos\chi}\end{array}\right)\times U_{\mbox{\tiny Minimal $Z^{\prime}\\!\\!\\!-\\!\\!Z$ mass mixing}}$ (63) $\displaystyle=\left(\begin{array}[]{ccc}\cos\theta^{\prime}\cos\theta_{W}&\sin\theta_{W}&\cos\theta_{W}\sin\theta^{\prime}\\\ -\sin\theta_{W}\cos\theta^{\prime}+\tan\chi\sin\theta^{\prime}&\cos\theta_{W}&-\sin\theta_{W}\sin\theta^{\prime}-\tan\chi\cos\theta^{\prime}\\\ -\sin\theta^{\prime}/\cos\chi&0&\cos\theta^{\prime}/\cos\chi\end{array}\right)\;.~{}~{}~{}~{}~{}$ (67) 3. 3. General $Z^{\prime}\\!-\\!Z$ mixing RizzoARXIV2006 ; Hill ; Lane ; Chiv ; CasselARXIV2009 ; Holdom1986 ; PDG2006 ; BabuPRD1996 : This kind of model is combinations of minimal $Z^{\prime}\\!-\\!Z$ mass mixing model and minimal $Z^{\prime}\\!-\\!Z$ kinetic mixing model discussed above which correspond to $\displaystyle\tilde{g}^{\prime}=\alpha_{1}=\alpha_{8}=\alpha_{24}=0\hskip 28.45274ptg^{\prime}g^{\prime\prime}\alpha_{25}\equiv-\frac{\sin\chi}{2}\;.$ (68) In a similar manner as for minimal $Z^{\prime}\\!-\\!Z$ kinetic mixing model, we can use (58) to remove the mixing in the kinetic term and then, in terms of the fields $B_{0}^{\mu},Z_{0}^{\prime\mu},W^{3\mu}$, the model can be changed into a minimal $Z^{\prime}\\!-\\!Z$ mass mixing model with identifications $\displaystyle M_{Z_{0}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{4}(1-2\beta_{1})(g^{2}\\!+g^{\prime 2})$ $\displaystyle M_{Z_{0}^{\prime}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}[g^{\prime 2}(1-2\beta_{1})\sin^{2}\chi+4g^{\prime\prime 2}(1-2\beta_{3})+4\beta_{2}g^{\prime}g^{\prime\prime}\sin\chi]}{4\cos^{2}\chi}$ $\displaystyle M_{ZZ^{\prime}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{4}\frac{(1-2\beta_{1})g^{\prime}\sin\chi+2\beta_{2}g^{\prime\prime}}{\cos\chi}\sqrt{g^{2}\\!+g^{\prime 2}}\;.~{}~{}~{}~{}~{}$ (69) The resulting rotation matrix has the same form as in (67), the only change is that now the $\theta^{\prime}$ as determined through (44) is different due to the new expressions for $M_{Z_{0}}^{2},M_{Z_{0}^{\prime}}^{2},M_{ZZ^{\prime}}^{2}$ given by (69). In some dynamical models such as TC2 models, the general $Z^{\prime}\\!-\\!Z$ mixings are generated by technicolor and topcolor dynamics, as in Refs.Hill1 ; Lane1 ; Chiv1 , while mixing parameters are given through dynamical computations depending on the nature of the TC2 models and results in the following expressions $\displaystyle g^{\prime}g^{\prime\prime}\alpha_{25}=\frac{g^{\prime 2}\gamma}{2c_{Z^{\prime}}}\hskip 56.9055pt\frac{f^{2}}{2}\beta_{2}g^{\prime\prime}=\frac{g^{\prime}}{4c_{Z^{\prime}}}\times\left\\{\begin{array}[]{lll}(F_{0}^{\mathrm{TC2}})^{2}\tan\theta^{\prime}&{}{}{}&\mbox{Ref.\cite[cite]{\@@bibref{Authors Phrase1YearPhrase2}{Hill,Hill1}{\@@citephrase{(}}{\@@citephrase{)}}}}\\\ 3(F_{0}^{\mathrm{1D}})^{2}\tan\theta^{\prime}&{}{}{}&\mbox{Ref.\cite[cite]{\@@bibref{Authors Phrase1YearPhrase2}{Lane,Lane1}{\@@citephrase{(}}{\@@citephrase{)}}}}\\\ -3(F_{0}^{\mathrm{1D}})^{2}\cot\theta^{\prime}&{}{}{}&\mbox{Ref.\cite[cite]{\@@bibref{Authors Phrase1YearPhrase2}{Chiv,Chiv1}{\@@citephrase{(}}{\@@citephrase{)}}}}\end{array}\right.\;,$ (73) where all symbols appearing on the right-hand side of these results are parameters pertaining to the TC2 models. 4. 4. $Z^{\prime}\\!-\\!\gamma$ kinetic and $Z^{\prime}\\!-\\!Z$ mixing HoldomPLB1991 : B. Holdom extends the conventional $Z^{\prime}\\!-\\!Z$ mixing by further adding in model a $Z^{\prime}\\!-\\!\gamma$ kinetic mixing term. His model corresponds to having $\displaystyle\tilde{g}^{\prime}=\alpha_{1}=\alpha_{8}=0\hskip 14.22636pt\frac{f^{2}}{4}(1\\!-\\!2\beta_{1})=m_{Z}^{2}\hskip 14.22636pt\frac{f^{2}}{2}\beta_{2}g^{\prime\prime}\sqrt{g^{2}\\!+g^{\prime 2}}=xm_{Z}^{2}\hskip 14.22636ptf^{2}(1\\!-\\!2\beta_{3})g^{\prime\prime 2}=m_{X}^{2}$ $\displaystyle gg^{\prime\prime}\sqrt{g^{2}\\!+g^{\prime 2}}\alpha_{24}=-\frac{1}{2}(gy+g^{\prime}w)\hskip 28.45274ptgg^{\prime\prime}\sqrt{g^{2}\\!+g^{\prime 2}}\alpha_{25}=\frac{1}{2}(g^{\prime}y-gw)\;.$ (74) We can diagonalize the kinetic terms by redefining the $B^{\mu}$ and $W^{3\mu}$ fields as $\displaystyle B^{\mu}=B_{0}^{\mu}-\frac{\sin\chi}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}Z_{0}^{\prime\mu}\hskip 28.45274ptW^{3\mu}=W^{3\mu}_{0}-\frac{\sin\overline{\chi}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}Z_{0}^{\prime\mu}~{}~{}~{}~{}~{}~{}~{}$ (75) $\displaystyle X^{\mu}=\frac{Z_{0}^{\prime\mu}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\hskip 28.45274pt-\frac{\sin\overline{\chi}}{2}\equiv g^{\prime}g^{\prime\prime}\alpha_{24}\hskip 28.45274pt-\frac{\sin\chi}{2}\equiv g^{\prime}g^{\prime\prime}\alpha_{25}$ and then in terms of fields $B_{0}^{\mu},Z_{0}^{\prime\mu},W^{3\mu}_{0}$, the model becomes the minimal $Z^{\prime}\\!-\\!Z$ mass mixing model with $\displaystyle M_{Z_{0}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{4}(1-2\beta_{1})(g^{2}\\!+g^{\prime 2})$ $\displaystyle M_{Z_{0}^{\prime}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}[\frac{1}{4}(1-2\beta_{1})(g^{\prime}\sin\chi-g\sin\overline{\chi})^{2}+(1-2\beta_{3})g^{\prime\prime 2}+\beta_{2}g^{\prime\prime}(g^{\prime}\sin\chi-g\sin\overline{\chi})]}{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}$ $\displaystyle M_{ZZ^{\prime}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{4}\frac{[(1-2\beta_{1})(g^{\prime}\sin\chi-g\sin\overline{\chi})+2\beta_{2}g^{\prime\prime}]}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\sqrt{g^{2}\\!+g^{\prime 2}}\;.~{}~{}~{}~{}~{}$ (76) for which the rotation matrix introduced in (11) takes the form $\displaystyle U_{\mbox{\tiny$Z^{\prime}\\!\\!\\!-\\!\\!\gamma$ kinetic and $Z^{\prime}\\!\\!\\!-\\!\\!Z$ mixing}}=\left(\begin{array}[]{ccc}1&0&-\frac{\sin\overline{\chi}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\\\ 0&1&-\frac{\sin\chi}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\\\ 0&0&\frac{1}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\end{array}\right)\times U_{\mbox{\tiny Minimal $Z^{\prime}\\!\\!\\!-\\!\\!Z$ mass mixing}}$ (80) $\displaystyle=\left(\begin{array}[]{ccc}\frac{g\cos\theta^{\prime}}{\sqrt{g^{2}+g^{\prime 2}}}+\frac{\sin\theta^{\prime}\sin\overline{\chi}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}&~{}~{}~{}\frac{g^{\prime}}{\sqrt{g^{2}+g^{\prime 2}}}{}{}{}&\frac{g\sin\theta^{\prime}}{\sqrt{g^{2}+g^{\prime 2}}}-\frac{\cos\theta^{\prime}\sin\overline{\chi}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\\\ -\frac{g^{\prime}\cos\theta^{\prime}}{\sqrt{g^{2}+g^{\prime 2}}}+\frac{\sin\theta^{\prime}\sin\chi}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}&\frac{g}{\sqrt{g^{2}+g^{\prime 2}}}&-\frac{g^{\prime}\sin\theta^{\prime}}{\sqrt{g^{2}+g^{\prime 2}}}-\frac{\cos\theta^{\prime}\sin\chi}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\\\ -\frac{\sin\theta^{\prime}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}&0&\frac{\cos\theta^{\prime}}{\sqrt{1-\sin^{2}\chi-\sin^{2}\overline{\chi}}}\end{array}\right)\;.~{}~{}~{}~{}~{}$ (84) 5. 5. Stueckelberg-type mixing KorsJHEP2005 ; FeldmanPRL2006 ; FeldmanPRD2007 : This kind of model provides mixing through the nonzero coupling constant $\tilde{g}^{\prime}$ and except for gauge coupling $g,g^{\prime},g^{\prime\prime}$, a typical choice as given in Refs.KorsJHEP2005 ; FeldmanPRL2006 is the vanishing of all other parameters $\displaystyle\beta_{1}=\beta_{2}=\beta_{3}=\alpha_{1}=\alpha_{8}=\alpha_{24}=\alpha_{25}=0\;,$ (85) leading to diagonal kinetic terms and mixing occurring only in the mass terms. After rotating the standard electroweak mixing angle $\theta_{W}$, we can redefine the gauge fields $\displaystyle\bar{B}^{\mu}$ $\displaystyle=$ $\displaystyle-\frac{{g^{\prime\prime}}\sqrt{g^{2}+g^{\prime 2}}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}B_{0}^{\mu}+\frac{g\tilde{g}^{\prime}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}{Z^{\prime}}_{0}^{\mu}$ $\displaystyle\bar{Z}^{\prime\mu}$ $\displaystyle=$ $\displaystyle\frac{g\tilde{g}^{\prime}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}B_{0}^{\mu}+\frac{{g^{\prime\prime}}\sqrt{g^{2}+g^{\prime 2}}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}{Z^{\prime}}_{0}^{\mu}$ (86) thereby changing the present model to a minimal $Z^{\prime}-Z$ mass mixing model with $\displaystyle M_{Z_{0}}^{2}$ $\displaystyle=$ $\displaystyle\frac{f^{2}}{4}(g^{2}+g^{\prime 2}+\frac{4g^{\prime 2}\tilde{g}^{\prime 2}}{g^{2}+g^{\prime 2}})$ $\displaystyle M_{Z^{\prime}_{0}}^{2}$ $\displaystyle=$ $\displaystyle f^{2}({g^{\prime\prime}}^{2}+\frac{g^{2}\tilde{g}^{\prime 2}}{g^{2}+g^{\prime 2}})$ $\displaystyle M_{ZZ^{\prime}}$ $\displaystyle=$ $\displaystyle-\frac{f^{2}g^{\prime}\tilde{g}^{\prime}\sqrt{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}}{g^{2}+g^{\prime 2}}\;.$ (87) The overall rotation matrix then becomes $\displaystyle U_{\mbox{\tiny Stuekckelberg type mixing}}$ $\displaystyle=$ $\displaystyle\left(\begin{array}[]{ccc}\cos\theta_{W}&\sin\theta_{W}&0\\\ -\sin\theta_{W}&\cos\theta_{W}&0\\\ 0&0&1\end{array}\right)\left(\begin{array}[]{ccc}1&0&0\\\ 0&-\frac{{g^{\prime\prime}}\sqrt{g^{2}+g^{\prime 2}}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}&\frac{g\tilde{g}^{\prime}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}\\\ 0&\frac{g\tilde{g}^{\prime}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}&\frac{{g^{\prime\prime}}\sqrt{g^{2}+g^{\prime 2}}}{(g^{2}+g^{\prime 2}){g^{\prime\prime}}^{2}+g^{2}\tilde{g}^{\prime 2}}\end{array}\right)$ (98) $\displaystyle\times\left(\begin{array}[]{ccc}\cos\theta^{\prime}&0&\sin\theta^{\prime}\\\ 0&1&0\\\ -\sin\theta^{\prime}&0&\cos\theta^{\prime}\end{array}\right)$ with $\theta^{\prime}$ evaluated from the second equation of (44) and those of (87). In Ref.FeldmanPRD2007 , the Stueckelberg-type mixing is further generalized to include kinetic mixing by relaxing the original condition $\alpha_{25}=0$. This kinetic mixing can be diagonalized by applying (58) and following a similar procedure to that leading to (86) in diagonalizing the mass terms. ## IV the $Z^{\prime}$ boson charges to quark and leptons The charges for the $Z^{\prime}$ boson with respect to ordinary quarks and leptons can be expressed in terms of the gauge interaction as $\displaystyle\mathcal{L}_{\mathrm{gauge~{}coupling}}={g^{\prime\prime}}X_{\mu}J^{\mu}_{X}\hskip 56.9055ptJ^{\mu}_{X}=\sum_{i}\bar{f}_{i}\gamma^{\mu}[y^{\prime}_{iL}P_{L}+y^{\prime}_{iR}P_{R}]f_{i}\;,$ (99) where index $i$ distinguishes the three generations associated with the six quarks $u,c,t,d,s,b$ and six leptons $e,\mu,\tau,\nu_{e},\nu_{\mu},\nu_{\tau}$, and $y_{i,L}^{\prime},y_{i,R}^{\prime}$ are the corresponding left- and right-hand charges555Phenomenologically, we need to further express the gauge interaction given in Eq.(99) in terms of mass eigenstate of $Z^{\prime}$, for then the $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixings discussed in the last section set in.. The $SU(2)_{L}$ symmetry requires equating $U(1)$ charges of the two components of the left-hand fermion doublet, i.e. $y^{\prime}_{u,L}=y^{\prime}_{d,L}\equiv y^{\prime}_{q}$ for quark and $y^{\prime}_{\nu,L}=y^{\prime}_{e,L}\equiv y^{\prime}_{l}$ for lepton. Thus, we can parameterize the fermionic $U(1)^{\prime}$ charges by $y^{\prime}_{q}$, $y^{\prime}_{u}$, $y^{\prime}_{d}$, $y^{\prime}_{l}$, $y^{\prime}_{e}$ and $y^{\prime}_{\nu}$. In general, the assignments of $U(1)^{\prime}$ charges are generation-dependent, but in its simplest form $U(1)^{\prime}$ charges can be generation-independent, much like hypercharge assignments in SM. TABLE.1 lists four sets of more common assignments for the generation-independent $U(1)^{\prime}$ charges of fermions in new physics models involving $Z^{\prime}$ boson CarenaPRD2004 ; PDG2008 . In the $U(1)_{B-xL}$ model (see column 3 of TABLE.1), $Z^{\prime}$ charges are determined by the baryon number and lepton number from $y^{\prime}_{i}=B_{i}-xL_{i}$ with a free rational parameter $x$. Leptophobic and hadrophobic $Z^{\prime}$ models correspond to $x=\infty$ and $x=0$, respectively. The second set of charges comes from grand unified theories. Parameter $x$ establishes the mixing of the two extra $U(1)$ groups in the $E_{6}$ symmetry breaking patterns $E_{6}\rightarrow SU(5)\times U(1)\times U(1)$. $Z_{\chi}$, $Z_{\psi}$ and $Z_{\eta}$ of Ref.GUTs correspond to the special case with $x=-3$, $x=1$ and $x=-1/2$, respectively. The third set, $U(1)_{d-xu}$ results in the vanishing of the left-hand quark doublet charge and the ratio of right-hand up quark charges to down quark charges is controlled by $-x$. In the last set, the free parameter $x$ is the ratio of the charges of the left-hand quark doublet and right-hand up quark singlet and reduces to the $U(1)_{B-L}$ model for $x=1$. Table 1: generation-independent $U(1)^{\prime}$ charges for quarks and leptons models | $Z^{\prime}$ EWCL | $U(1)_{B-xL}$ | $U(1)_{10+x\bar{5}}$ | $U(1)_{d-xu}$ | $U(1)_{q+xu}$ ---|---|---|---|---|--- $(u_{L},d_{L})$ | $y^{\prime}_{q}$ | $1/3$ | $1/3$ | $0$ | $1/3$ $u_{R}$ | $y^{\prime}_{u}$ | $1/3$ | $-1/3$ | $-x/3$ | $x/3$ $d_{R}$ | $y^{\prime}_{d}$ | $1/3$ | $-x/3$ | $1/3$ | $(2-x)/3$ $(\nu_{L},e_{L})$ | $y^{\prime}_{l}$ | $-x$ | $x/3$ | $(x-1)/3$ | $-1$ $e_{R}$ | $y^{\prime}_{e}$ | $-x$ | $-1/3$ | $x/3$ | $-(2+x)/3$ $\nu_{R}$ | $y^{\prime}_{\nu_{R}}$ | $-1$ | $(x-2)/3$ | $-x/3$ | $(x-4)/3$ Theoretically, the charges of quarks and leptons must satisfy the anomaly cancellation conditions to preserve the gauge symmetry. We now examine the constraints on generation-independent $U(1)^{\prime}$ charges arising as a consequence of these anomaly cancellation conditions. Davidson et.al. DavidsonPRD1979 have studied anomaly cancellation for additional $U(1)^{\prime}$ gauge group and derived the following anomaly cancellation conditions for $U(1)_{Y}\otimes U(1)^{\prime}$ gauge groups $\displaystyle\sum y^{\alpha}_{L}=\sum Q^{2}(y^{\alpha}_{L}\\!-\\!y^{\alpha}_{R})=0\hskip 17.07182pt\sum Q(y^{\alpha}_{L}y^{\beta}_{L}\\!-\\!y^{\alpha}_{R}y^{\beta}_{R})=0\hskip 17.07182pt\sum(y^{\alpha}_{L}y^{\beta}_{L}y^{\gamma}_{L}\\!-\\!y^{\alpha}_{R}y^{\beta}_{R}y^{\gamma}_{R})=0\;,~{}~{}~{}~{}$ (100) where $\alpha,\beta,\gamma$ indexes $U(1)_{Y}$ and $U(1)^{\prime}$ charges. Substituting the $U(1)_{Y}$ charges for ordinary quarks and leptons and assuming the generation-independence of $U(1)^{\prime}$ charges, we find that above equations imply $\displaystyle\left\\{\begin{array}[]{l}y^{\prime}_{l}+3y^{\prime}_{q}=0\\\ 3y^{\prime}_{l}+5y^{\prime}_{q}-3y^{\prime}_{e}-4y^{\prime}_{u}-y^{\prime}_{d}=0\\\ -{y^{\prime}_{l}}^{2}+{y^{\prime}_{q}}^{2}+{y^{\prime}_{e}}^{2}-2{y^{\prime}_{u}}^{2}+{y^{\prime}_{d}}^{2}=0\\\ 3y^{\prime}_{l}+y^{\prime}_{q}-6y^{\prime}_{e}-8y^{\prime}_{u}-2y^{\prime}_{d}=0\\\ 2{y^{\prime}_{l}}^{3}+6{y^{\prime}_{q}}^{3}-{y^{\prime}_{e}}^{3}-3{y^{\prime}_{u}}^{3}-3{y^{\prime}_{d}}^{3}-{y^{\prime}_{\nu_{R}}}^{3}=0\end{array}\right.\;.$ (106) The last equation in (106) can be satisfied by assigning $y^{\prime}_{\nu_{R}}$ a proper value or adding in our theory some other new fermions. Solving the above equations, we obtain two sets of solutions which satisfy the anomaly cancellation conditions $\displaystyle\left\\{\begin{array}[]{l}y^{\prime}_{l}=-3y^{\prime}_{q}\\\ y^{\prime}_{d}=2y^{\prime}_{q}-y^{\prime}_{u}\\\ y^{\prime}_{e}=-2y^{\prime}_{q}-y^{\prime}_{u}\\\ y^{\prime}_{\nu_{R}}=-4y^{\prime}_{q}+y^{\prime}_{u}\end{array}\right.\hskip 56.9055pt{\rm or}\hskip 56.9055pt\left\\{\begin{array}[]{l}y^{\prime}_{l}=-3y^{\prime}_{q}\\\ y^{\prime}_{d}=-\frac{14}{5}y^{\prime}_{q}+\frac{1}{5}y^{\prime}_{u}\\\ y^{\prime}_{e}=-\frac{2}{5}y^{\prime}_{q}-\frac{7}{5}y^{\prime}_{u}\\\ y^{\prime}_{\nu_{R}}=\frac{\sqrt[3]{35}}{5}(4y^{\prime}_{q}-y^{\prime}_{u})\end{array}\right.\;.$ (115) Of the six of $U(1)^{\prime}$ charges, only two of them $y^{\prime}_{q}$ and $y^{\prime}_{u}$ are independent; the other four being linear combinations of these two. In addition, there are two kinds of linear combinations: the first of Eq.(115) which was given and discussed in detail in Ref.AppelquistPRD2003 , while the second is a new solution having not yet appeared in the literature. We can utilize the values of $y^{\prime}_{q}$ and $y^{\prime}_{u}$ to classify the new physics models and in the following we list some typical cases: 1. 1. Left Handed: $y^{\prime}_{u}=y^{\prime}_{d}=y^{\prime}_{e}=y^{\prime}_{\nu_{R}}=0~{}\Rightarrow~{}y^{\prime}_{q}=y^{\prime}_{l}=0$ 2. 2. Right Handed: $y^{\prime}_{q}=y^{\prime}_{l}=0~{}\Rightarrow~{}y^{\prime}_{d}\\!=-y^{\prime}_{u}\\!=y^{\prime}_{e}\\!=-y^{\prime}_{\nu_{R}}$ or $y^{\prime}_{d}\\!=\frac{1}{5}y^{\prime}_{u}\\!=-\frac{1}{7}y^{\prime}_{e}\\!=-\frac{1}{\sqrt[3]{35}}y^{\prime}_{\nu_{R}}$ 3. 3. Left-Right symmetric: $y^{\prime}_{q}=y^{\prime}_{u}=y^{\prime}_{d}~{}\Rightarrow~{}y^{\prime}_{l}=y^{\prime}_{e}=y^{\prime}_{\nu_{R}}=-3y^{\prime}_{q}$ 4. 4. $\nu_{R}$ decouple: $y^{\prime}_{\nu_{R}}=0~{}\Rightarrow~{}y^{\prime}_{u}=4y^{\prime}_{q},~{}y^{\prime}_{e}=2y^{\prime}_{l}=3y^{\prime}_{d}=-6y^{\prime}_{q}$ Checking the assignments given in TABLE.1 against the two solutions in (115), we find that the $U(1)_{B-xL}$, $U(1)_{d-xu}$ and $U(1)_{q+xu}$ models are anomaly-free when parameter $x=1$ with the right-hand neutrino charge $y^{\prime}_{\nu_{R}}=-1$, $y^{\prime}_{\nu_{R}}=-\frac{1}{3}$ and $y^{\prime}_{\nu_{R}}=-1$, respectively. Furthermore, the $U(1)_{10+x\bar{5}}$ model is anomaly-free when $x=-3$ with $y^{\prime}_{\nu_{R}}=-5/3$. Even though the anomaly cancellation condition can not be satisfied with the present quarks and leptons, we still have the possibility of canceling the anomalies by adding some extra fermions into theory. If we relax the generation-independence criterion on the $U(1)^{\prime}$ charges, we need to add generation indices to each of the charges in Eq.(106) and sum over the generations on the left-hand side of Eq.(106). In this case, there are too many free parameters and solutions. We list several possible solutions in TABLE.2, in which the first and last columns are the two solutions given in Ref.PDG2008 , and the remaining solutions can be seen to be some kind of generation-dependent generalization of charge assignments given in the third, fourth and fifth columns in TABLE.1. The typical feature of these solutions is that for the solutions given in the first four columns of TABLE.2, the charges for the first two generations are parameterized in a like manner as those in the generation-independent situation by $x$ or $y$ separately, and differences appear only in the third generation of quarks and leptons. Of special note is that for the solution to $U(1)_{q+xu+yc+zt}$, the anomaly cancellation condition is satisfied for each generation independently. Table 2: generation-dependent charge models | $U(1)_{B-xL_{e}\\!-yL_{\mu}\\!}$ | $U(1)_{10+x\bar{5}}~{}\mathrm{\tiny gen\\!\\!-\\!dep}$ | $U(1)_{d-xu}~{}\mathrm{\tiny gen\\!\\!-\\!dep}$ | $U(1)_{q+xu+yc+zt}$ | $2\\!+\\!1~{}\mathrm{\tiny leptocratic}$ ---|---|---|---|---|--- $q_{1,L}$ | $1/3$ | $1/3$ | $0$ | $1/3$ | $1/3$ $u_{R}$ | $1/3$ | $-1/3$ | $-x/3$ | $x/3$ | $x/3$ $d_{R}$ | $1/3$ | $-x/3$ | $1/3$ | $(2-x)/3$ | $(2-x)/3$ $q_{2,L}$ | $1/3$ | $1/3$ | $0$ | $1/3$ | $1/3$ $c_{R}$ | $1/3$ | $-1/3$ | $-y/3$ | $y/3$ | $x/3$ $s_{R}$ | $1/3$ | $-y/3$ | $1/3$ | $(2-y)/3$ | $(2-x)/3$ $q_{3,L}$ | $1/3$ | $1/3$ | $0$ | $1/3$ | $1/3$ $t_{R}$ | $1/3$ | $-1/3$ | $2\\!-\\!\frac{2}{3}(x\\!\\!+\\!y)\\!\pm\\!\\!\sqrt{3\\!-\\!x^{2}\\!\\!-\\!y^{2}}$ | $z/3$ | $x/3$ $b_{R}$ | $1/3$ | $3+\frac{x+y}{3}$ | $1/3$ | $(2-z)/3$ | $(2-x)/3$ $(\nu^{e}_{L},e_{L})$ | $-x$ | $x/3$ | $(x-1)/3$ | $-1$ | $-1-2y$ $e_{R}$ | $-x$ | $-1/3$ | $x/3$ | $-(2+x)/3$ | $-(2\\!+\\!x)/3-2y$ $(\nu^{\mu}_{L},\mu_{L})$ | $-y$ | $y/3$ | $(y-1)/3$ | $-1$ | $y-1$ $\mu_{R}$ | $-y$ | $-1/3$ | $y/3$ | $-(2+y)/3$ | $-(2\\!+\\!x)/3+y$ $(\nu^{\tau}_{L},\tau_{L})$ | $x+y-3$ | $3+\frac{x+y}{3}$ | $\frac{2}{3}-\frac{1}{3}(x+y)$ | $-1$ | $y-1$ $\tau_{R}$ | $x+y-3$ | $-1/3$ | $x\\!+\\!y\\!-\\!3\\!\mp\\!\frac{4}{3}\sqrt{3\\!-\\!x^{2}\\!-\\!y^{2}}$ | $-(2+z)/3$ | $-(2+x)/3+y$ ## V Summary In this paper, we have classified various new physics models involving the $Z^{\prime}$ boson in two different ways: one according to $Z^{\prime}$ boson mixings with $Z$ and $\gamma$, and the other according to $Z^{\prime}$ boson charges with respect to quarks and leptons. In regard to the former, we based the general description for the $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixing derived from the EWCL on our previous workZ'our , characterizing these new physics models into five classes: 1. Models with minimal $Z^{\prime}\\!-\\!Z$ mass mixing; 2.Models with minimal $Z^{\prime}\\!-\\!Z$ kinetic mixing; 3.Models with general $Z^{\prime}\\!-\\!Z$ mixing; 4.Models with $Z^{\prime}\\!-\\!\gamma$ kinetic and $Z^{\prime}\\!-\\!Z$ mixing; and 5.Models with Stueckelberg-type mixing. Although the general $Z^{\prime}\\!-\\!Z\\!-\\!\gamma$ mixing is complicated and there is no exact analytical expression for the mixing matrix $U$ and masses $M_{Z},M_{Z^{\prime}}$, we obtain explicit analytical expressions for each of our five simplifying classes. We find that the most elementary mixing is the minimal $Z^{\prime}\\!-\\!Z$ mass mixing, the other four classes of mixings can be transformed into the minimal $Z^{\prime}\\!-\\!Z$ mass mixing through field transformations. In regard to the latter classification, we exploit the anomaly cancellation conditions to constrain the $U(1)^{\prime}$ charges. For generation-independent $U(1)^{\prime}$ charges, there are six charges $y^{\prime}_{q}$,$y^{\prime}_{u}$,$y^{\prime}_{d}$,$y^{\prime}_{l}$,$y^{\prime}_{e}$,$y^{\prime}_{\nu}$ for which anomaly cancellation requires that only two are independent parameters while the other four can depend on these two parameters in two different ways. While one appears already in the literature, the other is new. For generation-dependent $U(1)^{\prime}$ charges, we have listed some possible special solutions. ## Acknowledgments This work was supported by National Science Foundation of China (NSFC) under Grant No. 10875065. ## References * (1) T.G. Rizzo, arXiv:hep-ph/0610104 (2006) * (2) C.T.Hill, Phys.Lett. B345,483(1995). * (3) K.Lane and E.Eichten, Phys. Lett. B 352, 382(1995). * (4) F.Braam, M.Flossdorf, R.S.Chivukula, S.D.Chiara, E.H.Simmons, Phys. Rev. D77, 055005(2008). * (5) P.Langacker, G.Paz,L-T Wang and I.Yavin, Phys. Rev. Lett. 100, 041802(2008); Phys. Rev. D77, 085033(2008). * (6) S. Cassel, D.M. Ghilencea, G.G. Ross, arXiv:0903.1119 (2009). * (7) P.Langacker, e-Print: arXiv:0801.1345. * (8) Y.Zhang, S-Z.Wang, Q.Wang, JHEP03,047(2008). * (9) P.J.Franzini and F.J.Gilman, Phys. Rev. D35, 855(1987). * (10) T.G.Rizzo, Phys. Rev. D44, 202(1991). * (11) P.Langacker, M.Luo, Phys. Rev. D45, 278(1992). * (12) P.Chiappetta, J.Layssac, F.M.Renard, C.Verzegnassi, Phys. Rev. D54, 789(1996). * (13) P.H.Frampton, M.B.Wise, B.D.Wright, Phys. Rev. D54, 5820(1996). * (14) J.Erler, P.Langacker, Phys. Rev. Lett. 84, 212(2000). * (15) O.C.Anoka, K.S.Babu, and I.Gogoladze, Nucl. Phys. B687, 3(2004). * (16) G.A. Kozlov, Phys. Rev. D72, 075015(2005). * (17) L.Basso, A.Belyaev, S.Moretti, C.H.Shepherd-Themistocleous, arXiv:0812.4313(2008). * (18) M.S.Chanowitz, arXiv:0806.0890v2. * (19) T.Appelquist, B.A.Dobrescu, and A.R. Hopper, Phys. Rev. D68, 035012 (2003). * (20) A.Ferroglia, A.Lorca, J.J.van der Bij, Annal. Phys. 16, 563(2007). * (21) M.Carena, A.Daleo, B.A.Dobrescu, and T.M.P.Tait, Phys. Rev. D70, 093009(2004). * (22) T.G.Rizzo, Phys. Rev. D59, 015020(1998). * (23) P.Langacker, G.Paz, L.-T.Wang, I.Yavin, Phys. Rev.D77, 085033(2008). * (24) P.Langacker, G.Paz, L.-T.Wang, I.Yavin, Phys. Rev. Lett.100, 041802(2008). * (25) B. Holdom, Phys. Lett. B166, 196(1986). * (26) W.-M. Yao et al, J. Phys. G33, 1(2006). * (27) K.S. Babu, C. Kolda, and J.March-Russell, Phys. Rev. D54, 4635(1996). * (28) H-H.Zhang, S-Z.Jiang, J-Y.Lang, Q.Wang, Phys. Rev. D77, 055003(2008) * (29) J-Y.Lang, S-Z.Jiang, Q.Wang, Phys. Rev. D79 015002(2009). * (30) J-Y.Lang, S-Z.Jiang, Q.Wang, Phys. Lett. B673, 63(2009). * (31) B. Holdom, Phys. Lett. B259, 329(1991). * (32) B.Körs and P. Nath, JHEP 07, 069(2005). * (33) D.Feldman, Z.Liu, and P.Nath, Phys. Rev. Lett.97, 021801(2006). * (34) D.Feldman, Z.Liu, P.Nath, Phys. Rev. D75, 115001(2007). * (35) C.Amsler et al., Phys. Lett. B667, 1(2008). * (36) J.L. Hewett,T.G.Rizzo, Phys. Rept. 183, 193(1989); A.Leike, Phys. Rept. 317, 143(1999); P.Langacker, Phys. Rept. 72, 185(1981). * (37) A.Davidson, M.Koca and K.C.Wail, Phys. Rev. D20, 1195(1979).
arxiv-papers
2009-04-14T05:00:57
2024-09-04T02:49:01.848150
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Ying Zhang, Qing Wang", "submitter": "Wang Qing", "url": "https://arxiv.org/abs/0904.2047" }
0904.2051
# Joint-sparse recovery from multiple measurements††thanks: Department of Computer Science, University of British Columbia, Vancouver V6T 1Z4, BC, Canada ({ewout78,mpf}@cs.ubc.ca). Research partially supported by the Natural Sciences and Engineering Research Council of Canada. Ewout van den Berg Michael P. Friedlander ###### Abstract The joint-sparse recovery problem aims to recover, from sets of compressed measurements, unknown sparse matrices with nonzero entries restricted to a subset of rows. This is an extension of the single-measurement-vector (SMV) problem widely studied in compressed sensing. We analyze the recovery properties for two types of recovery algorithms. First, we show that recovery using sum-of-norm minimization cannot exceed the uniform recovery rate of sequential SMV using $\ell_{1}$ minimization, and that there are problems that can be solved with one approach but not with the other. Second, we analyze the performance of the ReMBo algorithm [M. Mishali and Y. Eldar, IEEE Trans. Sig. Proc., 56 (2008)] in combination with $\ell_{1}$ minimization, and show how recovery improves as more measurements are taken. From this analysis it follows that having more measurements than number of nonzero rows does not improve the potential theoretical recovery rate. ## 1 Introduction A problem of central importance in compressed sensing [1, 10] is the following: given an $m\times n$ matrix $A$, and a measurement vector $b=Ax_{0}$, recover $x_{0}$. When $m<n$, this problem is ill-posed, and it is not generally possible to uniquely recover $x_{0}$ without some prior information. In many important cases, $x_{0}$ is known to be sparse, and it may be appropriate to solve $\displaystyle\mathop{\hbox{minimize}}_{x\in\mathbb{R}^{n}}\quad\|x\|_{0}\quad\mathop{\hbox{subject to}}\quad Ax=b,$ (1.1) to find the sparsest possible solution. (The $\ell_{0}$-norm $\|\cdot\|_{0}$ of a vector counts the number of nonzero entries.) If $x_{0}$ has fewer than $s/2$ nonzero entries, where $s$ is the number of nonzeros in the sparsest null-vector of $A$, then $x_{0}$ is the unique solution of this optimization problem [12, 19]. The main obstacle of this approach is that it is combinatorial [24], and therefore impractical for all but the smallest problems. To overcome this, Chen et al. [6] introduced basis pursuit: $\displaystyle\mathop{\hbox{minimize}}_{x\in\mathbb{R}^{n}}\quad\|x\|_{1}\quad\mathop{\hbox{subject to}}\quad Ax=b.$ (1.2) This convex relaxation, based on the $\ell_{1}$-norm $\|x\|_{1}$, can be solved much more efficiently; moreover, under certain conditions [2, 11], it yields the same solution as the $\ell_{0}$ problem (1.1). A natural extension of the single-measurement-vector (SMV) problem just described is the multiple-measurement-vector (MMV) problem. Instead of a single measurement $b$, we are given a set of $r$ measurements $b^{(k)}=Ax_{0}^{(k)},\quad k=1,\ldots,r,$ in which the vectors $x_{0}^{(k)}$ are jointly sparse—i.e., have nonzero entries at the same locations. Such problems arise in source localization [22], neuromagnetic imaging [8], and equalization of sparse-communication channels [7, 15]. Succinctly, the aim of the MMV problem is to recover $X_{0}$ from observations $B=AX_{0}$, where $B=[b^{(1)},\ b^{(2)},\ldots,\ b^{(r)}]$ is an $m\times r$ matrix, and the $n\times r$ matrix $X_{0}$ is row sparse—i.e., it has nonzero entries in only a small number of rows. The most widely studied approach to the MMV problem is based on solving the convex optimization problem $\displaystyle\mathop{\hbox{minimize}}_{X\in\mathbb{R}^{n\times r}}\quad\|X\|_{p,q}\quad\mathop{\hbox{subject to}}\quad AX=B,$ where the mixed $\ell_{p,q}$ norm of $X$ is defined as $\|X\|_{p,q}=\Big{(}\sum_{j=1}^{n}\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{q}^{p}\Big{)}^{1/p},$ and $X^{{j}{\scalebox{0.6}{$\rightarrow$}}}$ is the (column) vector whose entries form the $j$th row of $X$. In particular, Cotter et al. [8] consider $p=2$, $q\leq 1$; Tropp [28, 29] analyzes $p=1$, $q=\infty$; Malioutov et al. [22] and Eldar and Mishali [14] use $p=1$, $q=2$; and Chen and Huo [5] study $p=1$, $q\geq 1$. A different approach is given by Mishali and Eldar [23], who propose the ReMBo algorithm, which reduces MMV to a series of SMV problems. In this paper we study the sum-of-norms problem and the conditions for uniform recovery of all $X_{0}$ with a fixed row support, and compare this against recovery using $\ell_{1,1}$. We then construct matrices $X_{0}$ that cannot be recovered using $\ell_{1,1}$ but for which $\ell_{1,2}$ does succeed, and vice versa. We then illustrate the individual recovery properties of $\ell_{1,1}$ and $\ell_{1,2}$ with empirical results. We further show how recovery via $\ell_{1,1}$ changes as the number of measurements increases, and propose a boosted-$\ell_{1}$ approach to improve on the $\ell_{1,1}$ approach. This analysis provides the starting point for our study of the recovery properties of ReMBo, based on a geometrical interpretation of this algorithm. We begin in Section 2 by summarizing existing $\ell_{0}$-$\ell_{1}$ equivalence results, which give conditions under which the solution of the $\ell_{1}$ relaxation (1.2) coincides with the solution of the $\ell_{0}$ problem (1.1). In Section 3 we consider the $\ell_{1,2}$ mixed-norm and sum- of-norms formulations and compare their performance against $\ell_{1,1}$. In Sections 4 and 5 we examine two approaches that are based on sequential application of (1.2). ##### Notation. We assume throughout that $A$ is a full-rank matrix in $\mathbb{R}^{m\times n}$, and that $X_{0}$ is an $s$ row-sparse matrix in $\mathbb{R}^{n\times r}$. We follow the convention that all vectors are column vectors. For an arbitrary matrix $M$, its $j$th column is denoted by the column vector $M^{\scalebox{0.6}{$\downarrow$}{j}}$; its $i$th row is the transpose of the column vector $M^{{i}{\scalebox{0.6}{$\rightarrow$}}}$. The $i$th entry of a vector $v$ is denoted by $v_{i}$. We make exceptions for $e_{i}=I^{\scalebox{0.6}{$\downarrow$}{i}}$ and for $x_{0}$ (resp., $X_{0}$), which represents the sparse vector (resp., matrix) we want to recover. When there is no ambiguity we sometimes write $m_{i}$ to denote $M^{\scalebox{0.6}{$\downarrow$}{i}}$. When concatenating vectors into matrices, $[a,b,c]$ denotes horizontal concatenation and $[a;b;c]$ denotes vertical concatenation. When indexing with $\mathcal{I}$, we define the vector $v_{\mathcal{I}}:=[v_{i}]_{i\in\mathcal{I}}$, and the $m\times|\mathcal{I}|$ matrix $A_{\mathcal{I}}:=[A^{\scalebox{0.6}{$\downarrow$}{j}}]_{j\in\mathcal{I}}$. Row or column selection takes precedence over all other operators. ## 2 Existing results for $\ell_{1}$ recovery The conditions under which (1.2) gives the sparsest possible solution have been studied by applying a number of different techniques. By far the most popular analytical approach is based on the restricted isometry property, introduced by Candès and Tao [3], which gives sufficient conditions for equivalence. Donoho [9] obtains necessary and sufficient (NS) conditions by analyzing the underlying geometry of (1.2). Several authors [13, 19, 12] characterize the NS-conditions in terms of properties of the kernel of $A$: $\textrm{Ker}(A)=\\{x\mid Ax=0\\}.$ Fuchs [16] and Tropp [27] express sufficient conditions in terms of the solution of the dual of (1.2): $\displaystyle\mathop{\hbox{maximize}}_{y}\quad b^{T}\\!y\quad\mathop{\hbox{subject to}}\quad\|A^{T}\\!y\|_{\infty}\leq 1.$ (2.1) In this paper we are mainly concerned with the geometric and kernel conditions. We use the geometrical interpretation of the problems to get a better understanding, and resort to the null-space properties of $A$ to analyze recovery. To make the discussion more self-contained, we briefly recall some of the relevant results in the next three sections. ### 2.1 The geometry of $\ell_{1}$ recovery The set of all points of the unit $\ell_{1}$-ball, $\\{x\in\mathbb{R}^{n}\mid\|x\|_{1}\leq 1\\}$, can be formed by taking convex combinations of $\pm e_{j}$, the signed columns of the identity matrix. Geometrically this is equivalent to taking the convex hull of these vectors, giving the cross-polytope $\mathcal{C}=\mathrm{conv}\\{\pm e_{1},\pm e_{2},\ldots,\pm e_{n}\\}$. Likewise, we can look at the linear mapping $x\mapsto Ax$ for all points $x\in\mathcal{C}$, giving the polytope $\mathcal{P}=\\{Ax\mid x\in\mathcal{C}\\}=A\mathcal{C}$. The faces of $\mathcal{C}$ can be expressed as the convex hull of subsets of vertices, not including pairs that are reflections with respect to the origin (such pairs are sometimes erroneously referred to as antipodal, which is a slightly more general concept [21]). Under linear transformations, each face from the cross- polytope $\mathcal{C}$ either maps to a face on $\mathcal{P}$ or vanishes into the interior of $\mathcal{P}$. The solution found by (1.2) can be interpreted as follows. Starting with a radius of zero, we slowly “inflate” $\mathcal{P}$ until it first touches $b$. The radius at which this happens corresponds to the $\ell_{1}$-norm of the solution $x^{*}$. The vertices whose convex hull is the face touching $b$ determine the location and sign of the non-zero entries of $x^{*}$, while the position where $b$ touches the face determines their relative weights. Donoho [9] shows that $x_{0}$ can be recovered from $b=Ax_{0}$ using (1.2) if and only if the face of the (scaled) cross-polytope containing $x_{0}$ maps to a face on $\mathcal{P}$. Two direct consequences are that recovery depends only on the sign pattern of $x_{0}$, and that the probability of recovering a random $s$-sparse vector is equal to the ratio of the number of $(s-1)$-faces in $\mathcal{P}$ to the number of $(s-1)$-faces in $\mathcal{C}$. That is, letting $\mathcal{F}_{d}(\mathcal{P})$ denote the collection of all $d$-faces [21] in $\mathcal{P}$, the probability of recovering $x_{0}$ using $\ell_{1}$ is given by $P_{\ell_{1}}(A,s)=\frac{|\mathcal{F}_{s-1}(A\mathcal{C})|}{|\mathcal{F}_{s-1}(\mathcal{C})|}.$ When we need to find the recoverability of vectors restricted to a support $\mathcal{I}$, this probability becomes $P_{\ell_{1}}(A,\mathcal{I})=\frac{|\mathcal{F}_{\mathcal{I}}(A\mathcal{C})|}{|\mathcal{F}_{\mathcal{I}}(\mathcal{C})|},$ (2.2) where $\mathcal{F}_{\mathcal{I}}(\mathcal{C})=2^{|\mathcal{I}|}$ denotes the number of faces in $\mathcal{C}$ formed by the convex hull of $\\{\pm e_{j}\\}_{i\in\mathcal{I}}$, and $\mathcal{F}_{\mathcal{I}}(A\mathcal{C})$ is the number of faces on $A\mathcal{C}$ generated by $\\{\pm A^{\scalebox{0.6}{$\downarrow$}{j}}\\}_{j\in\mathcal{I}}$. ### 2.2 Null-space properties and $\ell_{1}$ recovery Equivalence results in terms of null-space properties generally characterize equivalence for the set of all vectors $x$ with a fixed support, which is defined as $\textrm{Supp}(x)=\\{j\mid x_{j}\neq 0\\}.$ We say that $x$ can be uniformly recovered on $\mathcal{I}\subseteq\\{1,\ldots,n\\}$ if all $x$ with $\textrm{Supp}(x)\subseteq\mathcal{I}$ can be recovered. The following theorem illustrates conditions for uniform recovery via $\ell_{1}$ on an index set; more general results are given by Gribonval and Nielsen [20]. ###### Theorem 2.1 (Donoho and Elad [12], Gribonval and Nielsen [19]). Let $A$ be an $m\times n$ matrix and $\mathcal{I}\subseteq\\{1,\ldots,n\\}$ be a fixed index set. Then all $x_{0}\in\mathbb{R}^{n}$ with $\textrm{Supp}(x_{0})\subseteq\mathcal{I}$ can be uniquely recovered from $b=Ax_{0}$ using basis pursuit (1.2) if and only if for all $z\in\textrm{Ker}(A)\setminus\\{0\\}$, $\sum_{j\in\mathcal{I}}|z_{j}|<\sum_{j\not\in\mathcal{I}}|z_{j}|.$ (2.3) That is, the $\ell_{1}$-norm of $z$ on $\mathcal{I}$ is strictly less than the $\ell_{1}$-norm of $z$ on the complement $\mathcal{I}^{c}$. ### 2.3 Optimality conditions for $\ell_{1}$ recovery Sufficient conditions for recovery can be derived from the first-order optimality conditions necessary for $x^{*}$ and $y^{*}$ to be solutions of (1.2) and (2.1) respectively. The Karush-Kuhn-Tucker (KKT) conditions are also sufficient in this case because the problems are convex. The Lagrangian function for (1.2) is given by $\mathcal{L}(x,y)=\|x\|_{1}-y^{T}\\!(Ax-b);$ the KKT conditions require that $Ax=b\text{and}0\in\partial_{x}\mathcal{L}(x,y),$ (2.4) where $\partial_{x}\mathcal{L}$ denotes the subdifferential of $\mathcal{L}$ with respect to $x$. The second condition reduces to $0\in\mathop{\hbox{\rm sgn}}(x)-A^{T}\\!y,$ where the signum function $\mathop{\hbox{\rm sgn}}(\gamma)\in\begin{cases}\mathop{\hbox{\rm sign}}(\gamma)&\hbox{if $\gamma\neq 0$,}\\\ [-1,1]&\hbox{otherwise},\end{cases}$ is applied to each individual component of $x$. It follows that $x^{*}$ is a solution of (1.2) if and only if $Ax^{*}=b$ and there exists an $m$-vector $y$ such that $|a_{j}^{T}\\!y|\leq 1$ for $j\not\in\textrm{Supp}(x)$, and $a_{j}^{T}\\!y=\mathop{\hbox{\rm sign}}(x_{j}^{*})$ for all $j\in\textrm{Supp}(x)$. Fuchs [16] shows that $x^{*}$ is the unique solution of (1.2) when $[a_{j}]_{j\in\textrm{Supp}(x)}$ is full rank and, in addition, $|a_{j}^{T}\\!y|<1$ for all $j\not\in\textrm{Supp}(x)$. When the columns of $A$ are in general position (i.e., no $k+1$ columns of $A$ span the same $k-1$ dimensional hyperplane for $k\leq n$) we can weaken this condition by noting that for such $A$, the solution of (1.2) is always unique, thus making the existence of a $y$ that satisfies (2.4) for $x_{0}$ a necessary and sufficient condition for $\ell_{1}$ to recover $x_{0}$. ## 3 Recovery using sums-of-row norms Our analysis of sparse recovery for the MMV problem of recovering $X_{0}$ from $B=AX_{0}$ begins with an extension of Theorem 2.1 to recovery using the convex relaxation $\displaystyle\mathop{\hbox{minimize}}_{X}\quad\sum_{j=1}^{n}\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|\quad\mathop{\hbox{subject to}}\quad AX=B;$ (3.1) note that the norm within the summation is arbitrary. Define the row support of a matrix as $\textrm{Supp}_{\mathrm{row}}(X)=\\{j\mid\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|\neq 0\\}.$ With these definitions we have the following result. (A related result is given by Stojnic et al. [26].) ###### Theorem 3.1. Let $A$ be an $m\times n$ matrix, $k$ be a positive integer, $\mathcal{I}\subseteq\\{1,\ldots,n\\}$ be a fixed index set, and let $\|\cdot\|$ denote any vector norm. Then all $X_{0}\in\mathbb{R}^{n\times r}$ with $\textrm{Supp}_{\mathrm{row}}(X_{0})\subseteq\mathcal{I}$ can be uniquely recovered from $B=AX_{0}$ using (3.1) if and only if for all $Z$ with columns $Z^{\scalebox{0.6}{$\downarrow$}{k}}\in\textrm{Ker}(A)\setminus\\{0\\}$, $\sum_{j\in\mathcal{I}}\|Z^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|<\sum_{j\not\in\mathcal{I}}\|Z^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|.$ (3.2) ###### Proof. For the “only if” part, suppose that there is a $Z$ with columns $Z^{\scalebox{0.6}{$\downarrow$}{k}}\in\textrm{Ker}(A)\setminus\\{0\\}$ such that (3.2) does not hold. Now, choose $X^{{j}{\scalebox{0.6}{$\rightarrow$}}}=Z^{{j}{\scalebox{0.6}{$\rightarrow$}}}$ for all $j\in\mathcal{I}$ and with all remaining rows zero. Set $B=AX$. Next, define $V=X-Z$, and note that $AV=AX-AZ=AX=B$. The construction of $V$ implies that $\sum_{j}\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|\geq\sum_{j}\|V^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|$, and consequently $X$ cannot be the unique solution of (3.1). Conversely, let $X$ be an arbitrary matrix with $\textrm{Supp}_{\mathrm{row}}(X)\subseteq\mathcal{I}$, and let $B=AX$. To show that $X$ is the unique solution of (3.1) it suffices to show that for any $Z$ with columns $Z^{\scalebox{0.6}{$\downarrow$}{k}}\in\textrm{Ker}(A)\setminus\\{0\\}$, $\sum_{j}\|(X+Z)^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|>\sum_{j}\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|.$ This is equivalent to $\sum_{j\not\in\mathcal{I}}\|Z^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|+\sum_{j\in\mathcal{I}}\|(X+Z)^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|-\sum_{j\in\mathcal{I}}\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|>0.$ Applying the reverse triangle inequality, $\|a+b\|-\|b\|\geq-\|a\|$, to the summation over $j\in\mathcal{I}$ and reordering exactly gives condition (3.2). ∎ In the special case of the sum of $\ell_{1}$-norms, i.e., $\ell_{1,1}$, summing the norms of the columns is equivalent to summing the norms of the rows. As a result, (3.1) can be written as $\displaystyle\mathop{\hbox{minimize}}_{X}\quad\sum_{k=1}^{r}\|X^{\scalebox{0.6}{$\downarrow$}{k}}\|_{1}\quad\mathop{\hbox{subject to}}\quad AX^{\scalebox{0.6}{$\downarrow$}{k}}=B^{\scalebox{0.6}{$\downarrow$}{k}},\quad k=1,\ldots,r.$ Because this objective is separable, the problem can be decoupled and solved as a series of independent basis pursuit problems, giving one $X^{\scalebox{0.6}{$\downarrow$}{k}}$ for each column $B^{\scalebox{0.6}{$\downarrow$}{k}}$ of $B$. The following result relates recovery using the sum-of-norms formulation (3.1) to $\ell_{1,1}$ recovery. ###### Theorem 3.2. Let $A$ be an $m\times n$ matrix, $r$ be a positive integer, $\mathcal{I}\subseteq\\{1,\ldots,n\\}$ be a fixed index set, and $\|\cdot\|$ denote any vector norm. Then uniform recovery of all $X\in\mathbb{R}^{n\times r}$ with $\textrm{Supp}_{\mathrm{row}}(X)\subseteq\mathcal{I}$ using sums of norms (3.1) implies uniform recovery on $\mathcal{I}$ using $\ell_{1,1}$. ###### Proof. For uniform recovery on support $\mathcal{I}$ to hold it follows from Theorem 3.1 that for any matrix $Z$ with columns $Z^{\scalebox{0.6}{$\downarrow$}{k}}\in\textrm{Ker}(A)\setminus\\{0\\}$, property (3.2) holds. In particular it holds for $Z$ with $Z^{\scalebox{0.6}{$\downarrow$}{k}}={\bar{z\mkern 2.8mu}\mkern-2.8mu}{}$ for all $k$, with ${\bar{z\mkern 2.8mu}\mkern-2.8mu}{}\in\textrm{Ker}(A)\setminus\\{0\\}$. Note that for these matrices there exist a norm-dependent constant $\gamma$ such that $|{\bar{z\mkern 2.8mu}\mkern-2.8mu}{}_{j}|=\gamma\|Z^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|.$ Since the choice of ${\bar{z\mkern 2.8mu}\mkern-2.8mu}{}$ was arbitrary, it follows from (3.2) that the NS-condition (2.3) for independent recovery of vectors $B^{\scalebox{0.6}{$\downarrow$}{k}}$ using $\ell_{1}$ in Theorem 2.1 is satisfied. Moreover, because $\ell_{1,1}$ is equivalent to independent recovery, we also have uniform recovery on $\mathcal{I}$ using $\ell_{1,1}$. ∎ An implication of Theorem 3.2 is that the use of restricted isometry conditions—or any technique, for that matter—to analyze uniform recovery conditions for the sum-of-norms approach necessarily lead to results that are no stronger than uniform $\ell_{1}$ recovery. (Recall that the $\ell_{1,1}$ and $\ell_{1}$ norms are equivalent). ### 3.1 Recovery using $\ell_{1,2}$ Figure 1: Recovery rates for fixed, randomly drawn $20\times 60$ matrices $A$, averaged over 1,000 trials at each row-sparsity level $s$. The nonzero entries in the $60\times r$ matrix $X_{0}$ are sampled i.i.d. from the normal distribution. The solid and dashed lines represent $\ell_{1,2}$ and $\ell_{1,1}$ recovery, respectively. In this section we take a closer look at the $\ell_{1,2}$ problem $\displaystyle\mathop{\hbox{minimize}}_{X}\quad\|X\|_{1,2}\quad\mathop{\hbox{subject to}}\quad AX=B,$ (3.3) which is a special case of the sum-of-norms problem. Although Theorem 3.2 establishes that uniform recovery via $\ell_{1,2}$ is no better than uniform recovery via $\ell_{1,1}$, there are many situations in which it recovers signals that $\ell_{1,1}$ cannot. Indeed, it is evident from Figure 1 that the probability of recovering individual signals with random signs and support is much higher for $\ell_{1,2}$. The reason for the degrading performance or $\ell_{1,1}$ with increasing $k$ is explained in Section 4. In this section we construct examples for which $\ell_{1,2}$ works and $\ell_{1,1}$ fails, and vice versa. This helps uncover some of the structure of $\ell_{1,2}$, but at the same time implies that certain techniques used to study $\ell_{1}$ can no longer be used directly. Because the examples are based on extensions of the results from Section 2.3, we first develop equivalent conditions here. #### 3.1.1 Sufficient conditions for recovery via $\ell_{1,2}$ The optimality conditions of the $\ell_{1,2}$ problem (3.3) play a vital role in deriving a set of sufficient conditions for joint-sparse recovery. In this section we derive the dual of (3.3) and the corresponding necessary and sufficient optimality conditions. These allow us to derive sufficient conditions for recovery via $\ell_{1,2}$. The Lagrangian for (3.3) is defined as $\mathcal{L}(X,Y)=\|X\|_{1,2}-\Braket{Y,AX-B},$ (3.4) where $\Braket{V,W}\mathrel{\mathop{:}}=\mathop{\hbox{\rm trace}}(V^{T}\\!W)$ is an inner-product defined over real matrices. The dual is then given by maximizing $\inf_{X}\mathcal{L}(X,Y)=\inf_{X}\left\\{\|X\|_{1,2}-\Braket{Y,AX-B}\right\\}=\Braket{B,Y}-\sup_{X}\left\\{\Braket{A^{T}\\!Y,X}-\|X\|_{1,2}\right\\}$ (3.5) over $Y$. (Because the primal problem has only linear constraints, there necessarily exists a dual solution $Y^{*}$ that maximizes this expression [25, Theorem 28.2].) To simplify the supremum term, we note that for any convex, positively homogeneous function $f$ defined over an inner-product space, $\sup_{v}\ \\{\Braket{w,v}-f(v)\\}=\begin{cases}0&\hbox{if $w\in\partial f(0)$,}\\\ \infty&\hbox{otherwise.}\end{cases}$ To derive these conditions, note that positive homogeneity of $f$ implies that $f(0)=0$, and thus $w\in\partial f(0)$ implies that $\Braket{w,v}\leq f(v)$ for all $v$. Hence, the supremum is achieved with $v=0$. If on the other hand $w\not\in\partial f(0)$, then there exists some $v$ such that $\Braket{w,v}>f(v)$, and by the positive homogeneity of $f$, $\Braket{w,\alpha v}-f(\alpha v)\to\infty$ as $\alpha\to\infty$. Applying this expression for the supremum to (3.5), we arrive at the necessary condition $A^{T}\\!Y\in\partial\|0\|_{1,2},$ (3.6) which is required for dual feasibility. We now derive an expression for the subdifferential $\partial\|X\|_{1,2}$. For rows $j$ where $\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}>0$, the gradient is given by $\nabla\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}=X^{{j}{\scalebox{0.6}{$\rightarrow$}}}/\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}$. For the remaining rows, the gradient is not defined, but $\partial\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}$ coincides with the set of unit $\ell_{2}$-norm vectors $\mathcal{B}_{\ell_{2}}^{r}=\\{v\in\mathbb{R}^{r}\ \mid\|v\|_{2}\leq 1\\}$. Thus, for each $j=1,\ldots,n$, $\partial_{X^{{j}{\scalebox{0.6}{$\rightarrow$}}}}\|X\|_{1,2}\in\begin{cases}X^{{j}{\scalebox{0.6}{$\rightarrow$}}}/\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}&\hbox{if $\|X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}>0$,}\\\\[4.0pt] \mathcal{B}_{\ell_{2}}^{r}&\hbox{otherwise.}\end{cases}$ (3.7) Combining this expression with (3.6), we arrive at the dual of (3.3): $\displaystyle\mathop{\hbox{maximize}}_{Y}\quad\mathop{\hbox{\rm trace}}(B^{T}\\!Y)\quad\mathop{\hbox{subject to}}\quad\|A^{T}\\!Y\|_{\infty,2}\leq 1.$ (3.8) The following conditions are therefore necessary and sufficient for a primal- dual pair $(X^{*},Y^{*})$ to be optimal for (3.3) and its dual (3.8): $\displaystyle AX^{*}$ $\displaystyle=B$ (primal feasibility); (3.9a) $\displaystyle\|A^{T}\\!Y^{*}\|_{\infty,2}$ $\displaystyle\leq 1$ (dual feasibility); (3.9b) $\displaystyle\|X^{*}\|_{1,2}$ $\displaystyle=\mathop{\hbox{\rm trace}}(B^{T}\\!Y^{*})$ (zero duality gap). (3.9c) The existence of a matrix $Y^{*}$ that satisfies (3.9) provides a certificate that the feasible matrix $X^{*}$ is an optimal solution of (3.3). However, it does not guarantee that $X^{*}$ is also the unique solution. The following theorem gives sufficient conditions, similar to those in Section 2.3, that also guarantee uniqueness of the solution. ###### Theorem 3.3. Let $A$ be an $m\times n$ matrix, and $B$ be an $m\times r$ matrix. Then a set of sufficient conditions for $X$ to be the unique minimizer of (3.3) with Lagrange multiplier $Y\in\mathbb{R}^{m\times r}$ and row support $\mathcal{I}=\textrm{Supp}_{\mathrm{row}}(X)$, is that $\displaystyle AX=B,$ (3.10a) $\displaystyle(A^{T}\\!Y)^{\scalebox{0.6}{$\downarrow$}{j}}=(X^{*})^{{j}{\scalebox{0.6}{$\rightarrow$}}}/\|(X^{*})^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2},$ $\displaystyle\qquad j$ $\displaystyle\in\mathcal{I}$ (3.10b) $\displaystyle\|(A^{T}\\!Y)^{\scalebox{0.6}{$\downarrow$}{j}}\|_{2}<1,$ $\displaystyle\qquad j$ $\displaystyle\not\in\mathcal{I}$ (3.10c) $\displaystyle\mathop{\hbox{\rm rank}}(A_{\mathcal{I}})=|\mathcal{I}|.$ (3.10d) ###### Proof. The first three conditions clearly imply that $(X,Y)$ primal and dual feasible, and thus satisfy (3.9a) and (3.9b). Conditions (3.10b) and (3.10c) together imply that $\mathop{\hbox{\rm trace}}(B^{T}\\!Y)\equiv\sum_{j=1}^{n}[(A^{T}\\!Y)^{\scalebox{0.6}{$\downarrow$}{j}}]^{T}X^{{j}{\scalebox{0.6}{$\rightarrow$}}}=\sum_{j=1}^{n}X^{{j}{\scalebox{0.6}{$\rightarrow$}}}\equiv\|X\|_{1,2}.$ The first and last identities above follow directly from the definitions of the matrix trace and of the norm $\|\cdot\|_{1,2}$, respectively; the middle equality follows from the standard Cauchy inequality. Thus, the zero-gap requirement (3.9c) is satisfied. The conditions (3.10a)–(3.10c) are therefore sufficient for $(X,Y)$ to be an optimal primal-dual solution of (3.3). Because $Y$ determines the support and is a Lagrange multiplier for every solution $X$, this support must be unique. It then follows from condition (3.10d) that $X$ must be unique. ∎ ### 3.2 Counter examples Using the sufficient and necessary conditions developed in the previous section we now construct examples of problems for which $\ell_{1,2}$ succeeds while $\ell_{1,1}$ fails, and vice versa. Because of its simplicity, we begin with the latter. ##### Recovery using $\ell_{1,1}$ where $\ell_{1,2}$ fails. Let $A$ be an $m\times n$ matrix with $m<n$ and unit-norm columns that are not scalar multiples of each other. Take any vector $x\in\mathbb{R}^{n}$ with at least $m+1$ nonzero entries. Then $X_{0}=\mathop{\hbox{\rm diag}}(x)$, possibly with all identically zero columns removed, can be recovered from $B=AX_{0}$ using $\ell_{1,1}$, but not with $\ell_{1,2}$. To see why, note that each column in $X_{0}$ has only a single nonzero entry, and that, under the assumptions on $A$, each one-sparse vector can be recovered individually using $\ell_{1}$ (the points $\pm A^{\scalebox{0.6}{$\downarrow$}{j}}\in\mathbb{R}^{m}$ are all $0$-faces of $\mathcal{P}$) and therefore that $X_{0}$ can be recovered using $\ell_{1,1}$. On the other hand, for recovery using $\ell_{1,2}$ there would need to exist a matrix $Y$ satisfying the first condition of (3.9) for all $j\in\mathcal{I}=\\{1,\ldots,n\\}$. For this given $X_{0}$ this reduces to $A^{T}Y=M$, where $M$ is the identity matrix, with the same columns removed as $X$. But this equality is impossible to satisfy because $\mathop{\hbox{\rm rank}}(A)\leq m<m+1\leq\mathop{\hbox{\rm rank}}(M)$. Thus, $X_{0}$ cannot be the solution of the $\ell_{1,2}$ problem (3.3). ##### Recovery using $\ell_{1,2}$ where $\ell_{1,1}$ fails. For the construction of a problem where $\ell_{1,2}$ succeeds and $\ell_{1,1}$ fails, we consider two vectors, $f$ and $s$, with the same support $\mathcal{I}$, in such a way that individual $\ell_{1}$ recovery fails for $f$, while it succeeds for $s$. In addition we assume that there exists a vector $y$ that satisfies $y^{T}\\!A^{\scalebox{0.6}{$\downarrow$}{j}}=\mathop{\hbox{\rm sign}}(s_{j})\quad\hbox{for all $j\in\mathcal{I}$,}\hbox{\qquad and\qquad}|y^{T}\\!A^{\scalebox{0.6}{$\downarrow$}{j}}|<1\quad\hbox{for all $j\not\in\mathcal{I}$;}$ i.e., $y$ satisfies conditions (3.10b) and (3.10c). Using the vectors $f$ and $s$, we construct the 2-column matrix $X_{0}=[(1-\gamma)s,\ \gamma f]$, and claim that for sufficiently small $\gamma>0$, this gives the desired reconstruction problem. Clearly, for any $\gamma\neq 0$, $\ell_{1,1}$ recovery fails because the second column can never be recovered, and we only need to show that $\ell_{1,2}$ does succeed. For $\gamma=0$, the matrix $Y=[y,0]$ satisfies conditions (3.10b) and (3.10c) and, assuming (3.10d) is also satisfied, $X_{0}$ is the unique solution of $\ell_{1,2}$ with $B=AX_{0}$. For sufficiently small $\gamma>0$, the conditions that $Y$ need to satisfy change slightly due to the division by $\|X_{0}^{{j}{\scalebox{0.6}{$\rightarrow$}}}\|_{2}$ for those rows in $\textrm{Supp}_{\mathrm{row}}(X)$. By adding corrections to the columns of $Y$ those new conditions can be satisfied. In particular, these corrections can be done by adding weighted combinations of the columns in $\bar{Y}$, which are constructed in such a way that it satisfies $A_{\mathcal{I}}^{T}{\bar{Y\mkern 2.0mu}\mkern-2.0mu}{}=I$, and minimizes $\|A_{\mathcal{I}^{c}}^{T}\bar{Y}\|_{\infty,\infty}$ on the complement $\mathcal{I}^{c}$ of $\mathcal{I}$. Note that on the above argument can also be used to show that $\ell_{1,2}$ fails for $\gamma$ sufficiently close to one. Because the support and signs of $X$ remain the same for all $0<\gamma<1$, we can conclude the following: ###### Corollary 3.4. Recovery using $\ell_{1,2}$ is generally not only characterized by the row- support and the sign pattern of the nonzero entries in $X_{0}$, but also by the magnitude of the nonzero entries. A consequence of this conclusion is that the notion of faces used in the geometrical interpretation of $\ell_{1}$ is not applicable to the $\ell_{1,2}$ problem. ### 3.3 Experiments To get an idea of just how much more $\ell_{1,2}$ can recover in the above case where $\ell_{1,1}$ fails, we generated a $20\times 60$ matrix $A$ with entries i.i.d. normally distributed, and determined a set of vectors $s_{i}$ and $f_{i}$ with identical support for which $\ell_{1}$ recovery succeeds and fails, respectively. Using triples of vectors $s_{i}$ and $f_{j}$ we constructed row-sparse matrices such as $X_{0}=[s_{1},f_{1},f_{2}]$ or $X_{0}=[s_{1},s_{2},f_{2}]$, and attempted to recover from $B=AX_{0}W$, where $W=\mathop{\hbox{\rm diag}}(\omega_{1},\omega_{2},\omega_{3})$ is a diagonal weighting matrix with nonnegative entries and unit trace, by solving (3.3). For problems of this size, interior-point methods are very efficient and we use SDPT3 [30] through the CVX interface [18, 17]. We consider $X_{0}$ to be recovered when the maximum absolute difference between $X_{0}$ and the $\ell_{1,2}$ solution $X^{*}$ is less than $10^{-5}$. The results of the experiment are shown in Figure 2. In addition to the expected regions of recovery around individual columns $s_{i}$ and failure around $f_{i}$, we see that certain combinations of vectors $s_{i}$ still fail, while other combinations of vectors $f_{i}$ may be recoverable. By contrast, when using $\ell_{1,1}$ to solve the problem, any combination of $s_{i}$ vectors can be recovered while no combination including an $f_{i}$ can be recovered. | | | ---|---|---|--- $|\mathcal{I}|=5$ | $|\mathcal{I}|=5$ | $|\mathcal{I}|=5$ | $|\mathcal{I}|=7$ | | | $|\mathcal{I}|=10$ | $|\mathcal{I}|=10$ | $|\mathcal{I}|=10$ | $|\mathcal{I}|=10$ Figure 2: Generation of problems where $\ell_{1,2}$ succeeds, while $\ell_{1,1}$ fails. For a $20\times 60$ matrix $A$ and fixed support of size $|\mathcal{I}|=5,7,10$, we create vectors $f_{i}$ that cannot be recovered using $\ell_{1}$, and vectors $s_{i}$ than can be recovered. Each triangle represents an $X_{0}$ constructed from the vectors denoted in the corners. The location in the triangle determines the weight on each vector, ranging from zero to one, and summing up to one. The dark areas indicates the weights for which $\ell_{1,2}$ successfully recovered $X_{0}$. ## 4 Boosted $\ell_{1}$ As described in Section 3, recovery using $\ell_{1,1}$ is equivalent to individual $\ell_{1}$ recovery of each column $x_{k}:=X_{0}^{\scalebox{0.6}{$\downarrow$}{k}}$ based on $b_{k}\mathrel{\mathop{:}}=B^{\scalebox{0.6}{$\downarrow$}{k}}$, for $k=1,\ldots,r$: $\displaystyle\mathop{\hbox{minimize}}_{x}\quad\|x\|_{1}\quad\mathop{\hbox{subject to}}\quad Ax=b_{k}.$ (4.1) Assuming that the signs of nonzero entries in the support of each $x_{k}$ are drawn i.i.d. from $\\{1,-1\\}$, we can express the probability of recovering a matrix $X_{0}$ with row support $\mathcal{I}$ using $\ell_{1,1}$ in terms of the probability of recovering vectors on that support using $\ell_{1}$. To see how, note that $\ell_{1,1}$ recovers the original $X_{0}$ if and only if each individual problem in (4.1) successfully recovers each $x_{k}$. For the above class of matrices $X_{0}$ this therefore gives a recovery rate of $P_{\ell_{1,1}}(A,\mathcal{I},k)=\left[P_{\ell_{1}}(A,\mathcal{I})\right]^{r}.$ Using $\ell_{1,1}$ to recover $X_{0}$ is clearly not a good idea. Note also that uniform recovery of $X_{0}$ on a support $\mathcal{I}$ remains unchanged, regardless of the number of observations, $r$, that are given. As a consequence of Theorem 3.2, this also means that the uniform-recovery properties for any sum-of-norms approach cannot increase with $r$. This clearly defeats the purpose of gathering multiple observations. In many instances where $\ell_{1,1}$ fails, it may still recover a subset of columns $x_{k}$ from the corresponding observations $b_{k}$. It seems wasteful to discard this information because if we could recognize a single correctly recovered $x_{k}$, we would immediately know the row support $\mathcal{I}=\textrm{Supp}_{\mathrm{row}}(X_{0})=\textrm{Supp}(x_{k})$ of $X_{0}$. Given the correct support we can recover the nonzero part $\bar{X}$ of $X_{0}$ by solving $\displaystyle\mathop{\hbox{minimize}}_{\bar{X}}\quad\|A_{\mathcal{I}}\bar{X}-B\|_{F}.$ (4.2) In practice we obviously do not know the correct support, but when a given solution $x_{k}^{*}$ of (4.1) that is sufficiently sparse, we can try to solve (4.2) for that support and verify if the residual at the solution is zero. If so, we construct the final $X^{*}$ using the non-zero part and declare success. Otherwise we simply increment $k$ and repeat this process until there are no more observations and recovery was unsuccessful. We refer to this algorithm, which is reminiscent of the ReMBo approach [23], as boosted $\ell_{1}$; its sole aim is to provide a bridge to the analysis of ReMBo. The complete boosted $\ell_{1}$ algorithm is outlined in Figure 4. The recovery properties of the boosted $\ell_{1}$ approach are opposite from those of $\ell_{1,1}$: it fails only if all individual columns fail to be recovered using $\ell_{1}$. Hence, given an unknown $n\times r$ matrix $X$ supported on $\mathcal{I}$ with its sign pattern uniformly random, the boosted $\ell_{1}$ algorithm gives an expected recovery rate of $P_{\ell_{1}^{B}}(A,\mathcal{I},r)=1-\left[1-P_{\ell_{1}}(A,\mathcal{I})\right]^{r}.$ (4.3) To experimentally verify this recovery rate, we generated a $20\times 80$ matrix $A$ with entries independently sampled from the normal distribution and fixed a randomly chosen support set $\mathcal{I}_{s}$ for three levels of sparsity, $s=8,9,10$. On each of these three supports we generated vectors with all possible sign patterns and solved (1.2) to see if they could be recovered or not (see Section 3.3). This gives exactly the face counts required to compute the $\ell_{1}$ recovery probability in (2.2), and the expected boosted $\ell_{1}$ recovery rate in (4.3) For the empirical success rate we take the average over 1,000 trials with random coefficient matrices $X$ supported on $\mathcal{I}_{s}$, and its nonzero entries independently drawn from the normal distribution. To reduce the computational time we avoid solving $\ell_{1}$ and instead compare the sign pattern of the current solution $x_{k}$ against the information computed to determine the face counts (both $A$ and $\mathcal{I}_{s}$ remain fixed). The theoretical and empirical recovery rates using boosted $\ell_{1}$ are plotted in Figure 4. given $A$, $B$ for _$k=1,\ldots,r$_ do solve (1.2) with $b_{k}=B^{\scalebox{0.6}{$\downarrow$}{k}}$ to get $x$ $\mathcal{I}\leftarrow\textrm{Supp}(x)$ if _$|\mathcal{I}| <m/2$_ then solve (4.2) to get $X$ if _$A_{\mathcal{I}}X=B$_ then $X^{*}=0$ $(X^{*})^{{j}{\scalebox{0.6}{$\rightarrow$}}}\leftarrow X^{{j}{\scalebox{0.6}{$\rightarrow$}}}$ for $j\in\mathcal{I}$ return solution $X^{*}$ return failure | ---|--- Figure 3: The boosted $\ell_{1}$ algorithm | Figure 4: Theoretical (dashed) and experimental (solid) performance of boosted $\ell_{1}$ for three problem instances with different row support $s$. ## 5 Recovery using ReMBo The boosted $\ell_{1}$ approach can be seen as a special case of the ReMBo [23] algorithm. ReMBo proceeds by taking a random vector $w\in\mathbb{R}^{r}$ and combining the individual observations in $B$ into a single weighted observation $b\mathrel{\mathop{:}}=Bw$. It then solves a single measurement vector problem $Ax=b$ for this $b$ (we shall use $\ell_{1}$ throughout) and checks if the computed solution $x^{*}$ is sufficiently sparse. If not, the above steps are repeated with a different weight vector $w$; the algorithm stops when a maximum number of trials is reached. If the support $\mathcal{I}$ of $x^{*}$ is small, we form $A_{\mathcal{I}}=[A^{\scalebox{0.6}{$\downarrow$}{j}}]_{j\in\mathcal{I}}$, and check if (4.2) has a solution $\bar{X}$ with zero residual. If this is the case we have the nonzero rows of the solution $X^{*}$ in $\bar{X}$ and are done. Otherwise, we simply proceed with the next $w$. The ReMBo algorithm reduces to boosted $\ell_{1}$ by limiting the number of iterations to $r$ and choosing $w=e_{i}$ in the $i$th iteration. We summarize the ReMBo-$\ell_{1}$ algorithm in Figure 6. The formulation given in [23] requires a user-defined threshold on the cardinality of the support $\mathcal{I}$ instead of the fixed threshold $m/2$. Ideally this threshold should be half of the spark [12] of A, where $\textrm{Spark}(A)\mathrel{\mathop{:}}=\min_{z\in\textrm{Ker}(A)\setminus\\{0\\}}\ \|z\|_{0}$ which is the number of nonzeros of the sparsest vector in the kernel of $A$; any vector $x_{0}$ with fewer than $\textrm{Spark}(A)/2$ nonzeros is the unique sparsest solution of $Ax=Ax_{0}=b$ [12]. Unfortunately, the spark is prohibitively expensive to compute, but under the assumption that $A$ is in general position, $\textrm{Spark}(A)=m+1$. Note that choosing a higher value can help to recover signals with row sparsity exceeding $m/2$. However, in this case it can no longer be guaranteed to be the sparsest solution. given $A$, $B$. Set $\mathrm{Iteration}\leftarrow 0$ while _$\mathrm{Iteration} <\mathrm{MaxIteration}$_ do $w\leftarrow\mathrm{Random}(n,1)$ solve (1.2) with $b=Bw$ to get $x$ $\mathcal{I}\leftarrow\textrm{Supp}(x)$ if _$|\mathcal{I}| <m/2$_ then solve (4.2) to get $X$ if _$A_{\mathcal{I}}X=B$_ then $X^{*}=0$ $(X^{*})^{{j}{\scalebox{0.6}{$\rightarrow$}}}\leftarrow X^{{j}{\scalebox{0.6}{$\rightarrow$}}}$ for $j\in\mathcal{I}$ return solution $X^{*}$ $\mathrm{Iteration}\leftarrow\mathrm{Iteration}+1$ return failure | ---|--- Figure 5: The ReMBo-$\ell_{1}$ algorithm | Figure 6: Theoretical performance model for ReMBo on three problem instances with different sparsity levels $s$. To derive the performance analysis of ReMBo, we fix a support $\mathcal{I}$ of cardinality $s$, and consider only signals with nonzero entries on this support. Each time we multiply $B$ by a weight vector $w$, we in fact create a new problem with an $s$-sparse solution $x_{0}=X_{0}w$ corresponding with a right-hand side $b=Bw=AX_{0}w=Ax_{0}$. As reflected in (2.2), recovery of $x_{0}$ using $\ell_{1}$ depends only on its support and sign pattern. Clearly, the more sign patterns in $x_{0}$ that we can generate, the higher the probability of recovery. Moreover, due to the elimination of previously tried sign patterns, the probability of recovery goes up with each new sign pattern (excluding negation of previous sign patterns). The maximum number of sign patterns we can check with boosted $\ell_{1}$ is the number of observations $r$. The question thus becomes, how many different sign patterns we can generate by taking linear combinations of the columns in $X_{0}$? (We disregard the situation where elimination occurs and $|\textrm{Supp}(X_{0}w)|<s$.) Equivalently, we can ask how many orthants in $\mathbb{R}^{s}$ (each one corresponding to a different sign pattern) can be properly intersected by the hyperplane given by the range of the $s\times r$ matrix $\bar{X}$ consisting of the nonzero rows of $X_{0}$ (with proper we mean intersection of the interior). In Section 5.1 we derive an exact expression for the maximum number of proper orthant intersections in $\mathbb{R}^{n}$ by a hyperplane generated by $d$ vectors, denoted by $C(n,d)$. Based on the above reasoning, a good model for the recovery rate of $n\times r$ matrices $X_{0}$ with $\textrm{Supp}_{\mathrm{row}}(X_{0})=\mathcal{I}<m/2$ using ReMBo is given by $P_{\scriptscriptstyle R}(A,\mathcal{I},r)=1-\prod_{i=1}^{C(|\mathcal{I}|,r)/2}\left[1-\frac{\mathcal{F}_{\mathcal{I}}(A\mathcal{C})}{\mathcal{F}_{\mathcal{I}}(\mathcal{C})-2(i-1)}\right].$ (5.1) The term within brackets denotes the probability of failure and the fraction represents the success rate, which is given by the ratio of the number of faces $\mathcal{F}_{\mathcal{I}}(A\mathcal{C})$ that survived the mapping to the total number of faces to consider. The total number reduces by two at each trial because we can exclude the face $f$ we just tried, as well as $-f$. The factor of two in $C(|\mathcal{I}|,r)/2$ is also due to this symmetry111Henceforth we use the convention that the uniqueness of a sign pattern is invariant under negation.. This model would be a bound for the average performance of ReMBo if the sign patterns generated would be randomly sampled from the space of all sign patterns on the given support. However, because it is generated from the orthant intersections with a hyperplane, the actual pattern is highly structured. Indeed, it is possible to imagine a situation where the $(s-1)$-faces in $\mathcal{C}$ that perish in the mapping to $A\mathcal{C}$ have sign patterns that are all contained in the set generated by a single hyperplane. Any other set of sign patterns would then necessarily include some faces that survive the mapping and by trying all patterns in that set we would recover $X_{0}$. In this case, the average recovery over all $X_{0}$ on that support could be much higher than that given by (5.1). We do not yet fully understand how the surviving faces of $\mathcal{C}$ are distributed. Due to the simplicial structure of the facets of $\mathcal{C}$, we can expect the faces that perish to be partially clustered (if a $(d-2)$-face perishes, then so will the two $(d-1)$-faces whose intersection gives this face), and partially unclustered (the faces that perish while all their sub-faces survive). Note that, regardless of these patterns, recovery is guaranteed in the limit whenever the number of unique sign patterns tried exceeds half the number of faces lost, $(|\mathcal{F}_{\mathcal{I}}(\mathcal{C})|-|\mathcal{F}_{\mathcal{I}}(\mathcal{AC})|)/2$. Figure 6 illustrates the theoretical performance model based on $C(n,d)$, for which we derive the exact expression in Section 5.1. In Section 5.2 we discuss practical limitations, and in Section 5.3 we empirically look at how the number of sign patterns generated grows with the number of normally distributed vectors $w$, and how this affects the recovery rates. To allow comparison between ReMBo and boosted $\ell_{1}$, we used the same matrix $A$ and support $\mathcal{I}_{s}$ used to generate Figure 4. ### 5.1 Maximum number of orthant intersections with subspace ###### Theorem 5.1. Let $C(n,d)$ denote the maximum attainable number of orthant interiors intersected by a hyperplane in $\mathbb{R}^{n}$ generated by $d$ vectors. Then $C(n,1)=2$, $C(n,d)=2^{n}$ for $d\geq n$. In general, $C(n,d)$ is given by $C(n,d)=C(n-1,d-1)+C(n-1,d)=2\sum_{i=0}^{d-1}{n-1\choose i}.$ (5.2) ###### Proof. The number of intersected orthants is exactly equal to the number of proper sign patterns (excluding zero values) that can be generated by linear combinations of those $d$ vectors. When $d=1$, there can only be two such sign patterns corresponding to positive and negative multiples of that vector, thus giving $C(n,1)=2$. Whenever $d\geq n$, we can choose a basis for $\mathbb{R}^{n}$ and add additional vectors as needed, and we can reach all points, and therefore all $2^{n}=C(n,d)$ sign patterns. For the general case (5.2), let $v_{1},\ldots,v_{d}$ be vectors in $\mathbb{R}^{n}$ such that the affine hull with the origin, $S=\mathrm{aff}\\{0,v_{1},\ldots,v_{d}\\}$, gives a hyperplane in $\mathbb{R}^{n}$ that properly intersects the maximum number of orthants, $C(n,d)$. Without loss of generality assume that vectors $v_{i}$, $i=1,\ldots,d-1$ all have their $n$th component equal to zero. Now, let $T=\mathrm{aff}\\{0,v_{1},\ldots,v_{d-1}\\}\subseteq\mathbb{R}^{n-1}$ be the intersection of $S$ with the $(n-1)$-dimensional subspace of all points $\mathcal{X}=\\{x\in\mathbb{R}^{n}\mid x_{n}=0\\}$, and let $C_{T}$ denote the number of $(n-1)$-orthants intersected by $T$. Note that $T$ itself, as embedded in $\mathbb{R}^{n}$, does not properly intersect any orthant. However, by adding or subtracting an arbitrarily small amount of $v_{d}$, we intersect $2C_{T}$ orthants; taking $v_{d}$ to be the $n$th column of the identity matrix would suffice for that matter. Any other orthants that are added have either $x_{n}>0$ or $x_{n}<0$, and their number does not depend on the magnitude of the $n$th entry of $v_{d}$, provided it remains nonzero. Because only the first $n-1$ entries of $v_{d}$ determine the maximum number of additional orthants, the problem reduces to $\mathbb{R}^{n-1}$. In fact, we ask how many new orthants can be added to $C_{T}$ taking the affine hull of $T$ with $v$, the orthogonal projection $v_{d}$ onto $\mathcal{X}$. Since the maximum orthants for this $d$-dimensional subspace in $\mathbb{R}^{n-1}$ is given by $C(n-1,d)$, this number is clearly bounded by $C(n-1,d)-C_{T}$. Adding this to $2C_{T}$, we have $\displaystyle C(n,d)$ $\displaystyle\leq 2C_{T}+[C(n-1,d)-C_{T}]=C_{T}+C(n-1,d)$ (5.3) $\displaystyle\leq C(n-1,d-1)+C(n-1,d)$ $\displaystyle\leq 2\sum_{i=0}^{d-1}{n-1\choose i}.$ The final expression follows by expanding the recurrence relations, which generates (a part of) Pascal’s triangle, and combining this with $C(1,j)=2$ for $j\geq 1$. In the above, whenever there are free orthants in $\mathbb{R}^{n-1}$, that is, when $d<n$, we can always choose the corresponding part of $v_{d}$ in that orthant. As a consequence we have that no hyperplane supported by a set of vectors can intersect the maximum number of orthants when the range of those vectors includes some $e_{i}$. We now show that this expression holds with equality. Let $U$ denote an $(n-d)$-hyperplane in $\mathbb{R}^{n}$ that intersects the maximum $C(n,n-d)$ orthants. We now claim that in the interior of each orthant not intersected by $U$ there exists a vector that is orthogonal to $U$. If this were not the case then $T$ must be aligned with some $e_{i}$ and can therefore not be optimal. The span of these orthogonal vectors generates a $d$-hyperplane $V$ that intersects $C_{V}=2^{n}-C(n,n-d)$ orthants, and it follows that $\displaystyle C(n,d)$ $\displaystyle\geq C_{V}=2^{n}-C(n,n-d)$ $\displaystyle\geq 2^{n}-2\sum_{i=0}^{n-d-1}{n-1\choose i}=2\sum_{i=0}^{n-1}{n-1\choose i}-2\sum_{i=0}^{n-d-1}{n-1\choose i}$ $\displaystyle=2\sum_{n-d}^{n-1}{n-1\choose i}=2\sum_{i=0}^{d-1}{n-1\choose i}\geq C(n,d),$ where the last inequality follows from (5.3). Consequently, all inequalities hold with equality. ∎ ###### Corollary 5.2. Given $d\leq n$, then $C(n,d)=2^{n}-C(n,n-d)$, and $C(2d,d)=2^{2d-1}$. ###### Corollary 5.3. A hyperplane $\mathcal{H}$ in $\mathbb{R}^{n}$, defined as the range of $V=[v_{1},\ v_{2},\ldots,\ v_{d}]$, intersects the maximum number of orthants $C(n,d)$ whenever $\mathop{\hbox{\rm rank}}(V)=n$, or when $e_{i}\not\in\mathop{\hbox{\rm range}}(V)$ for $i=1,\ldots,n$. ### 5.2 Practical considerations In practice it is generally not feasible to generate all of the $C(|\mathcal{I}|,r)/2$ unique sign patterns. This means that we would have to replace this term in (5.1) by the number of unique patterns actually tried. For a given $X_{0}$ the actual probability of recovery is determined by a number of factors. First of all, the linear combinations of the columns of the nonzero part of $\bar{X}$ prescribe a hyperplane and therefore a set of possible sign patterns. With each sign pattern is associated a face in $\mathcal{C}$ that may or may not map to a face in $A\mathcal{C}$. In addition, depending on the probability distribution from which the weight vectors $w$ are drawn, there is a certain probability for reaching each sign pattern. Summing the probability of reaching those patterns that can be recovered gives the probability $P(A,\mathcal{I},X_{0})$ of recovering with an individual random sample $w$. The probability of recovery after $t$ trials is then of the form $1-[1-P(A,\mathcal{I},X_{0})]^{t}.$ To attain a certain sign pattern $\bar{e}$, we need to find an $r$-vector $w$ such that $\mathop{\hbox{\rm sign}}(\bar{X}w)=\bar{e}$. For a positive sign on the $j$th position of the support we can take any vector $w$ in the open halfspace $\\{w\mid\bar{X}^{{j}{\scalebox{0.6}{$\rightarrow$}}}w>0\\}$, and likewise for negative signs. The region of vectors $w$ in $\mathbb{R}^{r}$ that generates a desired sign pattern thus corresponds to the intersection of $|\mathcal{I}|$ open halfspaces. The measure of this intersection as a fraction of $\mathbb{R}^{r}$ determines the probability of sampling such a $w$. To formalize, define $\mathcal{K}$ as the cone generated by the rows of $-\mathop{\hbox{\rm diag}}(\bar{e})\bar{X}$, and the unit Euclidean $(k-1)$-sphere $\mathcal{S}^{k-1}=\\{x\in\mathbb{R}^{r}\mid\|x\|_{2}=1\\}$. The intersection of halfspaces then corresponds to the interior of the polar cone of $\mathcal{K}$: $\mathcal{K}^{\circ}=\\{x\in\mathbb{R}^{r}\mid x^{T}\\!y\leq 0,\ \forall y\in\mathcal{K}\\}$. The fraction of $\mathbb{R}^{r}$ taken up by $\mathcal{K}^{\circ}$ is given by the $(k-1)$-content of $\mathcal{S}^{k-1}\cap\mathcal{K}^{\circ}$ to the $(k-1)$-content of $\mathcal{S}^{k-1}$ [21]. This quantity coincides precisely with the definition of the external angle of $\mathcal{K}$ at the origin. ### 5.3 Experiments In this section we illustrate the theoretical results from Section 5 and examine some practical considerations that affect the performance of ReMBo. For all experiments that require the matrix $A$, we use the same $20\times 80$ matrix that was used in Section 4, and likewise for the supports $\mathcal{I}_{s}$. To solve (1.2), we again use CVX in conjunction with SDPT3. We consider $x_{0}$ to be recovered from $b=Ax_{0}=AX_{0}w$ if $\|x^{*}-x_{0}\|_{\infty}\leq 10^{-5}$, where $x^{*}$ is the computed solution. The experiments that are concerned with the number of unique sign patterns generated depend only on the $s\times r$ matrix $\bar{X}$ representing the nonzero entries of $X_{0}$. Because an initial reordering of the rows does not affect the number of patterns, those experiments depend only on $\bar{X}$, $s=|\mathcal{I}|$, and the number of observations $r$; the exact indices in the support set $\mathcal{I}$ are irrelevant for those tests. #### 5.3.1 Generation of unique sign patterns The practical performance of ReMBo depends on its ability to generate as many different sign patterns using the columns in $X_{0}$ as possible. A natural question to ask then is how the number of such patterns grows with the number of randomly drawn samples $w$. Although this ultimately depends on the distribution used for generating the entries in $w$, we shall, for sake of simplicity, consider only samples drawn from the normal distribution. As an experiment we take a $10\times 5$ matrix $\bar{X}$ with normally-distributed entries, and over $10^{8}$ trials record how often each sign-pattern (or negation) was reached, and in which trial they were first encountered. The results of this experiment are summarized in Figure 7. From the distribution in Figure 7(b) it is clear that the occurrence levels of different orthants exhibits a strong bias. The most frequently visited orthant pairs were reached up to $7.3\times 10^{6}$ times, while others, those hard to reach using weights from the normal distribution, were observed only four times over all trials. The efficiency of ReMBo depends on the rate of encountering new sign patterns. Figure 7(c) shows how the average rate changes over the number of trials. The curves in Figure 7(d) illustrate the theoretical probability of recovery in (5.1), with $C(n,d)/2$ replaced by the number of orthant pairs at a given iteration, and with face counts determined as in Section 4, for three instances with support cardinality $s=10$, and observations $r=5$. | ---|--- (a) | (b) | (c) | (d) Figure 7: Sampling the sign patterns for a $10\times 5$ matrix $\bar{X}$, with (a) number of unique sign patterns versus number of trials, (b) relative frequency with which each orthant is sampled, (c) average number of new sign patterns per iteration as a function of iterations, and (d) theoretical probability of recovery using ReMBo for three instances of $X_{0}$ with row sparsity $s=10$, and $r=5$ observations. #### 5.3.2 Role of $\bar{X}$. Although the number of orthants that a hyperplane can intersect does not depend on the basis with which it was generated, this choice does greatly influence the ability to sample those orthants. Figure 8 shows two ways in which this can happen. In part (a) we sampled the number of unique sign patterns for two different $9\times 5$ matrices $\bar{X}$, each with columns scaled to unit $\ell_{2}$-norm. The entries of the first matrix were independently drawn from the normal distribution, while those in the second were generated by repeating a single column drawn likewise and adding small random perturbations to each entry. This caused the average angle between any pair of columns to decrease from $65$ degrees in the random matrix to a mere $8$ in the perturbed matrix, and greatly reduces the probability of reaching certain orthants. The same idea applies to the case where $d\geq n$, as shown in part (b) of the same figure. Although choosing $d$ greater than $n$ does not increase the number of orthants that can be reached, it does make reaching them easier, thus allowing ReMBo to work more efficiently. Hence, we can expect ReMBo to have higher recovery on average when the number of columns in $X_{0}$ increases and when they have a lower mutual coherence $\mu(X)=\min_{i\neq j}|x_{i}^{T}x_{j}|/(\|x_{i}\|_{2}\cdot\|x_{j}\|_{2})$. | ---|--- (a) | (b) Figure 8: Number of unique sign patterns for (a) two $9\times 5$ matrices $\bar{X}$ with columns scaled to unit $\ell_{2}$-norm; one with entries drawn independently from the normal distribution, and one with a single random column repeated and random perturbations added, and (b) $10\times r$ matrices with $r=10,12,15$. #### 5.3.3 Limiting the number of iterations The number of iterations used in the previous experiments greatly exceeds that what is practically feasible: we cannot afford to run ReMBo until all possible sign patterns have been tried, even if there was a way detect that the limit had been reached. Realistically, we should set the number of iterations to a fixed maximum that depends on the computational resources available, and the problem setting. In Figure 7 we show the unique orthant count as a function of iterations and the predicted recovery rate. When using only a limited number of iterations it is interesting to know what the distribution of unique orthant counts looks like. To find out, we drew 1,000 random $\bar{X}$ matrices for each size $s\times r$, with $s=10$ nonzero rows fixed, and the number of columns ranging from $r=1,\ldots,20$. For each $\bar{X}$ we counted the number of unique sign patterns attained after respectively 1,000 and 10,000 iterations. The resulting minimum, maximum, and median values are plotted in Figure 9(a) along with the theoretical maximum. More interestingly of course is the average recovery rate of ReMBo with those number of iterations. For this test we again used the $20\times 80$ matrix $A$ with predetermined support $\mathcal{I}$, and with success or failure of each sign pattern on that support precomputed. For each value of $r=1,\ldots,20$ we generated random matrices $X$ on $\mathcal{I}$ and ran ReMBo with the maximum number of iterations set to 1,000 and 10,000. To save on computing time, we compared the on-support sign pattern of each combined coefficient vector $Xw$ to the known results instead of solving $\ell_{1}$. The average recovery rate thus obtained is plotted in Figures 9(b)–(c), along with the average of the predicted performance using (5.1) with $C(n,d)/2$ replaced by orthant counts found in the previous experiment. | | ---|---|--- (a) | (b) | (c) Figure 9: Effect of limiting the number of weight vectors $w$ on (a) the distribution of unique orthant counts for $10\times k$ random matrices $\bar{X}$, solid lines give the median number and the dashed lines indicate the minimum and maximum values, the top solid line is the theoretical maximum; (b–c) the average performance of the ReMBo-$\ell_{1}$ algorithm (solid) for fixed $20\times 80$ matrix $A$ and three different support sizes $r=8,9,10$, along with the average predicted performance (dashed). The support patterns used are the same as those used for Figure 4. ## 6 Conclusions The MMV problem is often solved by minimizing the sum-of-row norms of the unknown coefficients $X$. We show that the (local) uniform recovery properties, i.e., recovery of all $X_{0}$ with a fixed row support $\mathcal{I}=\textrm{Supp}_{\mathrm{row}}(X_{0})$, cannot exceed that of $\ell_{1,1}$, the sum of $\ell_{1}$ norms. This is despite the fact that $\ell_{1,1}$ reduces to solving the basis pursuit problem (1.2) for each column separately, which does not take advantage of the fact that all vectors in $X_{0}$ are assumed to have the same support. A consequence of this observation is that the use of restricted isometry techniques to analyze (local) uniform recovery using sum-of-norm minimization can at best give improved bounds on $\ell_{1}$ recovery. Empirically, minimization with $\ell_{1,2}$, the sum of $\ell_{2}$ norms, clearly outperforms $\ell_{1,1}$ on individual problem instances: for supports where uniform recovery fails, $\ell_{1,2}$ recovers more cases than $\ell_{1,1}$. We construct cases where $\ell_{1,2}$ succeeds while $\ell_{1,1}$ fails, and vice versa. From the construction where only $\ell_{1,2}$ succeeds it also follows that the relative magnitudes of the coefficients in $X_{0}$ matter for recovery. This is unlike $\ell_{1,1}$ recovery, where only the support and the sign patterns matter. This implies that the notion of faces, so useful in the analysis of $\ell_{1}$, disappears. We show that the performance of $\ell_{1,1}$ outside the uniform-recovery regime degrades rapidly as the number of observations increases. We can turn this situation around, and increase the performance with the number of observations by using a boosted-$\ell_{1}$ approach. This technique aims to uncover the correct support based on basis pursuit solutions for individual observations. Boosted-$\ell_{1}$ is a special case of the ReMBo algorithm which repeatedly takes random combinations of the observations, allowing it to sample many more sign patterns in the coefficient space. As a result, the potential recovery rates of ReMBo (at least in combination with an $\ell_{1}$ solver) are a much higher than boosted-$\ell_{1}$. ReMBo can be used in combination with any solver for the single measurement problem $Ax=b$, including greedy approaches and reweighted $\ell_{1}$ [4]. The recovery rate of greedy approaches may be lower than $\ell_{1}$ but the algorithms are generally much faster, thus giving ReMBo the chance to sample more random combinations. Another advantage of ReMBo, even more so than boosted-$\ell_{1}$, is that it can be easily parallelized. Based on the geometrical interpretation of ReMBo-$\ell_{1}$ (cf. Figure 6), we conclude that, theoretically, its performance does not increase with the number of observations after this number reaches the number of nonzero rows. In addition we develop a simplified model for the performance of ReMBo-$\ell_{1}$. To improve the model we would need to know the distribution of faces in the cross-polytope $\mathcal{C}$ that map to faces on $A\mathcal{C}$, and the distribution of external angles for the cones generated by the signed rows of the nonzero part of $X_{0}$. It would be very interesting to compare the recovery performance between $\ell_{1,2}$ and ReMBo-$\ell_{1}$. However, we consider this beyond the scope of this paper. All of the numerical experiments in this paper are reproducible. The scripts used to run the experiments and generate the figures can be downloaded from http://www.cs.ubc.ca/~mpf/jointsparse. ## Acknowledgments The authors would like to give their sincere thanks to Özgür Yılmaz and Rayan Saab for their thoughtful comments and suggestions during numerous discussions. ## References * [1] E. J. Candès. Compressive sampling. In Proceedings of the International Congress of Mathematicians, Madrid, Spain, 2006. * [2] E. J. Candès, J. Romberg, and T. Tao. Robust uncertainty principles: Exact signal reconstruction from highly incomplete frequency information. IEEE Transactions on Information Theory, 52(2):489–509, February 2006. * [3] E. J. Candès and T. Tao. Decoding by linear programming. IEEE Transactions on Information Theory, 51(2):4203–4215, December 2005. * [4] E. J. Candès, M. B. Wakin, and S. P. Boyd. Enhancing sparsity by reweighted $\ell_{1}$ minimization. Journal of Fourier Analysis and Applications, 14(5–6):877–905, December 2008. * [5] J. Chen and X. Huo. Theoretical results on sparse represenations of multiple-measurement vectors. IEEE Transactions on Signal Processing, 54:4634–4643, December 2006. * [6] S. S. Chen, D. L. Donoho, and M. A. Saunders. Atomic decomposition by basis pursuit. SIAM Journal on Scientific Computing, 20(1):33–61, 1998. * [7] S. F. Cotter and B. D. Rao. Sparse channel estimation via matching pursuit with application to equalization. IEEE Transactions on Communications, 50(3), March 2002. * [8] S. F. Cotter, B. D. Rao, K. Engang, and K. Kreutz-Delgado. Sparse solutions to linear inverse problems with multiple measurement vectors. IEEE Transactions on Signal Processing, 53:2477–2488, July 2005\. * [9] D. L. Donoho. Neighborly polytopes and sparse solution of underdetermined linear equations. Technical Report 2005-4, Department of Statistics, Stanford University, Stanford, CA, 2005. * [10] D. L. Donoho. Compressed sensing. IEEE Transactions on Information Theory, 52(4):1289–1306, April 2006. * [11] D. L. Donoho. High-dimensional centrosymmetric polytopes with neighborliness proportional to dimension. Discrete and Computational Geometry, 35(4):617–652, May 2006. * [12] D. L. Donoho and M. Elad. Optimally sparse representation in general (nonorthogonal) dictionaries via $\ell^{1}$ minimization. PNAS, 100(5):2197–2202, March 2003. * [13] D. L. Donoho and X. Huo. Uncertainty principles and ideal atomic decomposition. IEEE Transactions on Information Theory, 47(7):2845–2862, November 2001. * [14] Y. C. Eldar and M. Mishali. Robust recovery of signals from a union of subspaces. arXiv 0807.4581, July 2008. * [15] I. J. Fevrier, S. B. Gelfand, and M. P. Fitz. Reduced complexity decision feedback equalization for multipath channels with large delay spreads. IEEE Transactions on Communications, 47(6):927–937, June 1999\. * [16] J.-J. Fuchs. On sparse representations in arbitrary redundant bases. IEEE Transactions on Information Theory, 50(6):1341–1344, June 2004. * [17] M. Grant and S. Boyd. Graph implementations for nonsmooth convex programs. In V. Blondel, S. Boyd, and H. Kimura, editors, Lecture Notes in Control and Information Sciences, pages 95–110. Springer, 2008. * [18] M. Grant and S. Boyd. CVX: Matlab software for disciplined convex programming (web page and software). http://stanford.edu/~boyd/cvx, February 2009. * [19] R. Gribonval and M. Nielsen. Sparse representations in unions of bases. IEEE Transactions on Information Theory, 49(12):3320–3325, December 2003. * [20] R. Gribonval and M. Nielsen. Highly sparse representations from dictionaries are unique and independents of the sparseness measure. Applied and Computational Harmonic Analysis, 22(3):335–355, May 2007. * [21] B. Grünbaum. Convex Polytopes, volume 221 of Graduate Texts in Mathematics. Springer-Verlag, second edition, 2003. * [22] D. Malioutov, M. Çetin, and A. S. Willsky. A sparse signal reconstruction perspective for source localization with sensor arrays. IEEE Transactions on Signal Processing, 53(8):3010–3022, August 2005. * [23] M. Mishali and Y. C. Eldar. Reduce and boost: Recovering arbitrary sets of jointly sparse vectors. IEEE Transactions on Signal Processing, 56(10):4692–4702, October 2008. * [24] B. K. Natarajan. Sparse approximate solutions to linear systems. SIAM Journal on Computing, 24(2):227–234, April 1995. * [25] R. T. Rockafellar. Convex Analysis. Princeton University Press, Princeton, 1970. * [26] M. Stojnic, F. Parvaresh, and B. Hassibi. On the reconstruction of block-sparse signals with an optimal number of measurements. arXiv 0804.0041, March 2008. * [27] J. A. Tropp. Recovery of short, complex linear combinations via $\ell_{1}$ minimization. IEEE Transactions on Information Theory, 51(4):1568–1570, April 2005. * [28] J. A. Tropp. Algorithms for simultaneous sparse approximation: Part II: Convex relaxation. Signal Processing, 86:589–602, 2006. * [29] J. A. Tropp, A. C. Gilbert, and M. J. Strauss. Algorithms for simultaneous sparse approximation: Part I: Greedy pursuit. Signal Processing, 86:572–588, 2006. * [30] R. H. Tütüncü, K. C. Toh, and M. J. Todd. Solving semidefinite-quadratic-linear programs using SDPT3. Mathematical Programming Ser. B, 95:189–217, 2003.
arxiv-papers
2009-04-14T05:54:33
2024-09-04T02:49:01.855644
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Ewout van den Berg and Michael P. Friedlander", "submitter": "Michael Friedlander", "url": "https://arxiv.org/abs/0904.2051" }
0904.2088
# Dynamics of Particles in Non Scaling FFAG Accelerators James K. Jones james.jones@stfc.ac.uk Bruno D. Muratori bruno.muratori@stfc.ac.uk Susan L. Smith susan.smith@stfc.ac.uk Stephan I. Tzenov stephan.tzenov@stfc.ac.uk STFC Daresbury Laboratory, Daresbury, Warrington, Cheshire, WA4 4AD, United Kingdom ###### Abstract Non scaling Fixed-Field Alternating Gradient (FFAG) accelerators have an unprecedented potential for muon acceleration, as well as for medical purposes based on carbon and proton hadron therapy. They also represent a possible active element for an Accelerator Driven Subcritical Reactor (ADSR). Starting from first principle the Hamiltonian formalism for the description of the dynamics of particles in non scaling FFAG machines has been developed. The stationary reference (closed) orbit has been found within the Hamiltonian framework. The dependence of the path length on the energy deviation has been described in terms of higher order dispersion functions. The latter have been used subsequently to specify the longitudinal part of the Hamiltonian. It has been shown that higher order phase slip coefficients should be taken into account to adequately describe the acceleration in non scaling FFAG accelerators. A complete theory of the fast (serpentine) acceleration in non scaling FFAGs has been developed. An example of the theory is presented for the parameters of the Electron Machine with Many Applications (EMMA), a prototype electron non scaling FFAG to be hosted at Daresbury Laboratory. ###### pacs: 29.20.-c, 29.20.D-, 41.85.-p ## I Introduction Fixed-Field Alternating Gradient (FFAG) accelerators were proposed half century ago KL ; Kol ; Sy ; Ke , when acceleration of electrons was first demonstrated. These machines, which were intensively studied in the 1950s and 1960s but never progressed beyond the model stage, have in recent years become the focus of renewed attention. Acceleration of protons has been recently achieved at the KEK Proof-of-Principle (PoP) proton FFAG Ai . To avoid the slow crossing of betatron resonances associated with a typical low energy-gain per turn, the first FFAGs designed and constructed so far have been based on the ”scaling” principle. The latter implies that the orbit shape and betatron tunes must be kept fixed during the acceleration process. Thus, magnets must be built with constant field index, while in the case of spiral- sector designs the spiral angle must be constant as well. Machines of this type use conventional magnets with the bending and focusing field being kept constant during acceleration. The latter alternate in sign, providing a more compact radial extension and consequently smaller aperture as compared to the AVF cyclotrons. The ring essentially consists of a sequence of short cells with very large periodicity. Non scaling FFAG machines have until recently been considered as an alternative. The bending and the focusing is provided simultaneously by focusing and defocusing quadrupole magnets repeating in an alternating sequence. There is a number of advantages of the non scaling FFAG lattice as compared to the scaling one, among which are the relatively small transverse magnet aperture (tending to be much smaller than the one for scaling machines) and the lower field strength. Unfortunately this lattice leads to a large betatron tune variation across the required energy range for acceleration as opposed to the scaling lattice. As a consequence several resonances are crossed during the acceleration cycle, some of them nonlinear created by the magnetic field imperfections, as well as half-integer and integer ones. A possible bypass to this problem is the rapid acceleration (of utmost importance for muons), which allows betatron resonances no time to essentially damage beam quality. Because non scaling FFAG accelerators have otherwise very desirable features, it is important to investigate analytically and numerically some of the peculiarities of the beam dynamics, the new type of fast acceleration regime (so-called serpentine acceleration) and the effects of crossing of linear as well as nonlinear resonances. Moreover, it is important to examine the most favorable phase at which the cavities need to be set for the optimal acceleration. Some of these problems will be discussed in the present paper. An example of the theory developed here is presented for the parameters of the Electron Machine with Many Applications (EMMA) emma , a prototype electron non scaling FFAG to be hosted at Daresbury Laboratory. The Accelerators and Lasers In Combined Experiments (ALICE) accelerator alice is used as an injector to the EMMA ring. The energy delivered by this injector can vary from a $10$ to $20$ MeV single bunch train with a bunch charge of $16$ to $32$ pC at a rate of $1$ to $20$ Hz. ALICE is presently designed to deliver bunches which are around $4$ ps and $8.35$ MeV from the exit of the booster of its injector line. These are then accelerated to $10$ or $20$ MeV in the main ALICE linac after which they are sent to the EMMA injection line. The EMMA injection line ends with a septum for injection into the EMMA ring itself followed by two kickers so as to direct the beam onto the correct, energy dependent, trajectory. After circulation in the EMMA ring, the electron bunches are extracted using what is almost a mirror image of the injection setup with two kickers followed by an extraction septum. The beam is then transported to a diagnostic line whose purpose it is to analyze in as much detail as possible the effect the non scaling FFAG has had on the bunch. The paper is organized as follows. Firstly, we review some generalities and first principles of the Hamiltonian formalism Tzenov suitably modified to cover the case of a non scaling FFAG lattice. Subsequently the synchrobetatron framework is applied to determine the energy dependent reference orbit. Stability of motion about the stationary reference orbit is described in terms of betatron oscillations with energy dependent Twiss parameters and betatron tunes. Dispersion, measuring the effect of energy variation on the path length along the reference orbit is an essential feature of non scaling FFAGs. Within the developed synchrobetatron formalism higher order dispersion functions have been introduced and their contribution to the longitudinal dynamics has been further analyzed. Finally, a complete description of the so-called serpentine acceleration in non scaling lepton FFAGs is given together with conclusions. The calculations of the reference orbit and phase stability are detailed in the appendices. ## II Generalities and First Principles Let the ideal (design) trajectory of a particle in an accelerator be a planar curve with curvature $K$. The Hamiltonian describing the motion of a particle in a natural coordinate system attached to the orbit thus defined is Tzenov : $H=-{\left(1+Kx\right)}{\sqrt{{\frac{{\left({\mathcal{H}}-q\varphi\right)}^{2}}{c^{2}}}-m_{p0}^{2}c^{2}-{\left(P_{x}-qA_{x}\right)}^{2}-{\left(P_{z}-qA_{z}\right)}^{2}}}-q{\left(1+Kx\right)}A_{s},$ (1) where $m_{p0}$ is the rest mass of the particle. The guiding magnetic field can be represented as a gradient of a function $\psi{\left(x,z;s\right)}$ $\mathbf{B}=\nabla\psi,$ (2) where the latter satisfies the Laplace equation $\nabla^{2}\psi=0.$ (3) Using the median symmetry of the machine, it is straightforward to show that $\psi$ can be written in the form $\psi={\left(a_{0}+a_{1}x+{\frac{a_{2}x^{2}}{2!}}+\dots\right)}z$ $-{\left(b_{0}+b_{1}x+{\frac{b_{2}x^{2}}{2!}}+\dots\right)}{\frac{z^{3}}{3!}}+{\left(c_{0}+c_{1}x+\dots\right)}{\frac{z^{5}}{5!}}+\dots.$ (4) Inserting the above expression into the Laplace equation (3), one readily finds relations between the coefficients $b_{k}$ and $c_{k}$ on one hand and $a_{k}$ on the other: $b_{0}=a_{0}^{\prime\prime}+Ka_{1}+a_{2},$ (5) $b_{1}=-2Ka_{0}^{\prime\prime}-K^{\prime}a_{0}^{\prime}+a_{1}^{\prime\prime}-K^{2}a_{1}+Ka_{2}+a_{3},$ (6) $b_{2}=6K^{2}a_{0}^{\prime\prime}+6KK^{\prime}a_{0}^{\prime}-4Ka_{1}^{\prime\prime}-2K^{\prime}a_{1}^{\prime}$ $+a_{2}^{\prime\prime}+2K^{3}a_{1}-2K^{2}a_{2}+Ka_{3}+a_{4},$ (7) $c_{0}=b_{0}^{\prime\prime}+Kb_{1}+b_{2}.$ (8) Prime in the above expressions implies differentiation with respect to the longitudinal coordinate $s$. The coefficients $a_{k}$ have a very simple meaning: $a_{0}={\left(B_{z}\right)}_{x,z=0},\qquad a_{1}={\left({\frac{\partial B_{z}}{\partial x}}\right)}_{x,z=0},$ $a_{2}={\left({\frac{\partial^{2}B_{z}}{\partial x^{2}}}\right)}_{x,z=0}.$ (9) In other words, this implies that, provided the vertical component $B_{z}$ of the magnetic field and its derivatives with respect to the horizontal coordinate $x$ are known in the median plane, one can in principle reconstruct the entire field chart. The vector potential $\mathbf{A}$ can be represented as $A_{x}=-z\overline{F}{\left(x,z;s\right)},\quad A_{z}=x\overline{F}{\left(x,z;s\right)},\quad A_{s}=\overline{G}{\left(x,z;s\right)},$ (10) where the Poincar${\grave{\rm e}}$ gauge condition $xA_{x}+zA_{z}=0,$ (11) written in the natural coordinate system has been used. From Maxwell’s equation $\mathbf{B}=\nabla\times\mathbf{A},$ (12) we obtain $2\overline{F}+{\left(x\partial_{x}+z\partial_{z}\right)}\overline{F}=B_{s},$ (13) ${\frac{Kx}{1+Kx}}\overline{G}+{\left(x\partial_{x}+z\partial_{z}\right)}\overline{G}=zB_{x}-xB_{z}.$ (14) Applying Euler’s theorem for homogeneous functions, we can write $\overline{F}={\frac{1}{2}}B_{s}^{(0)}+{\frac{1}{3}}B_{s}^{(1)}+{\frac{1}{4}}B_{s}^{(2)}+\dots,$ (15) ${\overline{G}}_{u}={\left(1+{\frac{Kx}{2}}\right)}B_{u}^{(0)}+{\left({\frac{1}{2}}+{\frac{Kx}{3}}\right)}B_{u}^{(1)}$ $+{\left({\frac{1}{3}}+{\frac{Kx}{4}}\right)}B_{u}^{(2)}+\dots,$ (16) ${\overline{G}}={\frac{z{\overline{G}}_{x}-x{\overline{G}}_{z}}{1+Kx}}.$ (17) Here $u=(x,z)$ and $B_{\alpha}^{(k)}$ denotes homogeneous polynomials in $x$ and $z$ of order $k$, representing the corresponding parts of the components of the magnetic field $\mathbf{B}={\left(B_{x},B_{z},B_{s}\right)}$. Thus, having found the magnetic field represented by equation (4), it is straightforward to calculate the vector potential $\mathbf{A}$. The accelerating field in AVF cyclotrons and FFAG machines can be represented by a scalar potential $\varphi$ (the corresponding vector potential $\mathbf{A}=0$). Due to the median symmetry, we have $\varphi=A_{0}+A_{1}x+{\frac{A_{2}x^{2}}{2!}}+\dots$ $-{\left(B_{0}+B_{1}x+{\frac{B_{2}x^{2}}{2!}}+\dots\right)}{\frac{z^{2}}{2!}}$ $+{\left(C_{0}+C_{1}x+\dots\right)}{\frac{z^{4}}{4!}}+\dots.$ (18) Inserting the above expansion into the Laplace equation for $\varphi$, we obtain similar relations between $B_{k}$ and $C_{k}$ on one hand and $A_{k}$ on the other, which are analogous to those relating $b_{k}$, $c_{k}$ and $a_{k}$. We consider the canonical transformation, specified by the generating function $S_{2}{\left(x,z,{\cal T},{\widehat{P}}_{x},{\widehat{P}}_{z},E;s\right)}=x{\widehat{P}}_{x}+z{\widehat{P}}_{z}+{\cal T}E$ $+q\int{\rm d}{\cal T}\varphi{\left(x,z,{\cal T};s\right)},$ (19) where ${\cal T}=-t,$ (20) is a canonical variable canonically conjugate to $\mathcal{H}$. The relations between the new and the old variables are $\widehat{u}={\frac{\partial S_{2}}{\partial{\widehat{P}}_{u}}}=u,\qquad u={\left(x,z\right)},\qquad\widehat{\cal T}={\frac{\partial S_{2}}{\partial E}}={\cal T},$ (21) $P_{u}={\frac{\partial S_{2}}{\partial u}}={\widehat{P}}_{u}-q\int{\rm d}{\cal T}E_{u}{\left(x,z,{\cal T};s\right)}$ $={\widehat{P}}_{u}-q{\widetilde{E}}_{u}{\left(x,z,{\cal T};s\right)},\qquad E_{u}=-{\frac{\partial\varphi}{\partial u}},$ (22) $\mathcal{H}={\frac{\partial S_{2}}{\partial{\cal T}}}=E+q\varphi{\left(x,z,{\cal T};s\right)}=m_{p0}\gamma c^{2}+q\varphi{\left(x,z,{\cal T};s\right)}.$ (23) The new Hamiltonian acquires now the form $\widehat{H}=-{\left(1+Kx\right)}{\sqrt{{\frac{E^{2}}{c^{2}}}-m_{p0}^{2}c^{2}-{\left(\widehat{P}_{x}-q\widetilde{E}_{x}-qA_{x}\right)}^{2}-{\left(\widehat{P}_{z}-q\widetilde{E}_{z}-qA_{z}\right)}^{2}}}-q{\left(1+Kx\right)}{\left(A_{s}+\widetilde{E}_{s}\right)},$ (24) where $\widetilde{E}_{s}=\int{\rm d}{\cal T}E_{s}{\left(x,z,{\cal T};s\right)}$ $=-{\frac{1}{1+Kx}}\int{\rm d}{\cal T}{\frac{\partial\varphi{\left(x,z,{\cal T};s\right)}}{\partial s}}.$ (25) We introduce the new scaled variables $\widetilde{P}_{u}={\frac{\widehat{P}_{u}}{p_{0}}}={\frac{\widehat{P}_{u}}{m_{p0}c}},\quad\Theta=c{\cal T},\quad\gamma={\frac{E}{E_{p}}}={\frac{E}{m_{p0}c^{2}}}.$ (26) The new scaled Hamiltonian can be expressed as $\widetilde{H}={\frac{\widehat{H}}{p_{0}}}=-{\left(1+Kx\right)}{\sqrt{\gamma^{2}-1-{\left(\widetilde{P}_{x}-\widetilde{q}\widetilde{E}_{x}-\widetilde{q}A_{x}\right)}^{2}-{\left(\widetilde{P}_{z}-\widetilde{q}\widetilde{E}_{z}-\widetilde{q}A_{z}\right)}^{2}}}-\widetilde{q}{\left(1+Kx\right)}{\left(A_{s}+\widetilde{E}_{s}\right)},$ (27) where $\widetilde{q}={\frac{q}{p_{0}}}.$ (28) The quantities $\widetilde{E}_{x}$ and $\widetilde{E}_{z}$ can be neglected as compared to the components of the vector potential $\mathbf{A}$, so that $\widetilde{H}=\beta\gamma{\left(1+Kx\right)}{\left[-{\sqrt{1-{\left(\overline{P}_{x}-\overline{q}A_{x}\right)}^{2}-{\left(\overline{P}_{z}-\overline{q}A_{z}\right)}^{2}}}-\overline{q}A_{s}\right]}-\widetilde{q}{\left(1+Kx\right)}\widetilde{E}_{s},$ (29) where now $\overline{q}={\frac{q}{p}}={\frac{q}{\beta\gamma p_{0}}},\qquad\overline{P}_{u}={\frac{\widehat{P}_{u}}{p}}={\frac{\widehat{P}_{u}}{\beta\gamma p_{0}}},\qquad u=(x,z).$ (30) Since $\overline{P}_{u}$ and $u$ are small deviations, we can expand the square root in power series in the canonical variables $x$, $\overline{P}_{x}$ and $z$, $\overline{P}_{z}$. Tedious algebra yields $\widetilde{H}=\widetilde{H}_{0}+\widetilde{H}_{1}+\widetilde{H}_{2}+\widetilde{H}_{3}+\widetilde{H}_{4}+\dots,$ (31) $\widetilde{H}_{0}=-\beta\gamma-\widetilde{q}{\left(1+Kx\right)}\widetilde{E}_{s},$ (32) $\widetilde{H}_{1}=\beta\gamma{\left(\overline{q}a_{0}-K\right)}x,$ (33) $\widetilde{H}_{2}={\frac{\beta\gamma}{2}}{\left({\overline{P}}_{x}^{2}+{\overline{P}}_{z}^{2}\right)}+{\frac{\widetilde{q}}{2}}{\left[{\left(Ka_{0}+a_{1}\right)}x^{2}-a_{1}z^{2}\right]},$ (34) $\widetilde{H}_{3}={\frac{\beta\gamma}{2}}Kx{\left({\overline{P}}_{x}^{2}+{\overline{P}}_{z}^{2}\right)}+{\frac{\widetilde{q}a_{0}^{\prime}z}{3}}{\left(z\overline{P}_{x}-x\overline{P}_{z}\right)}+{\frac{\widetilde{q}}{3}}{\left[{\left(Ka_{1}+{\frac{a_{2}}{2}}\right)}x^{3}-{\left(Ka_{1}+a_{2}+{\frac{b_{0}}{2}}\right)}xz^{2}\right]},$ (35) $\widetilde{H}_{4}={\frac{\beta\gamma}{8}}{\left({\overline{P}}_{x}^{2}+{\overline{P}}_{z}^{2}\right)}^{2}+{\frac{\widetilde{q}xz}{12}}{\left(Ka_{0}^{\prime}+3a_{1}^{\prime}\right)}{\left(z\overline{P}_{x}-x\overline{P}_{z}\right)}+{\frac{\overline{q}^{2}\beta\gamma a_{0}^{\prime 2}z^{2}}{18}}{\left(x^{2}+z^{2}\right)}$ $+{\frac{\widetilde{q}}{4}}{\left[{\left({\frac{Ka_{2}}{2}}+{\frac{a_{3}}{6}}\right)}x^{4}-{\left(Ka_{2}+{\frac{a_{3}}{3}}+{\frac{Kb_{0}}{2}}+{\frac{b_{1}}{2}}\right)}x^{2}z^{2}+{\frac{b_{1}}{6}}z^{4}\right]}.$ (36) The Hamiltonian decomposition (31) represents the milestone of the synchrobetatron formalism. For instance, ${\widetilde{H}_{0}}$ governs the longitudinal motion, ${\widetilde{H}_{1}}$ describes linear coupling between longitudinal and transverse degrees of freedom and is the basic source of dispersion. The part ${\widetilde{H}_{2}}$ is responsible for linear betatron motion and chromaticity, while the remainder describes higher order contributions. ## III The Synchro-Betatron Formalism and the Reference Orbit In the present paper we consider a FFAG lattice with polygonal structure. To define and subsequently calculate the stationary reference orbit, it is convenient to use a global Cartesian coordinate system whose origin is located in the center of the polygon. To describe step by step the fraction of the reference orbit related to a particular side of the polygon, we rotate each time the axes of the coordinate system by the polygon angle $\Theta_{p}=2\pi/N_{L}$, where $N_{L}$ is the number of sides of the polygon. Let $X_{e}$ and $P_{e}$ denote the reference orbit and the reference momentum, respectively. The vertical component of the magnetic field in the median plane of a perfectly linear machine can be written as $B_{z}{\left(X_{e};s\right)}=a_{1}(s){\left[X_{e}-X_{c}-d(s)\right]},$ $a_{0}{\left(X_{e};s\right)}=B_{z}{\left(X_{e};s\right)},$ (37) where $s$ is the distance along the polygon side, and $X_{c}$ is the distance of the side of the polygon from the center of the machine $X_{c}={\frac{L_{p}}{2\tan(\Theta_{p}/2)}}.$ (38) Here $L_{p}$ is the length of the polygon side which actually represents the periodicity parameter of the lattice. Usually $X_{c}$ is related to an arbitrary energy in the range from injection to extraction energy. In the case of EMMA it is related to the 15 MeV orbit. The quantity $d(s)$ in equation (37) is the relative offset of the magnetic center in the quadrupoles with respect to the corresponding side of the polygon. In what follows [see equations (47) and (50)] $d_{F}$ corresponds to the offset in the focusing quadrupoles and $d_{D}$ corresponds to the one in the defocusing quadrupoles. Similarly, $a_{F}$ and $a_{D}$ stand for the particular value of $a_{1}$ in the focusing and the defocusing quadrupoles, respectively. A design (reference) orbit corresponding to a local curvature $K{\left(X_{e};s\right)}$ can be defined according to the relation $K{\left(X_{e};s\right)}={\frac{q}{p_{0}\beta_{e}\gamma_{e}}}B_{z}{\left(X_{e};s\right)},$ (39) where $\gamma_{e}$ is the energy of the reference particle. In terms of the reference orbit position $X_{e}(s)$ the equation for the curvature can be written as $X_{e}^{\prime\prime}={\frac{q}{p_{0}\beta_{e}\gamma_{e}}}{\left(1+X_{e}^{\prime 2}\right)}^{3/2}B_{z}{\left(X_{e};s\right)},$ (40) where the prime implies differentiation with respect to $s$. To proceed further, we notice that equation (40) parameterizing the local curvature can be derived from an equivalent Hamiltonian $H_{e}{\left(X_{e},P_{e};s\right)}=-{\sqrt{\beta_{e}^{2}\gamma_{e}^{2}-P_{e}^{2}}}-{\widetilde{q}}\int{\rm d}X_{e}B_{z}{\left(X_{e};s\right)}.$ (41) Taking into account Hamilton’s equations of motion $X_{e}^{\prime}={\frac{P_{e}}{\sqrt{\beta_{e}^{2}\gamma_{e}^{2}-P_{e}^{2}}}},\qquad\qquad P_{e}^{\prime}={\widetilde{q}}B_{z}{\left(X_{e};s\right)},$ (42) and using the relation $P_{e}={\frac{\beta_{e}\gamma_{e}X_{e}^{\prime}}{\sqrt{1+X_{e}^{\prime 2}}}},$ (43) we readily obtain equation (40). Note also that the Hamiltonian (41) follows directly from the scaled Hamiltonian (27) with $x=0$, ${\widetilde{P}}_{x}=P_{e}$, ${\widetilde{P}}_{z}=0$, $A_{x}=A_{z}=0$ and the accelerating cavities being switched off respectively. Hamilton’s equations of motion (42) can be linearized and subsequently solved approximately by assuming that $P_{e}\ll\beta_{e}\gamma_{e}.$ (44) Thus, assuming electrons ($q=-e$), we have $P_{e}=\beta_{e}\gamma_{e}X_{e}^{\prime},\qquad X_{e}^{\prime\prime}=-{\frac{ea_{1}(s)}{p_{0}\beta_{e}\gamma_{e}}}{\left(X_{e}-X_{c}-d(s)\right)}.$ (45) The three types of solutions to equations (45) are as follows: Drift Space $X_{e}=X_{0}+{\frac{P_{0}}{\beta_{e}\gamma_{e}}}{\left(s-s_{0}\right)},\qquad\qquad P_{e}=P_{0},$ (46) where $X_{0}$ and $P_{0}$ are the initial position and reference momentum and $s$ is the distance in longitudinal direction. Focusing Quadrupole $X_{e}=X_{c}+d_{F}+{\left(X_{0}-X_{c}-d_{F}\right)}\cos\omega_{F}{\left(s-s_{0}\right)}$ $+{\frac{P_{0}}{\beta_{e}\gamma_{e}\omega_{F}}}\sin\omega_{F}{\left(s-s_{0}\right)},$ (47) $P_{e}=-\beta_{e}\gamma_{e}\omega_{F}{\left(X_{0}-X_{c}-d_{F}\right)}\sin\omega_{F}{\left(s-s_{0}\right)}$ $+P_{0}\cos\omega_{F}{\left(s-s_{0}\right)},$ (48) where $\omega_{F}^{2}={\frac{ea_{F}}{p_{0}\beta_{e}\gamma_{e}}}.$ (49) Defocusing Quadrupole $X_{e}=X_{c}+d_{D}+{\left(X_{0}-X_{c}-d_{D}\right)}\cosh\omega_{D}{\left(s-s_{0}\right)}$ $+{\frac{P_{0}}{\beta_{e}\gamma_{e}\omega_{D}}}\sinh\omega_{D}{\left(s-s_{0}\right)},$ (50) $P_{e}=\beta_{e}\gamma_{e}\omega_{D}{\left(X_{0}-X_{c}-d_{D}\right)}\sinh\omega_{D}{\left(s-s_{0}\right)}$ $+P_{0}\cosh\omega_{D}{\left(s-s_{0}\right)},$ (51) where $\omega_{D}^{2}={\frac{ea_{D}}{p_{0}\beta_{e}\gamma_{e}}}.$ (52) In addition to the above, the coordinate transformation at the polygon bend when passing to the new rotated coordinate system needs to be specified. The latter can be written as $X_{e}=X_{c}+{\frac{X_{0}-X_{c}}{\cos\Theta_{p}-P_{0}\sin\Theta_{p}/\beta_{e}\gamma_{e}}},$ $P_{e}=\beta_{e}\gamma_{e}\tan{\left[\Theta_{p}+\arctan{\left({\frac{P_{0}}{\beta_{e}\gamma_{e}}}\right)}\right]}.$ (53) Once the reference trajectory has been found the corresponding contributions to the total Hamiltonian (31) can be written as follows $\widetilde{H}_{0}=-\beta\gamma+{\frac{Z}{AE_{p}}}{\left({\frac{{\rm d}\Delta E}{{\rm d}s}}\right)}\int{\rm d}\Theta\sin\phi(\Theta),$ (54) $\widetilde{H}_{1}=-{\left(\beta\gamma-\beta_{e}\gamma_{e}\right)}K\widetilde{x},$ (55) $\widetilde{H}_{2}={\frac{1}{2\beta\gamma}}{\left({\widetilde{P}}_{x}^{2}+{\widetilde{P}}_{z}^{2}\right)}+{\frac{1}{2}}{\left[{\left(g+\beta_{e}\gamma_{e}K^{2}\right)}{\widetilde{x}}^{2}-g{\widetilde{z}}^{2}\right]},$ (56) $\widetilde{H}_{3}={\frac{K{\widetilde{x}}}{2\beta\gamma}}{\left({\widetilde{P}}_{x}^{2}+{\widetilde{P}}_{z}^{2}\right)}+{\frac{Kg}{6}}{\left(2{\widetilde{x}}^{3}-3\widetilde{x}{\widetilde{z}}^{2}\right)},$ (57) $\widetilde{H}_{4}={\frac{{\left({\widetilde{P}}_{x}^{2}+{\widetilde{P}}_{z}^{2}\right)}^{2}}{8\beta^{3}\gamma^{3}}}-{\frac{K^{2}g}{24}}{\widetilde{z}}^{4}.$ (58) Here, we have introduced the following notation $g={\frac{qa_{1}}{p_{0}}}.$ (59) Moreover, $Z$ is the charge state of the accelerated particle, $A$ is the mass ratio with respect to the proton mass in the case of ions, and $\phi(\Theta)$ is the phase of the RF. For a lepton accelerator like EMMA, $A=Z=1$. In addition, $({\rm d}\Delta E/{\rm d}s)$ is the energy gain per unit longitudinal distance $s$, which in thin lens approximation scales as $\Delta E/\Delta s$, where $\Delta s$ is the length of the cavity. It is convenient to pass to new scaled variables as follows ${\widetilde{p}}_{u}={\frac{{\widetilde{P}}_{u}}{\beta_{e}\gamma_{e}}},\qquad h={\frac{\gamma}{\beta_{e}^{2}\gamma_{e}}},$ (60) $\tau=\beta_{e}\Theta,\qquad\Gamma_{e}={\frac{\beta\gamma}{\beta_{e}\gamma_{e}}}={\sqrt{\beta_{e}^{2}h^{2}-{\frac{1}{\beta_{e}^{2}\gamma_{e}^{2}}}}}.$ (61) Thus, expressions (54) – (58) become $\widetilde{H}_{0}=-\Gamma_{e}+{\frac{Z}{A\beta_{e}^{2}E_{e}}}{\left({\frac{{\rm d}\Delta E}{{\rm d}s}}\right)}\int{\rm d}\tau\sin\phi(\tau),$ (62) $\widetilde{H}_{1}=-{\left(\Gamma_{e}-1\right)}K\widetilde{x},$ (63) $\widetilde{H}_{2}={\frac{1}{2\Gamma_{e}}}{\left({\widetilde{p}}_{x}^{2}+{\widetilde{p}}_{z}^{2}\right)}+{\frac{1}{2}}{\left[{\left(g_{e}+K^{2}\right)}{\widetilde{x}}^{2}-g_{e}{\widetilde{z}}^{2}\right]},$ (64) $\widetilde{H}_{3}={\frac{K{\widetilde{x}}}{2\Gamma_{e}}}{\left({\widetilde{p}}_{x}^{2}+{\widetilde{p}}_{z}^{2}\right)}+{\frac{Kg_{e}}{6}}{\left(2{\widetilde{x}}^{3}-3\widetilde{x}{\widetilde{z}}^{2}\right)},$ (65) $\widetilde{H}_{4}={\frac{{\left({\widetilde{p}}_{x}^{2}+{\widetilde{p}}_{z}^{2}\right)}^{2}}{8\Gamma_{e}^{3}}}-{\frac{K^{2}g_{e}}{24}}{\widetilde{z}}^{4},$ (66) $E_{p}=m_{p0}c^{2},\qquad\qquad g_{e}={\frac{g}{\beta_{e}\gamma_{e}}}.$ (67) The longitudinal part of the reference orbit can be isolated via a canonical transformation $F_{2}{\left(\widetilde{x},\widetilde{\widetilde{p}}_{x},\widetilde{z},\widetilde{\widetilde{p}}_{z},\tau,\eta;s\right)}=\widetilde{x}\widetilde{\widetilde{p}}_{x}+\widetilde{z}\widetilde{\widetilde{p}}_{z}+{\left(\tau+s\right)}{\left(\eta+{\frac{1}{\beta_{e}^{2}}}\right)},$ (68) $\sigma=\tau+s,\qquad\qquad\eta=h-{\frac{1}{\beta_{e}^{2}}},$ (69) where $\sigma$ is the new longitudinal variable and $\eta$ is the energy deviation with respect to the energy $\gamma_{e}$ of the reference particle. ## IV Dispersion and Betatron Motion The (linear and higher order) dispersion can be introduced via a canonical transformation aimed at canceling the first order Hamiltonian ${\widetilde{H}}_{1}$ in all orders of $\eta$. The explicit form of the generating function is $G_{2}{\left({\widetilde{x}},{\widehat{p}}_{x},{\widetilde{z}},{\widehat{p}}_{z},\sigma,\widehat{\eta};s\right)}=\sigma{\widehat{\eta}}+{\widetilde{z}}{\widehat{p}}_{z}+{\widetilde{x}}{\widehat{p}}_{x}$ $+\sum\limits_{k=1}^{\infty}{\widehat{\eta}}^{k}{\left[{\widetilde{x}}{\cal X}_{k}(s)-{\widehat{p}}_{x}{\cal P}_{k}(s)+{\cal S}_{k}(s)\right]},$ (70) ${\widetilde{x}}=\widehat{x}+\sum\limits_{k=1}^{\infty}{\widehat{\eta}}^{k}{\cal P}_{k},\qquad\qquad{\widetilde{p}}_{x}={\widehat{p}}_{x}+\sum\limits_{k=1}^{\infty}{\widehat{\eta}}^{k}{\cal X}_{k},$ (71) $\sigma=\widehat{\sigma}+\sum\limits_{k=1}^{\infty}k{\widehat{\eta}}^{k-1}{\left({\cal P}_{k}{\widehat{p}}_{x}-{\cal X}_{k}{\widehat{x}}\right)}$ $-\sum\limits_{k=1}^{\infty}k{\widehat{\eta}}^{k-1}{\left({\cal S}_{k}+{\cal X}_{k}\sum\limits_{m=1}^{\infty}{\widehat{\eta}}^{m}{\cal P}_{m}\right)}.$ (72) Equating terms of the form ${\widehat{x}}{\widehat{\eta}}^{n}$ and ${\widehat{p}}_{x}{\widehat{\eta}}^{n}$ in the new transformed Hamiltonian, we determine order by order the conventional (first order) and higher order dispersions. The first order in ${\widehat{\eta}}$ (terms proportional to ${\widehat{x}}{\widehat{\eta}}$ and ${\widehat{p}}_{x}{\widehat{\eta}}$) yields the well-known result ${\cal P}_{1}^{\prime}={\cal X}_{1},\qquad\qquad{\cal X}_{1}^{\prime}+{\left(g_{e}+K^{2}\right)}{\cal P}_{1}=K.$ (73) Since in the case of vanishing betatron motion ${\left({\widehat{x}}=0,\quad{\widehat{p}}_{x}=0\right)}$ the new longitudinal coordinate $\widehat{\sigma}$ should not depend on the new longitudinal canonical conjugate variable $\widehat{\eta}$, the second sum in equation (72) must be identically zero. We readily obtain ${\cal S}_{1}=0$, and ${\cal S}_{2}=-{\frac{{\cal X}_{1}{\cal P}_{1}}{2}}.$ (74) In second order we have ${\cal P}_{2}^{\prime}={\cal X}_{2}-{\cal X}_{1}+K{\cal X}_{1}{\cal P}_{1},$ (75) ${\cal X}_{2}^{\prime}+{\left(g_{e}+K^{2}\right)}{\cal P}_{2}=-Kg_{e}{\cal P}_{1}^{2}-{\frac{K{\cal X}_{1}^{2}}{2}}-{\frac{K}{2\gamma_{e}^{2}}},$ (76) and in addition the function ${\cal S}_{3}(s)$ is expressed as ${\cal S}_{3}=-{\frac{1}{3}}{\left({\cal X}_{1}{\cal P}_{2}+2{\cal X}_{2}{\cal P}_{1}\right)}.$ (77) Close inspection of equations (73), (75) and (76) shows that ${\cal P}_{1}$ is the well-known linear dispersion function, ${\cal P}_{2}$ stands for a second order dispersion and so on. Up to third order in ${\widehat{\eta}}$ the new Hamiltonian describing the longitudinal motion and the linear transverse motion acquires the form $\widehat{H}_{0}=-{\frac{{\widetilde{\cal K}}_{1}{\widehat{\eta}}^{2}}{2}}+{\frac{{\widetilde{\cal K}}_{2}{\widehat{\eta}}^{3}}{3}}+{\frac{Z}{A\beta_{e}^{2}E_{e}}}{\left({\frac{{\rm d}\Delta E}{{\rm d}s}}\right)}\int{\rm d}\tau\sin\phi(\tau),$ (78) $\widehat{H}_{2}={\frac{1}{2}}{\left({\widehat{p}}_{x}^{2}+{\widehat{p}}_{z}^{2}\right)}+{\frac{1}{2}}{\left[{\left(g_{e}+K^{2}\right)}{\widehat{x}}^{2}-g_{e}{\widehat{z}}^{2}\right]},$ (79) where ${\widetilde{\cal K}}_{1}=K{\cal P}_{1}-{\frac{1}{\gamma_{e}^{2}}}\qquad{\widetilde{\cal K}}_{2}={\frac{K{\cal P}_{1}}{\gamma_{e}^{2}}}-K{\cal P}_{2}-{\frac{{\cal X}_{1}^{2}}{2}}-{\frac{3}{2\gamma_{e}^{2}}}.$ (80) For the sake of generality, let us consider a Hamiltonian of the type $\widehat{H}_{b}=\sum\limits_{u=(x,z)}{\left[{\frac{{\cal F}_{u}}{2}}{\widehat{p}}_{u}^{2}+{\cal R}_{u}{\widehat{u}}{\widehat{p}}_{u}+{\frac{{\cal G}_{u}}{2}}{\widehat{u}}^{2}\right]}.$ (81) A generic Hamiltonian of the type (81) can be transformed to the normal form ${\mathcal{H}}_{b}=\sum\limits_{u=(x,z)}{\frac{\chi_{u}^{\prime}}{2}}{\left({\overline{P}}_{u}^{2}+{\overline{U}}^{2}\right)},$ (82) by means of a canonical transformation specified by the generating function ${\mathcal{F}}_{2}{\left(\widehat{x},{\overline{P}}_{x},\widehat{z},{\overline{P}}_{z};s\right)}=\sum\limits_{u=(x,z)}{\left({\frac{\widehat{u}{\overline{P}}_{u}}{\sqrt{\beta_{u}}}}-{\frac{\alpha_{u}{\widehat{u}}^{2}}{2\beta_{u}}}\right)}.$ (83) Here the prime implies differentiation with respect to the longitudinal variable $s$. The old and the new canonical variables are related through the expressions $\widehat{u}={\overline{U}}\sqrt{\beta_{u}},\qquad\qquad{\widehat{p}}_{u}={\frac{1}{\sqrt{\beta_{u}}}}{\left({\overline{P}}_{u}-\alpha_{u}{\overline{U}}\right)}.$ (84) The phase advance $\chi_{u}(s)$ and the generalized Twiss parameters $\alpha_{u}(s)$, $\beta_{u}(s)$ and $\gamma_{u}(s)$ are defined as $\chi_{u}^{\prime}={\frac{{\rm d}\chi_{u}}{{\rm d}s}}={\frac{{\cal F}_{u}}{\beta_{u}}},$ (85) $\alpha_{u}^{\prime}={\frac{{\rm d}\alpha_{u}}{{\rm d}s}}={\cal G}_{u}\beta_{u}-{\cal F}_{u}\gamma_{u},$ (86) $\beta_{u}^{\prime}={\frac{{\rm d}\beta_{u}}{{\rm d}s}}=-2{\cal F}_{u}\alpha_{u}+2{\cal R}_{u}\beta_{u}.$ (87) The third Twiss parameter $\gamma_{u}(s)$ is introduced via the well-known expression $\beta_{u}\gamma_{u}-\alpha_{u}^{2}=1.$ (88) The corresponding betatron tunes are determined according to the expression $\nu_{u}={\frac{N_{p}}{2\pi}}\int\limits_{s}^{s+L_{p}}{\frac{{\rm d}\theta{\cal F}_{u}(\theta)}{\beta_{u}(\theta)}}.$ (89) Typical dependence of the horizontal and vertical betatron tunes on energy in the EMMA non scaling FFAG is shown in Figures 1 and 2. Figure 1: Horizontal betatron tune for the EMMA ring as a function of energy. Figure 2: Vertical betatron tune for the EMMA ring as a function of energy. ## V Acceleration in a Non Scaling FFAG Accelerator The process of acceleration in a non scaling FFAG accelerator can be studied by solving Hamilton’s equations of motion for the longitudinal degree of freedom. The latter are obtained from the Hamiltonian (41) supplemented by an additional term [similar to that in equation (54)], which takes into account the electric field of the RF cavities. They read as ${\frac{{\rm d}\Theta}{{\rm d}s}}=-{\frac{\gamma}{\sqrt{\beta^{2}\gamma^{2}-P^{2}}}},$ (90) ${\frac{{\rm d}\gamma}{{\rm d}s}}=-{\frac{ZeU_{c}}{2AE_{p}}}\sum\limits_{k=1}^{N_{c}}\delta_{p}{\left(s-s_{k}\right)}\sin{\left({\frac{\omega_{c}\Theta}{c}}-\varphi_{k}\right)}.$ (91) Here $U_{c}$ is the cavity voltage, $\omega_{c}$ is the RF frequency, $N_{c}$ is the number of cavities and $\varphi_{k}$ is the corresponding cavity phase. One could use the results obtained in the previous section with the additional requirement that the phase slip coefficient ${\widetilde{\cal K}}_{1}$ averaged over one period vanishes. Instead, we shall use an equivalent but more illustrative approach. The path length in a FFAG arc and therefore the time of flight $\Theta$ is often well approximated as a quadratic function of energy. The acceleration process is then described by a longitudinal Hamiltonian, which contains terms proportional to the zero-order (conventional phase slip) factor and first-order phase slip factor. It usually suffices to take into account only terms to second order in the energy deviation $\Theta=\Theta_{0}+2{\cal A}\gamma_{m}\gamma-{\cal A}\gamma^{2},$ (92) as suggested by Figure 3. Figure 3: Time of flight as a function of energy for a single 0.394481 meter EMMA cell. Here $\gamma_{m}$ corresponds to the reference energy with a minimum time of flight. Provided the time of flight $\Theta_{i}$ at injection energy $\gamma_{i}$ and the time of flight $\Theta_{m}$ at reference energy $\gamma_{m}$ are known, the constants entering equation (92) can be expressed as ${\cal A}={\frac{\Theta_{m}-\Theta_{i}}{{\left(\gamma_{m}-\gamma_{i}\right)}^{2}}},\qquad\qquad\Theta_{0}=\Theta_{m}-{\cal A}\gamma_{m}^{2}.$ (93) Next, we pass to a new variable ${\widehat{\gamma}}=\gamma-\gamma_{m},\qquad\qquad\Theta=\Theta_{m}-{\cal A}{\widehat{\gamma}}^{2},$ (94) similar to the variable ${\widehat{\eta}}$ introduced in the previous section. Then, Hamilton’s equation of motion (90) can be rewritten in an equivalent form ${\frac{{\rm d}\Theta}{{\rm d}s}}={\frac{\Theta_{m}}{L_{p}}}-{\frac{{\cal A}{\widehat{\gamma}}^{2}}{L_{p}}},$ (95) In what follows, it is convenient to introduce a new phase ${\widetilde{\varphi}}$ and the azimuthal angle $\theta$ along the machine circumference as an independent variable according to the relations ${\rm d}s=R{\rm d}\theta,\qquad{\widetilde{\varphi}}={\frac{\omega_{c}\Theta}{c}},\qquad R={\frac{N_{L}L_{p}}{2\pi}}.$ (96) It is straightforward to verify (see the averaging procedure below) that the necessary condition to have acceleration is ${\frac{\omega_{c}N_{L}{\left|\Theta_{m}\right|}}{2\pi c}}=h,$ (97) where $h$ is an integer (a harmonic number). Averaging Hamilton’s equations of motion ${\frac{{\rm d}{\widetilde{\varphi}}}{{\rm d}\theta}}=-h-ha{\widehat{\gamma}}^{2},\qquad\qquad a={\frac{\cal A}{\left|\Theta_{m}\right|}},$ (98) ${\frac{{\rm d}{\widehat{\gamma}}}{{\rm d}\theta}}=-{\frac{ZeU_{c}}{2AE_{p}}}\sum\limits_{k=1}^{N_{c}}\delta_{p}{\left(\theta-\theta_{k}\right)}\sin{\left({\widetilde{\varphi}}-\varphi_{k}\right)},$ (99) we rewrite them in a simpler form as ${\frac{{\rm d}\varphi}{{\rm d}\theta}}=ha{\widehat{\gamma}}^{2},\qquad\qquad{\frac{{\rm d}{\widehat{\gamma}}}{{\rm d}\theta}}=\lambda\sin\varphi,$ (100) where $\varphi=-{\widetilde{\varphi}}-h\theta+\psi_{0},\qquad\qquad\lambda={\frac{ZeU_{c}{\cal D}}{4\pi AE_{p}}},$ (101) ${\cal D}={\sqrt{{\cal A}_{c}^{2}+{\cal A}_{s}^{2}}},\qquad\qquad\psi_{0}=\arctan{\left({\frac{{\cal A}_{s}}{{\cal A}_{c}}}\right)},$ (102) ${\cal A}_{c}=\sum\limits_{k=1}^{N_{c}}\cos{\left(h\theta_{k}+\varphi_{k}\right)},\qquad{\cal A}_{s}=\sum\limits_{k=1}^{N_{c}}\sin{\left(h\theta_{k}+\varphi_{k}\right)}.$ (103) The effective longitudinal Hamiltonian, which governs the equations of motion (100) can be written as $H_{0}={\frac{ha}{3}}{\widehat{\gamma}}^{3}+\lambda\cos\varphi.$ (104) Since the Hamiltonian (104) is a constant of motion, the second Hamilton equation (100) can be written as ${\frac{{\rm d}{\widehat{\gamma}}}{{\rm d}\theta}}=\pm\lambda{\sqrt{1-{\frac{1}{\lambda^{2}}}{\left(H_{0}-{\frac{ha}{3}}{\widehat{\gamma}}^{3}\right)}^{2}}}.$ (105) Figure 4: An example of the so-called serpentine acceleration for the EMMA ring for the central trajectory, where the longitudinal $H_{0}=0$. The harmonic number is assumed to be 11, with the RF wavelength 0.405m. The parameter $a$ from Eq. (98) is taken to be $2.686310^{-5}$. Let us first consider the case of the central trajectory, where $H_{0}=0$. It is of utmost importance for the so called gutter acceleration. Equation (105) can be solved in a straightforward manner to give $\theta={\frac{J}{b}}\,{}_{2}F_{1}{\left({\frac{1}{6}},{\frac{1}{2}};{\frac{7}{6}};J^{6}\right)}-{\frac{\cal C}{b}},$ (106) where $J={\widehat{\gamma}}\,{\sqrt[3]{\frac{ha}{3\lambda}}},\qquad\qquad b=\lambda\,{\sqrt[3]{\frac{ha}{3\lambda}}},$ (107) ${\cal C}={}_{2}F_{1}{\left({\frac{1}{6}},{\frac{1}{2}};{\frac{7}{6}};J_{i}^{6}\right)}J_{i}.$ (108) In the above expressions ${}_{2}F_{1}{\left(\alpha,\beta;\gamma;x\right)}$ denotes the Gauss hypergeometric function of the argument $x$. This case is illustrated in Figure 4. In the general case where $H_{0}\neq 0$, we have $\theta={\frac{J}{b{\sqrt{a_{1}c}}}}\,F_{1}{\left({\frac{1}{3}};{\frac{1}{2}},{\frac{1}{2}};{\frac{4}{3}};{\frac{J^{3}}{a_{1}}},-{\frac{J^{3}}{c}}\right)}-{\frac{{\cal C}_{1}}{b}},$ (109) where $a_{1}=1+{\frac{H_{0}}{\lambda}},\qquad\qquad c=1-{\frac{H_{0}}{\lambda}},$ (110) ${\cal C}_{1}={\frac{J_{i}}{\sqrt{a_{1}c}}}\,F_{1}{\left({\frac{1}{3}};{\frac{1}{2}},{\frac{1}{2}};{\frac{4}{3}};{\frac{J_{i}^{3}}{a_{1}}},-{\frac{J_{i}^{3}}{c}}\right)}.$ (111) Here now, $F_{1}{\left(\alpha;\beta,\gamma;\delta;x,y\right)}$ denotes the Appell hypergeometric function of the arguments $x$ and $y$. The phase portrait corresponding to the general case for a variety of values of the longitudinal Hamiltonian $H_{0}$ is illustrated in Figure 5. ## VI Concluding Remarks Based on the Hamiltonian formalism, the synchro-betatron approach for the description of the dynamics of particles in non scaling FFAG machines has been developed. Its starting point is the specification of the static reference (closed) orbit for a fixed energy as a solution of the equations of motion in the machine reference frame. The problem of dynamical stability and acceleration is sequentially studied in the natural coordinate system associated with the reference orbit thus determined. It has been further shown that the dependence of the path length on the energy deviation can be described in terms of higher order (nonlinear) dispersion functions. The method provides a systematic tool to determine the dispersion functions to every desired order, and represents a natural definition through constitutive equations for the resulting Twiss parameters. The formulation thus developed has been applied to the electron FFAG machine EMMA. The transverse and longitudinal dynamics are explored and an initial attempt is made at understanding the limits of longitudinal stability of such a machine. Unlike the conventional synchronous acceleration, the acceleration process in FFAG accelerators is an asynchronous one in which the reference particle performs nonlinear oscillations around the crest of the RF waveform. To the best of our knowledge, it is the first time that such a fully analytic theory describing the acceleration in non scaling FFAGs has been developed. Figure 5: Examples of serpentine acceleration for the EMMA ring, with varying value of the longitudinal Hamiltonian. The limits of stability are given at values of the longitudinal Hamiltonian of $\pm 0.31272$, corresponding to either a 0 phase at 10MeV, or a $\pi$ phase at 20MeV. ## Appendix A Calculation of the Reference Orbit The explicit solutions of the linearized equations of motion (45) can be used to calculate approximately the reference orbit. To do so, we introduce a state vector ${\bf Z}_{e}={\left(\begin{array}[]{cc}X_{e}\\\ \\\ P_{e}\end{array}\right)}.$ (112) The effect of each lattice element can be represented in a simple form as ${\bf Z}_{out}={\widehat{\cal M}}_{el}{\bf Z}_{in}+{\bf A}_{el}.$ (113) Here ${\bf Z}_{in}$ is the initial value of the state vector, while ${\bf Z}_{out}$ is its final value at the exit of the corresponding element. The transfer matrix ${\widehat{\cal M}}_{el}$ and the shift vector ${\bf A}_{el}$ for various lattice elements are given as follows: 1\. Polygon Bend. Within the approximation (44) considered here we can linearize the second of equations (53) and write ${\widehat{\cal M}}_{p}={\left(\begin{array}[]{cc}1/\cos\Theta_{p}\ \ -X_{c}\tan\Theta_{p}/{\left(\beta_{e}\gamma_{e}\cos\Theta_{p}\right)}\\\ \\\ 0\ \ \ \ \ \ \ \ \ \ 1/\cos^{2}\Theta_{p}\end{array}\right)},$ ${\bf A}_{p}={\left(\begin{array}[]{cc}X_{c}{\left(1-1/\cos\Theta_{p}\right)}\\\ \\\ \beta_{e}\gamma_{e}\tan\Theta_{p}\end{array}\right)}.$ (114) 2\. Drift Space. ${\widehat{\cal M}}_{O}={\left(\begin{array}[]{cc}1\ L_{O}/\beta_{e}\gamma_{e}\\\ \\\ 0\ \ \ \ \ \ \ \ \ 1\end{array}\right)},\qquad\qquad{\bf A}_{O}=0,$ (115) where $L_{O}$ is the length of the drift. Every cell of the EMMA lattice includes a short drift of length $L_{0}$ and a long one of length $L_{1}$. 3\. Focusing Quadrupole. The transfer matrix can be written in a straightforward manner as ${\widehat{\cal M}}_{F}={\left(\begin{array}[]{cc}\cos{\left(\omega_{F}L_{F}\right)}\ \ \ \sin{\left(\omega_{F}L_{F}\right)}/{\left(\beta_{e}\gamma_{e}\omega_{F}\right)}\\\ \\\ -\beta_{e}\gamma_{e}\omega_{F}\sin{\left(\omega_{F}L_{F}\right)}\ \ \ \cos{\left(\omega_{F}L_{F}\right)}\end{array}\right)},$ (116) ${\bf A}_{F}={\left(\begin{array}[]{cc}{\left(X_{c}+d_{F}\right)}{\left[1-\cos{\left(\omega_{F}L_{F}\right)}\right]}\\\ \\\ \beta_{e}\gamma_{e}\omega_{F}{\left(X_{c}+d_{F}\right)}\sin{\left(\omega_{F}L_{F}\right)}\end{array}\right)},$ (117) where $L_{F}$ is the length of the focusing quadrupole. 4\. Defocusing Quadrupole. The transfer matrix in this case can be written in analogy to the above one as ${\widehat{\cal M}}_{D}={\left(\begin{array}[]{cc}\cosh{\left(\omega_{D}L_{D}\right)}\ \ \ \sinh{\left(\omega_{D}L_{D}\right)}/{\left(\beta_{e}\gamma_{e}\omega_{D}\right)}\\\ \\\ \beta_{e}\gamma_{e}\omega_{D}\sinh{\left(\omega_{D}L_{D}\right)}\ \ \ \cosh{\left(\omega_{D}L_{D}\right)}\end{array}\right)},$ (118) ${\bf A}_{D}={\left(\begin{array}[]{cc}{\left(X_{c}+d_{D}\right)}{\left[1-\cosh{\left(\omega_{D}L_{D}\right)}\right]}\\\ \\\ -\beta_{e}\gamma_{e}\omega_{D}{\left(X_{c}+d_{D}\right)}\sinh{\left(\omega_{D}L_{D}\right)}\end{array}\right)},$ (119) where $L_{D}$ is the length of the defocusing quadrupole. Since the reference orbit must be a periodic function of $s$ with period $L_{p}$, it clearly satisfies the condition ${\bf Z}_{out}={\bf Z}_{in}={\bf Z}_{e}.$ (120) Thus, the equation for determining the reference orbit becomes ${\bf Z}_{e}={\widehat{\cal M}}{\bf Z}_{e}+{\bf A},\qquad{\rm or}\qquad{\bf Z}_{e}={\left(1-{\widehat{\cal M}}\right)}^{-1}{\bf A}.$ (121) Here ${\widehat{\cal M}}$ and ${\bf A}$ are the transfer matrix and the shift vector for one period, respectively. The inverse of the matrix $1-{\widehat{\cal M}}$ can be expressed as ${\left(1-{\widehat{\cal M}}\right)}^{-1}={\frac{\cos^{3}\Theta_{p}}{1+{\left(1-{\rm Sp}{\widehat{\cal M}}\right)}\cos^{3}\Theta_{p}}}$ $\times{\left(\begin{array}[]{cc}1-{\cal M}_{22}\ \ \ {\cal M}_{12}\\\ \\\ {\cal M}_{21}\ \ \ 1-{\cal M}_{11}\end{array}\right)}.$ (122) For the EMMA lattice in particular, the components of the one period transfer matrix and shift vector can be written explicitly as ${\cal M}_{11}={\frac{1}{c_{p}}}{\left[c_{F}c_{D}+{\left({\frac{\omega_{D}}{\omega_{F}}}-L_{0}L_{1}\omega_{F}\omega_{D}\right)}s_{F}s_{D}+{\left(L_{0}+L_{1}\right)}\omega_{D}c_{F}s_{D}-L_{1}\omega_{F}s_{F}c_{D}\right]},$ (123) $\displaystyle{\cal M}_{12}={\frac{1}{\beta_{e}\gamma_{e}c_{p}}}{\left\\{{\left({\frac{L_{0}+L_{1}}{c_{p}}}-X_{c}t_{p}\right)}c_{F}c_{D}+{\left[{\left(L_{0}L_{1}\omega_{F}\omega_{D}-{\frac{\omega_{D}}{\omega_{F}}}\right)}X_{c}t_{p}-{\frac{\omega_{F}L_{1}}{\omega_{D}c_{p}}}\right]}s_{F}s_{D}\right.}$ ${\left.+{\left[{\frac{1}{\omega_{D}c_{p}}}-{\left(L_{0}+L_{1}\right)}\omega_{D}X_{c}t_{p}\right]}c_{F}s_{D}+{\left({\frac{1}{\omega_{F}c_{p}}}+L_{1}\omega_{F}X_{c}t_{p}-{\frac{L_{0}L_{1}\omega_{F}}{c_{p}}}\right)}s_{F}c_{D}\right\\}},$ (124) ${\cal M}_{21}=-{\frac{\beta_{e}\gamma_{e}}{c_{p}}}{\left(\omega_{F}s_{F}c_{D}+L_{0}\omega_{F}\omega_{D}s_{F}s_{D}-\omega_{D}c_{F}s_{D}\right)},$ (125) ${\cal M}_{22}={\frac{1}{c_{p}}}{\left[{\frac{c_{F}c_{D}}{c_{p}}}+{\left(L_{0}\omega_{F}\omega_{D}X_{c}t_{p}-{\frac{\omega_{F}}{\omega_{D}c_{p}}}\right)}s_{F}s_{D}+\omega_{F}{\left(X_{c}t_{p}-{\frac{L_{0}}{c_{p}}}\right)}s_{F}c_{D}-\omega_{D}X_{c}t_{p}c_{F}s_{D}\right]},$ (126) $\displaystyle A_{1}=X_{c}+d_{F}+{\left(d_{D}-d_{F}\right)}{\left(c_{F}-L_{1}\omega_{F}s_{F}\right)}+{\left({\frac{X_{c}}{c_{p}}}+d_{D}\right)}$ $\displaystyle\times{\left[L_{1}\omega_{F}s_{F}c_{D}-c_{F}c_{D}-{\left(L_{0}+L_{1}\right)}\omega_{D}c_{F}s_{D}-{\frac{\omega_{D}s_{F}s_{D}}{\omega_{F}}}+L_{0}L_{1}\omega_{F}\omega_{D}s_{F}s_{D}\right]}$ $+t_{p}{\left[{\left(L_{0}+L_{1}\right)}c_{F}c_{D}+{\frac{c_{F}s_{D}}{\omega_{D}}}+{\frac{s_{F}c_{D}}{\omega_{F}}}-{\frac{L_{1}\omega_{F}s_{F}s_{D}}{\omega_{D}}}-L_{0}L_{1}\omega_{F}s_{F}c_{D}\right]},$ (127) $\displaystyle A_{2}=-\beta_{e}\gamma_{e}\omega_{F}{\left(d_{D}-d_{F}\right)}s_{F}+\beta_{e}\gamma_{e}{\left({\frac{X_{c}}{c_{p}}}+d_{D}\right)}{\left(\omega_{F}s_{F}c_{D}+\omega_{F}\omega_{D}L_{0}s_{F}s_{D}-\omega_{D}c_{F}s_{D}\right)}$ $+\beta_{e}\gamma_{e}t_{p}{\left(c_{F}c_{D}-{\frac{\omega_{F}s_{F}s_{D}}{\omega_{D}}}-\omega_{F}L_{0}s_{F}c_{D}\right)}.$ (128) For the sake of brevity, the following notations $c_{p}=\cos\Theta_{p},\quad c_{F}=\cos{\left(\omega_{F}L_{F}\right)},\quad c_{D}=\cosh{\left(\omega_{D}L_{D}\right)},$ (129) $t_{p}=\tan\Theta_{p},\quad s_{F}=\sin{\left(\omega_{F}L_{F}\right)},\quad s_{D}=\sinh{\left(\omega_{D}L_{D}\right)},$ (130) have been introduced in the final expressions for the components of the one period transfer matrix and shift vector. ## Appendix B Phase Stability in FFAGs To study the stability of the serpentine acceleration in FFAG accelerators, we write the longitudinal Hamiltonian (104) in an equivalent form $H_{0}=\lambda{\left(J^{3}+\cos\varphi\right)}.$ (131) Hamilton’s equations of motion can be written as ${\frac{{\rm d}\varphi}{{\rm d}\theta}}=3bJ^{2},\qquad\qquad{\frac{{\rm d}J}{{\rm d}\theta}}=b\sin\varphi.$ (132) Let $\varphi_{a}(\theta)$ and $J_{a}(\theta)$ be the exact solution of equations (132) described already in Section V. Let us further denote by $\varphi_{1}$ and $J_{1}$ a small deviation about this solution such that $\varphi=\varphi_{a}+\varphi_{1}$ and $J=J_{a}+J_{1}$. Then, the linearized equations of motion governing the evolution of $\varphi_{1}$ and $J_{1}$ are ${\frac{{\rm d}\varphi_{1}}{{\rm d}\theta}}=6bJ_{a}J_{1},\qquad\qquad{\frac{{\rm d}J_{1}}{{\rm d}\theta}}=b\varphi_{1}\cos\varphi_{a}.$ (133) The latter should be solved provided the constraint $3J_{a}^{2}J_{1}-\varphi_{1}\sin\varphi_{a}=0,$ (134) following from the Hamiltonian (131) holds. Differentiating the second of equations (133) with respect to $\theta$ and eliminating $\varphi_{1}$, we obtain ${\frac{{\rm d}^{2}J_{1}}{{\rm d}\theta^{2}}}-{\frac{6b^{2}H_{0}}{\lambda}}J_{a}J_{1}+15b^{2}J_{a}^{4}J_{1}=0.$ (135) Next, we examine the case of separatrix acceleration with $H_{0}=0$. In Section V we showed that to a good accuracy the energy gain ${\left[J_{a}(\theta)=b\theta+J_{i}\right]}$ is linear in the azimuthal variable $\theta$. Therefore, equation (135) can be written as ${\frac{{\rm d}^{2}J_{1}}{{\rm d}J_{a}^{2}}}+15J_{a}^{4}J_{1}=0.$ (136) Figure 6: Phase stability of the standard EMMA ring, for the central trajectory at $H_{0}=0$. The errors are given as 0.1MeV in energy and $1.3^{\rm o}$ in phase. The latter possesses a simple solution of the form $J_{1}={\sqrt{\left|J_{a}\right|}}{\left[C_{1}{\cal J}_{1/6}{\left({\sqrt{\frac{5}{3}}}{\left|J_{a}\right|}^{3}\right)}+C_{2}{\cal Y}_{1/6}{\left({\sqrt{\frac{5}{3}}}{\left|J_{a}\right|}^{3}\right)}\right]},$ (137) where ${\cal J}_{\alpha}(z)$ and ${\cal Y}_{\alpha}(z)$ stand for the Bessel functions of the first and second kind, respectively. In addition the constants $C_{1}$ and $C_{2}$ should be determined taking into account the initial conditions ${\frac{{\rm d}J_{1}{\left(J_{i}\right)}}{{\rm d}J_{a}}}=\varphi_{1}{\left(J_{i}\right)}\cos\varphi_{i},\qquad J_{1}{\left(J_{i}\right)}=J_{1i}.$ (138) ## References * (1) A. A. Kolomensky and A. N. Lebedev 1966, “Theory of Cyclic Accelerators”, North-Holland Publishing Company. * (2) A. A. Kolomensky et al. 1955, “Some questions of the theory of cyclic accelerators”, Edition AN SSSR, page 7, PTE, N0. 2, 26(1956). * (3) K. R. Symon et al. 1956, Phys. Rev. 103 (1956) 1837. * (4) D. W. Kerst et al. 1960 , Review of Science Instruments 31 1076\. * (5) M. Aiba et al. 2000, “Development of a FFAG proton synchrotron”, Proceedings of EPAC 2000, p. 581. * (6) R. Edgecock et al., ”EMMA - the World’s First Non-scaling FFAG”, Proceedings of EPAC 2008, p. 3380. * (7) S. L. Smith, ”The Status of the Daresbury Energy Recovery Linac Prototype (ERLP)”, Proceedings of ERL 2007, p. 6. * (8) S. I. Tzenov 2004, “Contemporary Accelerator Physics”, World Scientific.
arxiv-papers
2009-04-14T13:03:33
2024-09-04T02:49:01.863957
{ "license": "Public Domain", "authors": "James K. Jones, Bruno D. Muratori, Susan L. Smith, Stephan I. Tzenov", "submitter": "Stephan Tzenov", "url": "https://arxiv.org/abs/0904.2088" }
0904.2231
# On quantum optical properties of single-walled carbon nanotube Z. L. Guo School of Physics, Peking University, Beijing, 100871, China Z. R. Gong Institute of Theoretical Physics, The Chinese Academy of Sciences, Beijing, 100080, China C. P. Sun Institute of Theoretical Physics, The Chinese Academy of Sciences, Beijing, 100080, China ###### Abstract We study quantum optical properties of the single-walled carbon nanotube (SWCNT) by introducing the effective interaction between the quantized electromagnetic field and the confined electrons in the SWCNT. Our purpose is to explore the quantum natures of electron transport in the SWCNT by probing its various quantum optical properties relevant to quantum coherence, such as the interference of the scattered and emitted photons, and the bunching and anti-bunching of photons which are characterized by the higher order coherence functions. In the strong field limit, we study the interband Rabi oscillation of electrons driven by a classical light. We also investigate the possible lasing mechanism in superradiation of coherent electrons in a SWCNT driven by a light pump or electron injection, which generate electron population inversion in the higher energy-band of SWCNT. ###### pacs: 78.67.Ch, 78.55.-m, 81.07.-b ## I INTRODUCTION Carbon nanotubes (CNTs) have been under great focus these years because of their promising thermal and electrical conductivities, and other unusual features that may lead to new applications Carbon1 ; Carbon2 ; Carbon3 . In recent years, individual single-walled carbon nanotubes (SWCNTs) have experimentally become available for the design of future quantum devices SWCNT1 ; SWCNT2 ; SWCNT3 ; SWCNT4 . Through putting such a SWCNT between electrodes while maintaining a low contact resistance, novel CMOS devices can be made from this novel material field1 ; field2 ; field3 . Surpassing the current silicon-based CMOS devices, CNT-based CMOS devices appear to have the potential for wide applications. To this end, a broad research is required on various aspects of its characteristics beforehand. The conventional investigation for a new material is to explore its photoluminescence optical1 ; optical2 ; optical3 ; optical4 ; optical5 ; optical6 ; optical7 ; optical8 ; optical9 . We usually study the characteristic spectroscopy of the light scattered by or emitted from this material. Meanwhile, since ballistic transport–a motion of electrons with negligible electrical resistivity due to scattering in the process of transportation–happens in a SWCNT at low temperature field1 ; ballistic , SWCNT should be treated beyond the classical scenario, and pure quantum effects should be taken into account. As a result, not only should the classical optical properties (e.g., the intensity, the spectrum, etc,) of the SWCNT be considered, but also the quantum optical properties (e.g., the bunching and antibunching phenomena, etc,) need to be studied in details. In this paper we develop a fully quantum approach for the SWCNT-light interaction to address the quantum effects relevant to the higher order quantum coherence. Our investigation is oriented by the great potential to implement the quantum optical devices based on current carbon nanotube technology, which works in the quantum regime, or at a level of single quantum state. Starting from the minimal coupling theorem, we derive the effective Hamiltonian of the SWCNT interacting with a fully quantized light field. The interband Rabi oscillation is first studied for the light field whose intensity is sufficiently strong to be treated classically. We explore the full quantum features of the transporting electron in the SWCNT which is displayed by its quantum optical properties. To this end, we quantize the light field interacting with the confined electrons in SWCNT, and calculate and analyze the higher order coherence functions of the photons scattered or emitted from the SWCNT. It is shown that the total population inversion of electrons, the first order and the second order coherence functions strongly depends on the chiral vector of the SWCNT, while this dependence does not exist in the generic graphene. Additionally, the anti-bunching feature of the light field is predicted with detailed calculations based on the long time approximation. A similar discovery has been made in an experiment ballistic , but to our best knowledge no microscopic theoretical explanation has been given. This paper is organized as follows. In Sec. II, the interaction between the quantized light field and the SWCNT based on the tight binding approach is derived from the the minimal coupling theorem. In Sec. III, we study the interband Rabi oscillation of the electrons in the SWCNT induced by strong light when the driving light can be treated classically, the reason of which is generally proved in App. A. The interference of the scattered light from the SWCNT and the second order correlation of the emitted photons are investigated in Sec. IV and Sec. V, respectively. Additionally, the possible lasing mechanism of the SWCNT through a light pump or electron injection is discussed in Sec. VI. The conclusions are presented in Sec. VII. ## II MODEL SETUP Figure 1: Schematic illustration of the $2$-D hexagonal lattice of the SWCNT, which contain two sets of sublattices A and B. The pair numbers $(n,m)$ denotes the chiral vector. The difference between carbon nanotubes and graphene is that carbon nanotubes allow merely discrete wave vectors along their specific chiral vector while graphene allows continuous ones, as long as we neglect such effects as distortion of the lattice in carbon nanotubes. Thus, to simplify the modeling of the system in consideration, we can take the tight banding model of graphene into account, and then apply discrete wave vector restriction to demonstrate the properties of the nanotube. The honeycomb lattice of graphene is divided into two triangular sublattices $A$ and $B$ (see Fig. 1). Here, the chiral vector of the SWCNT is denoted as a pair of numbers $(n,m).$ The discrete wave vectors for carbon nanotubes will be directly introduced by boundary conditions later. Since electrons in graphene approximately hop from one site to the nearest neighbor one, a tight binding model $H_{e}=-J\sum\limits_{\mathbf{r}\in A}\sum_{\alpha=1}^{3}[a^{\dagger}(\mathbf{r})b(\mathbf{r}+\mathbf{r}_{\alpha})+h.c.]$ (1) is applied to describe the motion of the electrons in the graphene. Here, $J$ is the hopping constant; $a\ (a^{\dagger})$ and $b\ (b^{\dagger})$ annihilates (creates) an electron at sublattice $A$ and $B$, respectively. And $\mathbf{r}_{\alpha}$ $(\alpha=1,2,3)$ are the real space vectors pointing from one site to its nearest neighbors. Usually they are chosen as $\displaystyle\mathbf{r}_{1}$ $\displaystyle=$ $\displaystyle\frac{l}{\sqrt{3}}(0,-1),$ (2a) $\displaystyle\mathbf{r}_{2}$ $\displaystyle=$ $\displaystyle\frac{l}{\sqrt{3}}(\frac{\sqrt{3}}{2},\frac{1}{2}),$ (2b) $\displaystyle\mathbf{r}_{3}$ $\displaystyle=$ $\displaystyle\frac{l}{\sqrt{3}}(-\frac{\sqrt{3}}{2},\frac{1}{2})$ (2c) , and are schematically plotted in Fig. 1. Here, $l$ is the lattice constant of both the triangular sublattice $A$ and $B.$ To diagonalize the above tight banding Hamiltonian, a 2D Fourier transformation $c_{\mathbf{k}}=\sum\limits_{\mathbf{r}\in C}c(\mathbf{r})e^{-i\mathbf{k}\cdot\mathbf{r}},(c=a\text{ or }b,C=A\text{ or }B).$ (3) is used to give the momentum space- representation of the Hamiltonian (1) $H_{e}=\sum\limits_{\mathbf{k}}\left(\Phi_{\mathbf{k}}a_{\mathbf{k}}^{\dagger}b_{\mathbf{k}}+h.c.\right).$ (4) Here the transition energy $\Phi_{\mathbf{k}}\equiv-J\sum\limits_{\mathbf{\delta}\in\\{\mathbf{r}_{\alpha}\\}}e^{i\mathbf{k}\cdot\mathbf{\delta}}$ is a summation over all the directions of nearest neighbors. It is explicitly written as $\Phi_{\mathbf{k}}=-Je^{i\frac{k_{x}l}{\sqrt{3}}}\left(1+2\cos\frac{k_{y}l}{2}e^{-i\frac{\sqrt{3}k_{x}l}{2}}\right).$ (5) and corresponds to the transition of electrons between two sublattices $A$ and $B$. Further, this Hamiltonian (4) is diagonalized as $H_{e}=\sum\limits_{\mathbf{k}}E_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}}\right)$ (6) through a unitary transformation $\displaystyle\alpha_{\mathbf{k}}$ $\displaystyle=$ $\displaystyle\frac{1}{\sqrt{2}}\left(e^{-i\varphi_{\mathbf{k}}}a_{\mathbf{k}}+e^{i\varphi_{\mathbf{k}}}b_{\mathbf{k}}\right),$ (7a) $\displaystyle\beta_{\mathbf{k}}$ $\displaystyle=$ $\displaystyle\frac{1}{\sqrt{2}}\left(e^{-i\varphi_{\mathbf{k}}}a_{\mathbf{k}}-e^{i\varphi_{\mathbf{k}}}b_{\mathbf{k}}\right).$ (7b) Here, the single particle spectrum is $E_{\mathbf{k}}=J\sqrt{1+4\cos(\frac{k_{x}l}{2})\left[\cos(\frac{\sqrt{3}}{2}k_{y}l)+\cos(\frac{k_{x}l}{2})\right]}$ (8) with the phase $\varphi_{\mathbf{k}}$ determined by $\tan 2\varphi_{\mathbf{k}}=-\frac{2\cos\left(k_{x}l/2\right)\sin\left(\sqrt{3}k_{y}l/2\right)}{1+2\cos\left(k_{x}l/2\right)\cos\left(\sqrt{3}k_{y}l/2\right)}.$ (9) We have to point out that the energy $2E_{\mathbf{k}}$ of single electron excitation actually has six Dirac points on the six vertices of the first Brillouin Zone in the momentum space. It has been discovered that in the vicinity of Dirac points, the effective motion of the electrons accords with the relativistic theory, which is described by the massless or massive Dirac equation with an effective light velocity . In order to study the quantum optical properties of the nanotubes, it is necessary to introduce a quantized light field $H_{p}=\sum\limits_{\mathbf{q}}\hbar\Omega_{\mathbf{q}}d_{\mathbf{q}}^{\dagger}d_{\mathbf{q}},$ (10) where $\Omega_{\mathbf{q}}$ is the frequency of photons with momentum $\mathbf{q}$. $d_{\mathbf{q}}^{\dagger}$ and $d_{\mathbf{q}}$ creates and annihilates a photon with momentum $\mathbf{q},$ respectively. We choose $\hbar=1$ and only one polarization direction for each mode of light denoted by $\mathbf{q}$ in the following discussions. The interaction between the carbon nanotube and the light field is obtained according to the minimal coupling principle of electromagnetic field. By replacing the mechanical momentum of the electrons with canonical ones and neglecting the multi-photon interactions, the interaction Hamiltonian is obtained as $H_{I}=-\frac{e}{mc}\sum\limits_{\mathbf{k},\mathbf{q}}\mathbf{k}\cdot\mathbf{A}_{\mathbf{q}}\left(a_{\mathbf{k}}^{\dagger}+b_{\mathbf{k}}^{\dagger}\right)\left(a_{\mathbf{k-q}}+b_{\mathbf{k-q}}\right).$ (11) Here, the vector potential of the quantized light field is $\mathbf{A}_{\mathbf{q}}=-i\sqrt{\frac{1}{2\epsilon_{0}V\Omega_{\mathbf{q}}}}\mathbf{e}_{\mathbf{q}}\left(d_{\mathbf{q}}-d_{-\mathbf{q}}^{\dagger}\right),$ (12) where $\mathbf{e}_{\mathbf{q}}$ is the unit polarization vector of mode $\mathbf{q}.$ $\epsilon_{0}$ is the vacuum electric permittivity and $V$ is the volume effectively occupied by the light field. So far, we have obtained the quantized mode of the SWCNT interacting with a light field, whose Hamiltonian is $H=H_{e}+H_{p}+H_{I}$, with $\displaystyle H_{e}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{k}}E_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}}\right),$ (13a) $\displaystyle H_{p}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{q}}\hbar\Omega_{\mathbf{q}}d_{\mathbf{q}}^{\dagger}d_{\mathbf{q}},$ (13b) $\displaystyle H_{I}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k},\mathbf{q}}D_{\mathbf{k,q}}\left(d_{\mathbf{q}}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}-\mathbf{q}}+h.c.\right),$ (13c) where we have made the rotating wave approximation to eliminate the fast varying terms, such as $d_{-\mathbf{q}}^{\dagger}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}$, $d_{\mathbf{q}}\beta_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k-q}}$, $d_{-\mathbf{q}}^{\dagger}\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k-q}}$, $d_{\mathbf{q}}\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k-q}}$, $d_{-\mathbf{q}}^{\dagger}\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}$, and $d_{\mathbf{q}}\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}$, and the coefficient $D_{\mathbf{k,q}}$ for electron-photon interaction is $\displaystyle D_{\mathbf{k,q}}$ $\displaystyle=$ $\displaystyle-\frac{e}{\sqrt{2}mc}\mathbf{k}\cdot\mathbf{e}_{\mathbf{q}}\sqrt{\frac{\hbar}{2\epsilon_{0}V\Omega_{\mathbf{q}}}}(\cos\varphi_{\mathbf{k}}\sin\varphi_{\mathbf{k-q}}$ (14) $\displaystyle+\cos\varphi_{\mathbf{k-q}}\sin\varphi_{\mathbf{k}}).$ We note that when interaction between the light field and the SWCNT is significant, the momentum of photons in the light field is approximately $\left|\mathbf{q}\right|\sim 10^{7}m^{-1}$, which is much smaller than the momentum of the electron near the boundary of the first Brillouin Zone of graphene $\left|\mathbf{k}\right|\sim 10^{10}m^{-1}.$ Thus we neglect the momentum $\mathbf{q}$ of photons so that $\cos\varphi_{\mathbf{k}}\sin\varphi_{\mathbf{k-q}}\approx\cos\varphi_{\mathbf{k-q}}\sin\varphi_{\mathbf{k}}\approx\sin[2\varphi_{\mathbf{k}}]/2$, and the coefficient $D_{\mathbf{k,q}}$ is approximately $D_{\mathbf{k,q}}=-\frac{e}{\sqrt{2}mc}\mathbf{k}\cdot\mathbf{e}_{\mathbf{q}}\sqrt{\frac{\hbar}{2\epsilon_{0}V\Omega_{\mathbf{q}}}}\sin 2\varphi_{\mathbf{k}}.$ (15) Specially, $D_{\mathbf{k,q}}$ is taken average over all polarization directions of the light field to obtain the final $D_{\mathbf{k,q}}$ we use in calculations. Figure 2: (a)The energy spectrum $E(k)$ of graphene versus $k$. (b)The interaction intensity $D(k)$ between electrons in graphene and single-mode light, in which we take the average over all the possible directions for e(q). The single quasi-particle energy $E_{\mathbf{k}}$ and the interaction coefficient $D_{\mathbf{k,q}}$ are plotted versus the momentum $\mathbf{k}$ of the electrons in Fig. 2. The six Dirac points are clear to be found at the degeneracy points of upper and lower bands in Fig. 2(a). For the photon momentum $\left|\mathbf{q}\right|\mathbf{\ll\left|\mathbf{k}\right|}$ chosen in Fig. 2(b), the absolute value of the interaction coefficient $D_{\mathbf{k,q}}$ becomes large when $\mathbf{k}$ is near the boundary of the first Brillouin Zone and decreases rapidly as $\mathbf{k}$ deviate from that boundary. ## III Interband Rabi Oscillation Induced by Strong Light Field The general photon-electron interaction contains multi-mode light field, which case is too complex to be analytically treated in revealing the essential properties. Thus, we simplify the Hamiltonian by making the reasonable assumption that only one particular quantum mode of the light field would dominate the dynamics. This could be experimentally realized by adding a high- finesse microcavity to the system to pick out a single mode of quantized light under consideration. In this sense, the model Hamiltonian is reduced to $H=H_{0}+H_{1},$ where $\displaystyle H_{0}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{k}}E_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}}\right)+\Omega d^{\dagger}d,$ (16a) $\displaystyle H_{1}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(d\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right),$ (16b) indicates that a single-mode light field would induce the coherent transitions of electrons between the upper band and the lower band. The output of the electronic flow would display an obvious resonance, namely, Rabi oscillation, which is experimentally observable. In the strong light limit, the light field can be treated as a classical one, where the creation and annihilation operators $d^{\dagger}$ and $d$ are replaced by C-numbers, namely $d\rightarrow\sqrt{N}e^{-i\Omega t},d^{\dagger}\rightarrow\left(d\right)^{\ast}.$ (17) with $N$ the total number of photons. This approximation is valid since in a strong light field only the intensity of the light plays an important role. We can generally prove this classical approximation in App. A. Then we obtain the semi-classical Hamiltonian $H(t)=\sum\limits_{\mathbf{k}}h_{\mathbf{k}}(t),$ in which the single momentum Hamiltonian is $\displaystyle h_{\mathbf{k}}(t)$ $\displaystyle=$ $\displaystyle E_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}-\mathbf{q}}^{\dagger}\beta_{\mathbf{k}-\mathbf{q}}\right)+$ (18) $\displaystyle\sqrt{N}D_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}-\mathbf{q}}e^{-i\Omega t}+h.c.\right).$ for electrons with momentum $\mathbf{k}$. Here, we have neglected the constant $N\Omega$ in the total energy of the light field and the difference between $E_{\mathbf{k}}$ and $E_{\mathbf{k-q}}$ for the reason mentioned at the end of Sec. II. In terms of the quasi-spin operators $\displaystyle S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}-\mathbf{q}}^{\dagger}\beta_{\mathbf{k}-\mathbf{q}}\right),$ (19a) $\displaystyle S_{\mathbf{k}}^{+}$ $\displaystyle=$ $\displaystyle\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}-\mathbf{q}},S_{\mathbf{k}}^{-}=\left(S_{\mathbf{k}}^{+}\right)^{\dagger},$ (19b) which obviously satisfy the commutation relations of the regular spin-$1/2$ operators, the above single momentum Hamiltonian is rewritten as $h_{\mathbf{k}}(t)=E_{\mathbf{k}}S_{\mathbf{k}}^{z}+\sqrt{N}D_{\mathbf{k}}\left(S_{\mathbf{k}}^{+}e^{-i\Omega t}+h.c.\right).$ (20) It describes a quasi-spin precession in a time-dependent effective magnetic field $\mathbf{B=(}\sqrt{N}D_{\mathbf{k}}\cos\Omega t,\sqrt{N}D_{\mathbf{k}}\sin\Omega t,E_{\mathbf{k}}\mathbf{).}$ (21) Such spin precession is just the Rabi oscillation between bands. To solve the dynamic equation governed by $h_{\mathbf{k}}(t),$ a time- dependent unitary transformation $U(t)=\exp(i\Omega S_{\mathbf{k}}^{z}t),$ (22) is used to transform the Hamiltonian above into a time-independent one $h_{\mathbf{k}}^{\prime}=U^{\dagger}h_{\mathbf{k}}(t)U-i\partial_{t}U^{\dagger}U$ or $h_{\mathbf{k}}^{\prime}=-\Delta_{\mathbf{k}}S_{\mathbf{k}}^{z}+\sqrt{N}D_{\mathbf{k}}S_{\mathbf{k}}^{+}+h.c$ (23) Here, $\Delta_{\mathbf{k}}=\Omega-2E_{\mathbf{k}}.$ (24) is the detuning between the energy of the light field and that of the quasi- spin. The Heisenberg equations of the system $\displaystyle i\frac{\partial}{\partial t}S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\varepsilon_{\mathbf{k}}\sin\theta_{\mathbf{k}}[S_{\mathbf{k}}^{+}-S_{\mathbf{k}}^{-}],$ (25a) $\displaystyle i\frac{\partial}{\partial t}S_{\mathbf{k}}^{\pm}$ $\displaystyle=$ $\displaystyle\pm\varepsilon_{\mathbf{k}}[\cos\theta_{\mathbf{k}}S_{\mathbf{k}}^{\pm}+\sin\theta_{\mathbf{k}}S_{\mathbf{k}}^{z}],$ (25b) determine the Rabi oscillation of the electrons with momentum $\mathbf{k}$ between the upper and lower bands. Here the mixing angle $\theta_{\mathbf{k}}$ is defined by $\displaystyle\cos\theta_{\mathbf{k}}$ $\displaystyle=$ $\displaystyle\frac{\Delta_{\mathbf{k}}}{\varepsilon_{\mathbf{k}}},$ (26a) $\displaystyle\sin\theta_{\mathbf{k}}$ $\displaystyle=$ $\displaystyle\frac{2\sqrt{N}D_{\mathbf{k}}}{\varepsilon_{\mathbf{k}}},$ (26b) $\displaystyle\varepsilon_{\mathbf{k}}^{2}$ $\displaystyle=$ $\displaystyle\Delta_{\mathbf{k}}^{2}+4ND_{\mathbf{k}}^{2}.$ (26c) The above first order partial differential equations (25a)-(25b) with initial operators $S_{\mathbf{k}}^{z}(0)$ and $S_{\mathbf{k}}^{\pm}(0)$ is solved through the Laplace transformation $\lambda(p)=\int\limits_{0}^{+\infty}\lambda(t)e^{-pt}dt,$ (27) which gives $\displaystyle pS_{\mathbf{k}}^{z}-S_{\mathbf{k}}^{z}(0)$ $\displaystyle=$ $\displaystyle-i\frac{1}{2}\varepsilon_{\mathbf{k}}\sin\theta_{\mathbf{k}}[S_{\mathbf{k}}^{+}-S_{\mathbf{k}}^{-}],$ (28a) $\displaystyle pS_{\mathbf{k}}^{\pm}-S_{\mathbf{k}}^{\pm}(0)$ $\displaystyle=$ $\displaystyle\mp i\varepsilon_{\mathbf{k}}[\cos\theta_{\mathbf{k}}S_{\mathbf{k}}^{\pm}+\sin\theta_{\mathbf{k}}S_{\mathbf{k}}^{z}].$ (28b) In terms of the normalized Laplacian parameter $p^{\prime}=p/\varepsilon_{\mathbf{k}},$ the above equation is solved as $\displaystyle S_{\mathbf{k}}^{z}(p^{\prime})$ $\displaystyle=$ $\displaystyle\frac{S_{\mathbf{k}}^{z}(0)}{\varepsilon_{\mathbf{k}}}\frac{[p^{\prime 2}+\cos^{2}\theta_{\mathbf{k}}]}{p^{\prime}[p^{\prime 2}+1]}+\frac{S_{\mathbf{k}}^{y}(0)}{\varepsilon_{\mathbf{k}}}\frac{\sin\theta_{\mathbf{k}}}{p^{\prime 2}+1}$ (29a) $\displaystyle-\frac{S_{\mathbf{k}}^{x}(0)}{\varepsilon_{\mathbf{k}}}\frac{\sin\theta_{\mathbf{k}}\cos\theta_{\mathbf{k}}}{p^{\prime}[p^{\prime 2}+1]},$ $\displaystyle S_{\mathbf{k}}^{\pm}(p^{\prime})$ $\displaystyle=$ $\displaystyle\frac{1}{\varepsilon_{\mathbf{k}}}\frac{S_{\mathbf{k}}^{\pm}(0)\mp i\sin\theta_{\mathbf{k}}S_{\mathbf{k}}^{z}(p^{\prime})}{p^{\prime}\pm i\cos\theta_{\mathbf{k}}},$ (29b) where $\displaystyle S_{\mathbf{k}}^{x}$ $\displaystyle=$ $\displaystyle\frac{1}{2}(S_{\mathbf{k}}^{+}+S_{\mathbf{k}}^{-}),$ (30a) $\displaystyle S_{\mathbf{k}}^{y}$ $\displaystyle=$ $\displaystyle\frac{1}{2i}(S_{\mathbf{k}}^{+}-S_{\mathbf{k}}^{-}).$ (30b) In the SWCNT, the electrons fill up the lower band when the system stays at its ground state at zero temperature. As a consequence, we may simply set $S_{\mathbf{k}}^{x}(0)$ and $S_{\mathbf{k}}^{y}(0)$ as zero for convenience in the following discussions. The inverse Laplace transformation gives the time evolution of $S_{\mathbf{k}}^{z}(t)$ and $S_{\mathbf{k}}^{\pm}(t)$ respectively $S_{\mathbf{k}}^{z}(t)=S_{\mathbf{k}}^{z}(0)\left[\cos^{2}\theta_{\mathbf{k}}+\sin^{2}\theta_{\mathbf{k}}\cos\left(\varepsilon_{\mathbf{k}}t\right)\right].$ (31) and $\displaystyle S_{\mathbf{k}}^{\pm}(t)$ $\displaystyle=$ $\displaystyle- S_{\mathbf{k}}^{z}(0)\sin\theta_{\mathbf{k}}\cos\theta_{\mathbf{k}}[1-\cos\left(\varepsilon_{\mathbf{k}}t\right)]$ (32) $\displaystyle\mp iS_{\mathbf{k}}^{z}(0)\sin\theta_{\mathbf{k}}\sin\left(\varepsilon_{\mathbf{k}}t\right).$ Finally, the total population inversion $W(t)=\sum\limits_{\mathbf{k}}\left\langle S_{\mathbf{k}}^{z}(t)+\frac{1}{2}\right\rangle$ (33) is calculated as the summation over those of single momentum, which reads $W(t)=\sum\limits_{\mathbf{k}}\left\\{\left\langle S_{\mathbf{k}}^{z}(0)\right\rangle\left[1-2\sin^{2}\theta_{\mathbf{k}}\sin^{2}\left(\frac{\varepsilon_{\mathbf{k}}t}{2}\right)\right]+\frac{1}{2}\right\\}.$ (34) When the temperature is zero, the system stays at its ground state and thus $\left\langle S_{\mathbf{k}}^{z}(t=0)\right\rangle=-1/2$ is valid for all $\mathbf{k}$. Then the total population inversion is obtained $W(t)=\sum\limits_{\mathbf{k}}\frac{1}{2}\sin^{2}\theta_{\mathbf{k}}\\{1-\cos\left(\varepsilon_{\mathbf{k}}t\right)\\}$ (35) If we consider the continuous momentum in a 2-D graphene and the inhomogeneously-broadened system in which different quasi-spins have different momentums by introducing the distribution $g(\varepsilon_{\mathbf{k}})$ centered on $\varepsilon_{\mathbf{0}}$ as $g(\varepsilon_{\mathbf{k}})=2\sqrt{\pi}T\exp\left[-T^{2}\left(\varepsilon_{\mathbf{k}}-\varepsilon_{\mathbf{0}}\right)^{2}\right],$ (36) which satisfies $\frac{1}{2\pi}\int_{\infty}^{-\infty}g(\varepsilon_{\mathbf{k}})d\varepsilon_{\mathbf{k}}=1$. When $2\sqrt{N}D_{\mathbf{k}}\gg\Delta_{\mathbf{k}}$ results in $\sin\theta_{\mathbf{k}}\simeq 1$, the total population inversion can be calculated as $\displaystyle W(t)$ $\displaystyle=$ $\displaystyle\frac{1}{4\pi}\int_{\infty}^{-\infty}g(\varepsilon_{\mathbf{k}})\\{1-\cos\left(\varepsilon_{\mathbf{k}}t\right)\\}d\varepsilon_{\mathbf{k}}\mbox{}$ (37) $\displaystyle=$ $\displaystyle\frac{1}{2}\left[1-\cos\left(\varepsilon_{\mathbf{0}}t\right)\right]\exp\left(-\frac{t^{2}}{4T^{2}}\right).$ It must be pointed out that the time dependence of the total population inversion includes two aspects when the energy distribution is Gaussian type. One is the periodic factor as $(1-\cos\left(\varepsilon_{\mathbf{0}}t\right))$ resulting from the central frequency of the Gaussian distribution. The other is the exponential decay $\exp\left(-\frac{t^{2}}{4T^{2}}\right)$ resulted from the broadening of the Gaussian distribution. The randomness of the energy spectrum of the quasi-spins actually induces these effects, which can be considered as a kind of spin echo. Figure 3: Population inversion of electrons in the SWCNT is plotted versus time. The parameters for the SWCNT are respectively: (1)chiral vector is $(6,4)$, $\Omega=0.4$, $\tau=5$ for the black short dotted line; (2)chiral vector is $(8,0)$, $\Omega=2$, $\tau=5$ for the red solid line; (3)chiral vector is $(8,0)$, $\Omega=2$, $\tau=70$ for the blue short dashed line. Here, $\tau$ is the time scale. From Fig. 3 for the population inversion of the $(2n,0)$ SWCNTs with the incurring light frequency of $\Omega=2J$, we may see that a considerable proportion of the electrons are excited to the upper band (more than $1/15$ for $(8,0)$ SWCNT), and exhibits collapse and revival in a long period of time. The explanation for it is straightforward: in the $(2n,0)$ SWCNTs, there are large degeneracies of possible states onto the equi-energy lines $E=J$ of the $2$-D graphene energy bands. Thus, the $(2n,0)$ SWCNTs are potential experimental candidates for the demonstration of Rabi oscillation in solids. ## IV First Order Coherence of Scattered and Emitted Photons The strong light field only couples the upper and lower bands of electrons through its intensity, which essentially cancels the quantum optical features of the SWCNT characterized by the higher order quantum coherence. To save curiosity of quantized light field interacting with SWCNT, we return to the Hamiltonian Eq.(16a)-(16b) The first order correlation function of the light field $G^{(1)}(\tau)=\left\langle d^{+}(t)d(t+\tau)\right\rangle$ (38) to characterize the interference of the electrons in SWCNT is independent of $t$ after long time evolution $t\rightarrow+\infty$, which corresponds to the steady solution for the light-SWCNT coupling system. In the interaction picture with respect to $H_{0}=\Omega d^{\dagger}d+\sum\limits_{\mathbf{k}}\Omega S_{\mathbf{k}}^{z},$ (39) the Langevin equations read as $\displaystyle\frac{\partial}{\partial t}d$ $\displaystyle=$ $\displaystyle-i\sum\limits_{\mathbf{k}}D_{\mathbf{k}}S_{\mathbf{k}}^{-},$ (40a) $\displaystyle\frac{\partial}{\partial t}S_{\mathbf{k}}^{-}$ $\displaystyle=$ $\displaystyle\left(i\Delta_{\mathbf{k}}-\gamma_{\mathbf{k}}\right)S_{\mathbf{k}}^{-}+2iD_{\mathbf{k}}S_{\mathbf{k}}^{z}d,$ (40b) $\displaystyle\frac{\partial}{\partial t}S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle-2\gamma_{\mathbf{k}}(S_{\mathbf{k}}^{z}+\frac{1}{2})+iD_{\mathbf{k}}(d^{\dagger}S_{\mathbf{k}}^{-}-S_{\mathbf{k}}^{+}d).$ (40c) Here, we phenomenologically add decay terms of the SWCNT part to the Langevin equations, while neglect the decay of light field since an ideal probe is considered. We also assume that the SWCNT system reaches its equilibrium state with the light field before there is considerable change in the light field. Actually, this assumption is very crucially used in Haken’s theory of laser Laser . By setting the time derivatives of the $S$ operators as zero, the steady solution of the total system can be obtained with steady quasi-spin operators $\displaystyle S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle-\frac{\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2}}{2(\Delta_{\mathbf{k}}^{2}+2d^{\dagger}dD_{\mathbf{k}}^{2}+\gamma_{\mathbf{k}}^{2})},$ (41a) $\displaystyle S_{\mathbf{k}}^{-}$ $\displaystyle=$ $\displaystyle-\frac{iD_{\mathbf{k}}(\gamma_{\mathbf{k}}-i\Delta_{\mathbf{k}})d}{\Delta_{\mathbf{k}}^{2}+2d^{\dagger}dD_{\mathbf{k}}^{2}+\gamma_{\mathbf{k}}^{2}}.$ (41b) Therefore, if the number of photons does not fluctuate intensively long time after the light is turned on, we could simply set the particle number operator $d^{\dagger}d=N$ as a constant. In order to study the first order coherence of the light field, we use the mean field approach for the Langevin equations of the above system by setting $S_{\mathbf{k}}^{z}d\approx\left.\left\langle S_{\mathbf{k}}^{z}(t)\right\rangle\right|_{t\rightarrow\infty}d(\tau)\equiv S_{\mathbf{k}}^{z}(\infty)d(\tau)$ (42) for long time evolution. Here we can analytically calculate the first order correlation function through the partial differential equations (40a-40c). After applying Laplace transformation to Eq. (40a-40c), we have $\displaystyle pd-d(0)$ $\displaystyle=$ $\displaystyle-i\sum\limits_{\mathbf{k}}D_{\mathbf{k}}S_{\mathbf{k}}^{-},$ (43a) $\displaystyle\left(p-i\Delta_{\mathbf{k}}^{\prime}\right)S_{\mathbf{k}}^{-}$ $\displaystyle=$ $\displaystyle 2iD_{\mathbf{k}}\left.\left\langle S_{\mathbf{k}}^{z}(t)\right\rangle\right|_{t\rightarrow\infty}d+S_{\mathbf{k}}^{-}(0),$ (43b) for the effective detuning $\Delta_{\mathbf{k}}^{\prime}=\Delta_{\mathbf{k}}+i\gamma_{\mathbf{k}}.$ This gives the solution of $d(p)$ as $d(p)=\frac{d(0)+\Lambda^{-}(p)}{p-\Lambda^{z}(p)}.$ (44) Here, $\Lambda^{-}(p)=-i\sum\limits_{\mathbf{k}}\frac{D_{\mathbf{k}}S_{\mathbf{k}}^{-}(0)}{p-i\Delta_{\mathbf{k}}^{\prime}}$ (45) represents the contribution from $S_{\mathbf{k}}^{-}(0)$, while contribution from the long time evolution of $\left\langle S_{\mathbf{k}}^{z}\right\rangle$ is given by $\Lambda^{z}(p)=\sum\limits_{\mathbf{k}}\frac{2D_{\mathbf{k}}^{2}\left.\left\langle S_{\mathbf{k}}^{z}(t)\right\rangle\right|_{t\rightarrow\infty}}{p-i\Delta_{\mathbf{k}}^{\prime}}.$ (46) Since the electron-photon interaction serves as a perturbation term in the Hamiltonian, the singularities of the $d(p)$ is mainly determined by the denominator $p-\Lambda^{z}(p)$. Under the Wigner-Weisskopf approximation, the $0$-th order zero point of the denominator is $p=0,$ and to the $1$-st order it is $p=-i\Omega^{\prime}-\Gamma^{\prime},$ (47) where the renormalized frequency and the effective decay are $\displaystyle\Omega^{\prime}$ $\displaystyle=$ $\displaystyle-\mathrm{Im}\Lambda^{z}(0),$ (48a) $\displaystyle\Gamma^{\prime}$ $\displaystyle=$ $\displaystyle-\mathrm{Re}\Lambda^{z}(0).$ (48b) Applying the inverse Laplace transformation, we obtain an expression for $d(\tau)$ as $d(\tau)=\exp\left(-i\Omega^{\prime}\tau-\Gamma^{\prime}\tau\right)\left[d(0)+F(\tau)\right],$ (49) where the contribution from $S_{\mathbf{k}}^{-}(0)$ is $F(\tau)=-i\sum\limits_{\mathbf{k}}\frac{D_{\mathbf{k}}S_{\mathbf{k}}^{-}(0)}{\mu_{\mathbf{k}}+i\nu_{\mathbf{k}}}\left[1-e^{-i\mu_{\mathbf{k}}\tau-\nu_{\mathbf{k}}\tau}\right],$ (50) with $\mu_{\mathbf{k}}=\left(-\Delta_{\mathbf{k}}-\Omega^{\prime}\right)$ and $\nu_{\mathbf{k}}=\left(\gamma_{\mathbf{k}}-\Gamma^{\prime}\right).$ If we compare a quasi-spin system to a heat bath, the term $F(\tau)$ represents its induced quantum fluctuation. The couplings of the light field to SWCNT is characterized by $\displaystyle\Omega^{\prime}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{k}}\frac{D_{\mathbf{k}}^{2}}{\Delta_{\mathbf{k}}^{2}+2ND_{\mathbf{k}}^{2}+\gamma_{\mathbf{k}}^{2}}\Delta_{\mathbf{k}},$ (51a) $\displaystyle\Gamma^{\prime}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{k}}\frac{D_{\mathbf{k}}^{2}}{\Delta_{\mathbf{k}}^{2}+2ND_{\mathbf{k}}^{2}+\gamma_{\mathbf{k}}^{2}}\gamma_{\mathbf{k}},$ (51b) where the explicit steady solution for $S_{\mathbf{k}}^{z}$ that has been used. The contribution $\left\langle d^{+}(0)F(\tau)\right\rangle$ from $S_{\mathbf{k}}^{-}(0)$ in the first order correlation $G^{(1)}(\tau)=\exp\left(-i\Omega^{\prime}\tau-\Gamma^{\prime}\tau\right)\left(G^{(1)}(0)+\left\langle d^{+}(0)F(\tau)\right\rangle\right)$ (52) vanishes since the average on the photon number states reduces to zero due to the photon number conservation. Then the normalized first order coherence function $g^{(1)}(\tau)\equiv G^{(1)}(\tau)/G^{(1)}(0)$ is explicitly written as $g^{(1)}(\tau)=\exp\left(-i\Omega^{\prime}\tau-\Gamma^{\prime}\tau\right),$ (53) which is used to measure the interference of the scattered and emitted photons. It is clear that long time first order correlation of the light field vanishes exponentially with $\tau$. In most cases, considering that the decay rates $\gamma_{\mathbf{k}}$ are much smaller than the detuning $\Delta_{\mathbf{k}}$, $\Gamma^{\prime}\ll\Omega^{\prime}$ is obviously satisfied. Thus, neglecting the decay effect in the first order coherence, the existence of SWCNT contributes to the first order coherence a shift $\Omega^{\prime}$ in the frequency of light. ## V Second Order Correlation of The Scattered and Emitted Light The first order coherence function only demonstrates the interference of the scattered and emitted photon. To distinguish the fully quantum optical properties of the SWCNT, e.g. , the bunching and anti-bunching of the photons, the second order coherence function $G^{(2)}(\tau)=\left\langle d^{\dagger}(t)d^{\dagger}(t+\tau)d(t+\tau)d(t)\right\rangle$ (54) is needed. According to Eq. (47), we calculate $\displaystyle G^{(2)}(\tau)$ $\displaystyle=$ $\displaystyle\exp\left(-2\Gamma^{\prime}\tau\right)G^{(2)}(0)$ (55) $\displaystyle+\exp\left(-2\Gamma^{\prime}\tau\right)\left\langle d^{\dagger}(0)F^{\dagger}(\tau)F(\tau)d(0)\right\rangle,$ where we have neglected terms $\left\langle d^{\dagger}(0)d^{\dagger}(0)F(\tau)d(0)\right\rangle$ and $\left\langle d^{\dagger}(0)F^{\dagger}(\tau)d(0)d(0)\right\rangle$ because of the photon number conservation for the light field. Neglecting correlation between different quasi-spins, only terms with the same momentum can survive in $F^{\dagger}(\tau)$ and $F(\tau).$ Therefore, the non-vanishing second term is calculated as $\displaystyle\left\langle d^{\dagger}(0)F^{\dagger}(\tau)F(\tau)d(0)\right\rangle$ (56) $\displaystyle\approx$ $\displaystyle\sum\limits_{\mathbf{k}}f_{\mathbf{k}}(\tau)\left\langle d^{\dagger}(0)S_{\mathbf{k}}^{+}(0)S_{\mathbf{k}}^{-}(0)d(0)\right\rangle$ $\displaystyle\approx$ $\displaystyle\sum\limits_{\mathbf{k}}f_{\mathbf{k}}(\tau)\left\langle d^{\dagger}(0)d(0)\right\rangle\left(\left.\left\langle S_{\mathbf{k}}^{z}(t)\right\rangle\right|_{t\rightarrow\infty}+\frac{1}{2}\right),$ where the time dependent coefficients are $f_{\mathbf{k}}(\tau)=\frac{2D_{\mathbf{k}}^{2}}{\mu_{\mathbf{k}}^{2}+\nu_{\mathbf{k}}^{2}}\left[\cosh\left(\nu_{\mathbf{k}}\tau\right)-\cos\left(\mu_{\mathbf{k}}\tau\right)\right]e^{-\nu_{\mathbf{k}}\tau}.$ (57) Accordingly, the normalized second order coherence function $g^{(2)}(\tau)\equiv G^{(2)}(\tau)/\left|G^{(1)}(0)\right|^{2}$ is written as $\displaystyle g^{(2)}(\tau)$ $\displaystyle=$ $\displaystyle\exp\left(-2\Gamma^{\prime}\tau\right)\left[\frac{G^{(2)}(0)}{G^{(1)}(0)^{2}}\right.+$ (58) $\displaystyle\left.\sum\limits_{\mathbf{k}}\frac{f_{\mathbf{k}}(\tau)}{G^{(1)}(0)}\left(\left.\left\langle S_{\mathbf{k}}^{z}(t)\right\rangle\right|_{t\rightarrow\infty}+\frac{1}{2}\right)\right]$ Here, the second item in $g^{(2)}(\tau)$ is non-negative for any $\tau$, and returns to zero when $\tau\rightarrow 0$, thus the explicit effect of the anti-bunching of the light coupled with the SWCNT is illustrated in Fig. 4. Figure 4: The second order correlation of the light $g^{(2)}(t)-g^{(2)}(0)$ is plotted, in which the antibunching feature is obviously displayed. The two chiral vectors $(6,4)$ and $(8,0)$ are chosen to represent significant anti- bunching effect due to different reasons. Here, we have chosen the frequency of the light field $\omega=2J$. Due to the divergence near the resonance area for $g^{(2)}(t)$, the anti- bunching feature is significant where the light and the energy gap between upper and lower bands reach resonance while the interaction intensity $D_{\mathbf{k}}$ is comparatively high. In this case, the SWCNT is equivalent to one or several 2-level atoms that interact strongly with the incurring light, just as the case in the $(6,4)$ SWCNT when the incurring light frequency is $2J$. Similar to Sec. III concerning Rabi oscillation, here we still have a distinct effect for the $(2n,0)$ SWCNTs, when the incurring light frequency is really close to $2J$. In the case for $(8,0)$ SWCNT, the strong anti-bunching feature is instead caused by the large degeneracy on the $E=J$ line in the first Brillouin zone. Unlike the case for the $(6,4)$ SWCNT, in which merely several electron states are involved, the significant anti- bunching here is caused by the excitation in the $E=J$ band of the SWCNT, where thousands of possible states participate in at the same time. ## VI Possible Lasing Mechanism of Carbon Nanotube The above investigations imply that the light emitted from or scattered by the SWCNT is strongly correlated in time domain, thus explicitly displays quantum effects. It is straight forward to imagine that if electrons in the SWCNT experience a population inversion, the emitted light would be amplified. This observation may enable a possible lasing mechanism. In this section, we will explore this mechanism for the SWCNT by using Haken’s laser theory Laser . The Heisenberg equations(25a,25b) without dissipation usually have no steady solution. Thus we phenomenologically introduce decays on both the light field and the quasi-spin operators to make the physical observables reach the stable results. In order to obtain the steady solution, we neglect the fluctuations because the time average of them vanishes. This simplification results in the laser-like equations $\displaystyle\frac{\partial}{\partial t}\widetilde{d}^{\dagger}$ $\displaystyle=$ $\displaystyle-\kappa\widetilde{d}^{\dagger}+i\sum\limits_{\mathbf{k}}D_{\mathbf{k}}\widetilde{S}_{\mathbf{k}}^{+}e^{-i\Delta_{\mathbf{k}}t},$ (59a) $\displaystyle\frac{\partial}{\partial t}\widetilde{S}_{\mathbf{k}}^{+}$ $\displaystyle=$ $\displaystyle-\gamma_{\mathbf{k}}\widetilde{S}_{\mathbf{k}}^{+}-2iD_{\mathbf{k}}\widetilde{d}^{\dagger}S_{\mathbf{k}}^{z}e^{i\Delta_{\mathbf{k}}t},$ (59b) $\displaystyle\frac{\partial}{\partial t}S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle-2\gamma_{\mathbf{k}}(S_{\mathbf{k}}^{z}+\frac{1}{2})-iD_{\mathbf{k}}(\widetilde{S}_{\mathbf{k}}^{+}\widetilde{d}e^{-i\Delta_{\mathbf{k}}t}-h.c.),$ (59c) where we have removed the higher frequency factors by defining $\widetilde{d}^{\dagger}=d^{\dagger}\exp(-i\Omega t)$ and $\widetilde{S}_{\mathbf{k}}^{+}=S_{\mathbf{k}}^{+}\exp[-i2E(\overrightarrow{k})t].$ This approach changes the observation from a laboratory frame of reference into some rotating one. Equation (59b) can be formally integrated as $\widetilde{S}_{\mathbf{k}}^{+}(t)=\widetilde{S}_{\mathbf{k}}^{+}(0)e^{-\gamma_{\mathbf{k}}t}-2iD_{\mathbf{k}}\int\limits_{0}^{t}e^{-\gamma_{\mathbf{k}}(t-\tau)}\widetilde{d}^{\dagger}S_{\mathbf{k}}^{z}e^{i\Delta_{\mathbf{k}}\tau}d\tau.$ (60) According to Haken’s laser theory, if $\widetilde{d}^{\dagger}S_{\mathbf{k}}^{z}$ varies with time much slower than $\widetilde{S}_{\mathbf{k}}^{+}(t)$, it could be regarded as a time- independent one and then the above integral becomes $\widetilde{S}_{\mathbf{k}}^{+}(t)=\widetilde{S}_{\mathbf{k}}^{+}(0)e^{-\gamma_{\mathbf{k}}t}-2iD_{\mathbf{k}}\widetilde{d}^{\dagger}S_{\mathbf{k}}^{z}\frac{\left(e^{i\Delta_{\mathbf{k}}t}-e^{-\gamma_{\mathbf{k}}t}\right)}{\gamma_{\mathbf{k}}+i\Delta_{\mathbf{k}}},$ (61) After a long time, the first term in the above solution Eq.(60), which is totally determined by the initial polarization $\widetilde{S}_{\mathbf{k}}^{+}(0)$, will vanish. Thus, when $\gamma_{k}t\gg 1$, only the initial state-independent part $\widetilde{S}_{\mathbf{k}}^{+}(t)\approx-2iD_{\mathbf{k}}\widetilde{d}^{\dagger}S_{\mathbf{k}}^{z}\frac{e^{i\Delta_{\mathbf{k}}t}}{\gamma_{\mathbf{k}}+i\Delta_{\mathbf{k}}},$ (62) remains. In this case the motion equation of the $z-$direction spin operators becomes $\frac{\partial}{\partial t}S_{\mathbf{k}}^{z}\approx-2\gamma_{\mathbf{k}}(S_{\mathbf{k}}^{z}+\frac{1}{2})-\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}S_{\mathbf{k}}^{z},$ (63) where $\theta_{\mathbf{k}}=4\gamma_{\mathbf{k}}D_{\mathbf{k}}^{2}/(\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2})$. Then we obtain the effective motion equation of the light field $\frac{\partial}{\partial t}\widetilde{d}^{\dagger}=-\widetilde{d}^{\dagger}\left(\kappa-\sum\limits_{\mathbf{k}}\frac{2D_{\mathbf{k}}^{2}e^{i\Omega t}}{\gamma_{\mathbf{k}}+i\Delta_{\mathbf{k}}}S_{\mathbf{k}}^{z}\right).$ (64) In the following discussions we will demonstrate a lasing-like phenomenon by considering the solution of Eq.(64) Usually, a lasing process requires population inversion. To realize such population inversion in our setup, a pump of electrons is needed to inject electrons with specific state into the carbon nanotube. Phenomenologically, we add a pump term $c_{\mathbf{k}}>0$ to each term $S_{\mathbf{k}}^{z}$, then $\frac{\partial}{\partial t}S_{\mathbf{k}}^{z}=c_{\mathbf{k}}-2\gamma_{\mathbf{k}}(S_{\mathbf{k}}^{z}+\frac{1}{2})-\theta(\mathbf{k})\widetilde{d}^{\dagger}\widetilde{d}S_{\mathbf{k}}^{z},$ (65) The population inversion is obtained from Eq. (65) as $\displaystyle S_{\mathbf{k}}^{z}$ $\displaystyle=$ $\displaystyle S_{\mathbf{k}}^{z}(0)\exp\left(-\int\limits_{0}^{t}\left[\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}+2\gamma_{\mathbf{k}}\right]d\tau^{\prime}\right)+$ (66) $\displaystyle(c_{\mathbf{k}}-\gamma_{\mathbf{k}})\int\limits_{0}^{t}\exp\left(\int\limits_{0}^{\tau}\left[\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}+2\gamma_{\mathbf{k}}\right]d\tau^{\prime}\right)d\tau\times$ $\displaystyle\exp\left(-\int\limits_{0}^{t}\left[\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}+2\gamma_{\mathbf{k}}\right]d\tau^{\prime}\right).$ After a long time evolution $\left(\gamma_{\mathbf{k}}t\gg 1\right)$, this solution becomes $S_{\mathbf{k}}^{z}=(c_{\mathbf{k}}-\gamma_{\mathbf{k}})\int\limits_{0}^{t}\exp\left(-\int\limits_{\tau}^{t}\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}d\tau^{\prime}\right)e^{-2\gamma_{\mathbf{k}}(t-\tau)}d\tau.$ (67) It follows from Eq.(67) that the main contribution of the integral comes from the accumulation of the weighted photon numbers in the time $\tau\sim t$. In this sense we can assume that $\int\limits_{\tau}^{t}\theta_{\mathbf{k}}\widetilde{d^{\dagger}}\widetilde{d}d\tau^{\prime}=\theta_{\mathbf{k}}\widetilde{d^{\dagger}}\widetilde{d}(t-\tau)$ Then the population inversion is integrated as $S_{\mathbf{k}}^{z}\approx\frac{(c_{\mathbf{k}}-\gamma_{\mathbf{k}})}{\theta_{\mathbf{k}}\widetilde{d}^{\dagger}\widetilde{d}+2\gamma_{\mathbf{k}}}.$ (68) Eventually, the motion equation of the light field is obtained as $\frac{\partial}{\partial t}\widetilde{d}^{\dagger}\approx(\kappa^{\prime}-i\delta\omega)\widetilde{d}^{\dagger}-\eta\widetilde{d}^{\dagger}\widetilde{d}^{\dagger}\widetilde{d},$ (69) where $\delta\omega=\sum\limits_{\mathbf{k}}D_{\mathbf{k}}^{2}\frac{(c_{\mathbf{k}}-\gamma_{\mathbf{k}})}{\gamma_{\mathbf{k}}}\frac{\Delta_{\mathbf{k}}}{\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2}},$ (70a) appears as the Lamb shift of photons, and $\kappa^{\prime}=-\kappa+\sum\limits_{\mathbf{k}}D_{\mathbf{k}}^{2}\frac{(c_{\mathbf{k}}-\gamma_{\mathbf{k}})}{\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2}},$ (70b) represents a dissipation or amplification of the optical mode together with $\eta=\sum\limits_{\mathbf{k}}2D_{\mathbf{k}}^{4}\frac{c_{\mathbf{k}}-\gamma_{\mathbf{k}}}{(\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2})^{2}}.$ (70c) describing the extent of nonlinearity of the light field induced by the SWCNT. Here, we have expanded the second item on the right hand side of Eq.(69) up to the first order of $2D_{\mathbf{k}}^{2}\widetilde{d}^{\dagger}\widetilde{d}$. Obviously, Eq.(69) is typical to describe the lasing process in an amplification medium. When electrons are injected into the SWCNT to realize a population inversion, $\kappa^{\prime}=-\kappa+\sum\limits_{\mathbf{k}}D_{\mathbf{k}}^{2}\frac{(c_{\mathbf{k}}-\gamma_{\mathbf{k}})}{\gamma_{\mathbf{k}}^{2}+\Delta_{\mathbf{k}}^{2}}>0$ (71) with $\eta>0$, we obtain a lasing equation $\frac{\partial}{\partial t}\widetilde{d^{\dagger}}=\kappa^{\prime}\widetilde{d^{\dagger}}-\eta\widetilde{d^{\dagger}}\widetilde{d^{\dagger}}\widetilde{d}.$ (72) Then the effect of the coherently injected electrons the SWCNT on the light field is equivalent to that of a double-well potential formed as $V(\left|d\right|)=-\kappa^{\prime}\left|d\right|^{2}+\frac{\eta}{2}\left|d\right|^{4},$ (73) Thus there exists a symmetry breaking based instability for laser amplification. When $\kappa^{\prime}<0$, $d=0$ is the unique stable point for the effective potential $V(\left|d\right|)$. In this case we may safely neglect the nonlinearity, and the system is only affected by stochastic processes. However, when $\kappa^{\prime}$ passes through zero, the point $d=0$ is no longer the stable point. Instead, the photon amplitude $d$ acquires its new stable points with nonzero amplitude $\left|d\right|=\sqrt{\frac{\kappa^{\prime}}{\eta}}$ (74) indicating a phase transition in the system. The above phenomenon that nonzero stable points of $V(\left|d\right|)$appear means that a coherent light field with non-vanishing amplitude is produced by the radiation of electrons confined in the SWCNT. ## VII Conclusion In summary, our investigation in this paper is oriented by the needs of designing the quantum devices in future. We theoretically studied a solid state based quantum optical system, namely, the SWCNT interacting with quantized light field. The ballistic transport of electrons in SWCNT means quantum coherence of electrons in terminology of quantum optics. Thus, the emitted and scattered light from such coherent electrons could be quantum coherent as well, and then we use the higher order coherence function to describe it. On the other hand, SWCNT with different chirality $(n,m)$ have different properties in their Rabi oscillations of the electrons when driven by a strong single-mode light field. The anti-bunching features of the light scattered by or emitted from them is also studied in details here. The reason for such distinction of chirality is that different sets of wave vectors $\mathbf{k}$ are allowed in SWCNT with different chiral vectors, which may lead to different energy structures in the SWCNT. Such effect is especially significant on the $(2n,0)$ type SWCNT, where large degeneracy of possible electron states onto $E=J$ occurs. This is a characteristic property absent in 2D graphene. The possible lasing mechanism in the SWCNT is also investigated theoretically, which may promise the realization of nanoscale laser devices. ## Appendix A Semi-classical It is noticed that the semi-classical approximation applied in Sec. III is valid only for the quasi-classical case in which the initial state possesses a very large number of single frequency photons. We will justify this approximation with necessary details in this appendix. The complete dynamics of the SWCNT interacting with a strong light field is displayed through the Schrodinger equations governed by the Hamiltonian $H=H_{0}+H_{1},$ in the interaction picture, where $\displaystyle H_{0}$ $\displaystyle=$ $\displaystyle\sum\limits_{\mathbf{k}}E_{\mathbf{k}}\left(\alpha_{\mathbf{k}}^{\dagger}\alpha_{\mathbf{k}}-\beta_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k}}\right),$ (75a) $\displaystyle H_{1}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(de^{-i\Omega t}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right)$ (75b) And the initial condition of the system $\left|\Psi\left(0\right)\right\rangle=\left|\xi=\sqrt{N}e^{i\theta}\right\rangle\otimes\left|\phi\left(0\right)\right\rangle,$ (76) where the coherent state $\left|\xi\right\rangle=\exp\left(\xi d^{\dagger}-\xi^{\ast}d\right)\left|0\right\rangle\equiv D\left(\xi\right)\left|0\right\rangle$ (77) represents the state of the light field while $\left|\phi\left(0\right)\right\rangle$ stands for the initial state of the electrons in the SWCNT. We note that $\left|\alpha\right|\simeq\sqrt{N}.$Since there is no broken global phase symmetry, the arbitrary $\theta$ is chosen as $0.$ The main reason for choosing the initial photon state as a coherent one is that the average number $\left\langle\sqrt{N}\right|d^{\dagger}d\left|\sqrt{N}\right\rangle=N$ should be satisfied. We introduce the photon vacuum picture, similar to the approach for the semi- classical approximation of photon-atom system [cite P.L.Kingt Concept of Quantum Optics], defined by $\left|\Phi\left(t\right)\right\rangle=D\left(\xi\right)^{-1}\left|\Psi\left(t\right)\right\rangle,\left|\Phi\left(0\right)\right\rangle=\left|0\right\rangle\otimes\left|\phi\left(0\right)\right\rangle$ (78) which satisfies the Schrodinger equation (in the interaction picture) with the effective Hamiltonian $H_{e}=D\left(\xi\right)^{-1}HD\left(\xi\right)=H_{0}+V_{q}+H_{q}$ where $\displaystyle V_{q}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(\sqrt{N}e^{-i\Omega t}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right)$ (79a) $\displaystyle H_{q}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(de^{-i\Omega t}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right),$ (79b) Here $|0\rangle$ can be understood as a displaced vacuum. It should be noticed that the above derivation is exact for the initial condition (78). For a very large $N$, $H_{q}$ in the above Hamiltonian is very small with respect to the $V_{q}$, and it can be neglected in the first order approximation. Under this approximation, the state of photons is subjected to a collective evolution governed by the effective Hamiltonian $\displaystyle H_{e}$ $\displaystyle=$ $\displaystyle H_{0}+V_{q},$ (80a) $\displaystyle V_{q}$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(\sqrt{N}e^{-i\Omega t}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right).$ (80b) Transforming back to the original picture, one proves the conclusion: If $N$ is a macroscopic number, namely, it is large enough, the total system will evolve with a factorizable wave function $|\Psi(t)\rangle=|\sqrt{N}e^{i\theta}\rangle\otimes|\phi(t)\rangle,$ where $|\phi(t)\rangle$ obeys the Schrödinger equation governed by the effective Hamiltonian $H_{e}$. The next question is the effects of the neglected term, $H_{q}$, on the dynamics in the photons vacuum picture. In the framework of the perturbation theory, the role of $H_{q}$ relies on the coupling to the vacuum, that is $\displaystyle H_{q}|\Phi(0)\rangle$ $\displaystyle=$ $\displaystyle\sum_{\mathbf{k}}D_{\mathbf{k}}\left(de^{-i\Omega t}\alpha_{\mathbf{k}}^{\dagger}\beta_{\mathbf{k-q}}+h.c.\right)|0\rangle\otimes|\phi(0)\rangle$ (81) $\displaystyle=$ $\displaystyle e^{i\Omega t}|1\rangle\otimes\sum_{\mathbf{k}}D_{\mathbf{k}}\beta_{\mathbf{k-q}}^{\dagger}\alpha_{\mathbf{k}}|\phi(0)\rangle$ which leads to a single-particle excitation of the vacuum. Finally we reach the following conclusions: (1) In the large $N$ limit, this excitation is weak compared with the collective motion; (2) If there is initially no collective excitation or single excited electrons in the SWCNT, the system will be stable and remain in the displaced vacuum state even when $H_{q}$ is taken into account. ###### Acknowledgements. The authors thank H. Dong for his schematic diagram of the graphene. This work is supported by NSFC No.10474104, No.60433050, and No.10704023, NFRPC No.2006CB921205 and 2005CB724508. ## References * (1) R. Saito, G. Dresselhaus, M. S. Dresselhaus, Physical Properties of Carbon Nanotubes (Imperial College Press, London, 1995). * (2) R. H. Baughman, A. A. Zakhidov, W. A. de Heer, Science 297, 787 (2002). * (3) M. S. Dresselhaus, G. Dresselhaus, Ph. Avouris, Carbon Nanotubes (Springer-Verlag, Berlin, 2110). * (4) M. J. O’Connell, S. M. Bachilo, C. B. Huffman, V. C. Moore, M. S. Strano, E. H. Haroz, K. L. Rialon, P. J. Boul, W. H. Noon, C. Kittrell, Jianpeng Ma, R. H. Hauge, R. Bruce Weisman, and R. E. Smalley, Science 297, 593 (2002). * (5) V. C. Moore, M. S. Strano, E. H. Haroz, R. H. Hauge, and R. E. Smalley, Nano Lett. 3, 1379 (2003). * (6) Chongwu Zhou, Jing Kong, and Hongjie Dai, Appl. Phys. Lett. 76, 1597 (2000). * (7) M. Y. Sfeir, T. Beetz, F. Wang, Limin Huang, X. M. H. Huang, Mingyuan Huang, J. Hone, S. O’Brien, J. A. Misewich, T. F. Heinz, Lijun Wu, Yimei Zhu, and L. E. Brus, Science 312, 554 (2006). * (8) A. Javey, J. Guo, Q. Wang, M. Lundstrom, and Hongjie Dai, Nature 424, 654 (2003). * (9) Xiaolei Liu, Chenglung Lee, and Chongwu Zhou, Appl. Phys. Lett. 79, 3329 (2001). * (10) Z. Y. Zhang, S. Wang, L. Ding, X. L. Liang, H. L. Xu, J. Shen, Q. Chen, R. L. Cui, Y. Li, and L. M. Peng, Appl. Phys. Lett. 92, 133117 (2008). * (11) S. M. Bachilo, M. S. Strano, C. Kittrell, R. H. Hauge, R. E. Smalley, R. B. Weisman, Science 298, 2361 (2002). * (12) H. Katauraa, Y. Kumazawaa, Y. Maniwaa, I. Umezub, S. Suzukic, Y. Ohtsukac and Y. Achiba, Synthetic Metals 103, 2555 (1999). * (13) E. Chang, G. Bussi, A. Ruini, and E. Molinari, Phys. Rev. Lett. 92, 196401 (2004). * (14) C. D. Spataru, S. Ismail-Beigi, L. X. Benedict, and S. G. Louie, Phys. Rev. Lett. 92, 077402 (2004). * (15) V. Perebeinos, J. Tersoff, and Ph. Avouris, Phys. Rev. Lett. 92, 257402 (2004). * (16) H. Zhao and S. Mazumdar, Phys. Rev. Lett. 93, 157402 (2004). * (17) F. Wang, G. Dukovic, L. E. Brus, T. F. Heinz, Science 308, 838 (2005). * (18) J. Maultzsch, R. Pomraenke, S. Reich, E. Chang, D. Prezzi, A. Ruini, E. Molinari, M. S. Strano, C. Thomsen, and C. Lienau, Phys. Rev. B 72, 241402 (2005). * (19) J. Lefebvre and P. Finnie, Phys. Rev. Lett. 98, 167406 (2007). * (20) A.Höele, C. Galland, M. Winger, and A. Imamoǧlu, Phys. Rev. Lett. 100, 217401 (2008). * (21) H. Haken, Rev. Mod. Phys. 47, 67 (1975).
arxiv-papers
2009-04-15T02:34:08
2024-09-04T02:49:01.874275
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Z. L. Guo, Z. R. Gong, and C. P. Sun", "submitter": "Zelei Guo", "url": "https://arxiv.org/abs/0904.2231" }
0904.2240
###### Abstract A theorem related to the Newman-Penrose constants is proven. The theorem states that all the Newman-Penrose constants of asymptotically flat, stationary, asymptotically algebraically special electrovacuum spacetimes are zero. Straightforward application of this theorem shows that all the Newman- Penrose constants of the Kerr-Newman spacetime must vanish. On Newman-Penrose constants of stationary electrovacuum spacetimes Xiangdong Zhanga,111e-mail : zhangxiangdong@mail.bnu.edu.cn Xiaoning Wub,222e-mail : wuxn@amss.ac.cn and Sijie Gao a,333e-mail : sijie@bnu.edu.cn a. Department of Physics, Beijing Normal University, Beijing, China, 100080. b. Institute of Applied Mathematics. Academy of Mathematics and System Science. Chinese Academy of Sciences, P.O.Box 2734, Beijing, China, 100080. PACS number : 04.20.-q, 04.20.Ha Keywords : Newman-Penrose constants, stationary electrovacuum condition, Kerr- Newman solution. ## 1 Introduction Newmen-Penrose(N-P) constants are very interesting and useful quantities in the study of asymptotic flat space-times. They were first found by E.T.Newman and R.Penrose in 1968[1] and then discussed by many other authors[2, 3, 4, 5, 6, 7]. Although the N-P constants have been found for forty years, their physical interpretation remains an open question. One reason is that the computation of these constants for a general asymptotically flat spacetime is not easy. In stationary vacuum cases, these constants can be viewed as combination of multi-pole moments of space-times[8]-[11]. Calculations of the NP constants for vacuum solutions have been made by many authors [12, 13, 14, 15, 16, 17]. People used to conjecture that the algebraically special condition (ASC) leads to the vanishing of NP constants. However, Kinnersley and Walker[12] provided a counterexample. Recently, some authors[15] proposed the asymptotically algebraically special condition (AASC), and proved that the N-P constants vanish for vacuum, stationary, asymptotic algebraically special space-times. In fact, the two conditions are closely related. It is well known that the ASC implies that the Weyl curvature possesses a multiple principle null direction. This condition can be expressed in terms of two geometric invariants $I$ and $J$, defined by $I=\Psi_{0}\Psi_{4}-4\Psi_{1}\Psi_{3}+3(\Psi_{2})^{2}$ and $J=\Psi_{4}\Psi_{2}\Psi_{0}+2\Psi_{3}\Psi_{2}\Psi_{1}-(\Psi_{2})^{3}-(\Psi_{3})^{2}\Psi_{0}-(\Psi_{1})^{2}\Psi_{4}$ [18, 21]. A spacetime is said to be algebraically special if $I^{3}-27J^{2}=0$. It has been shown that a general asymptotically flat, stationary spacetime satisfies $I^{3}-27J^{2}\sim O(r^{-21})$ near future null infinity[15]. Thus, $I^{3}-27J^{2}$ will peel off very quickly for a general stationary vacuum asymptotically flat spacetime although the spacetime may not be algebraically special. A spacetime is said to be “asymptotically algebraically special” if $I^{3}-27J^{2}\sim O(r^{-22})$ [15], i.e. one order faster than general cases. From the geometric point of view, this indicates that one pair of principle null directions coincides near null infinity. By imposing this condition, authors of [15] showed that the NP constants vanish for vacuum, stationary spacetimes. Based on the result of [15], N-P constants can bee seen as combination of Janis-Newman multi-poles of gravitational field[24]. An intriguing question is whether the Janis-Newman multi-poles of matter field will contribute to the N-P constants. In this paper, we extend the discussion to the electrovacuum case. By imposing the AACS, we show that the NP constants still vanish in the presence of a stationary Maxwell field. If the Maxwell field is not stationary, the multi-pole moments of the Maxwell field will contribute to the N-P constants. This paper is organized as follows : In section II, we apply the method of Taylor expansion to a stationary electrovacuum space-time. With the help of the Killing equation, we reduce the dynamical freedom of gravitational field into a set of arbitrary constants. Detailed expressions are given up to order $O(r^{-6})$. We then prove that all the N-P constants of a stationary asymptotically algebraically special electrovacuum space-time are zero. Finally, we make some concluding remarks in section III. ## 2 The Newman-Penrose constants of stationary asymptotically algebraically special electrovacuum space-times In an asymptotically flat spacetime, the Newman-Penrose constants are defined by [18] $\displaystyle G_{m}=\int_{S_{\infty}}{}_{2}Y_{2,m}\Psi^{1}_{0}dS,$ where ${}_{2}Y_{2,m}$ is a spin-weight harmonic function and $\Psi^{1}_{0}$ is a component of the Weyl tensor. Since the integral is performed on a two- sphere at infinity, we only need the asymptotic form of the Weyl tensor in the calculation. According to the peeling off theorem given by Sachs [18], we may express the Weyl tensor and Maxwell field as : $\displaystyle\Psi_{n}\sim O(r^{n-5})\,\quad n=0,1,2,3,4,$ $\displaystyle\phi_{m}\sim O(r^{m-3})\quad m=0,1,2.$ (1) The vacuum case has been studied previously[7, 13, 14, 15]. An interesting issue is to consider the effect of matter fields on N-P constants. In this paper, we shall concentrate on the electromagnetic field. Like in the vacuum case, we require the space-time to be stationary. Obviously, there is no Bondi energy flux in such a space-time, i.e. ${\dot{\sigma}}^{0}=0$. In this case we can choose some suitable coordinates, such that the asymptotic shear $\sigma^{0}$ is zero. Similarly, the stationary condition has eliminated the freedom of the news function. We also demand the Weyl tensor satisfy the asymptotically algebraically special condition, which has been discussed above. The main purpose of this paper is to prove the following theorem: ###### Theorem 1 All the N-P constants of an asymptotically flat, stationary, asymptotically algebraically special electrovacuum space-time are zero. Note that Kerr-Newman solution satisfies all the conditions in the theorem. It follows immediately that the all N-P constants in a Kerr-Newman spacetime must vanish. Proof of the theorem. We choose the standard Bondi-Sachs’ coordinates and construct the standard Bondi null tetrad [15, 22]. With the gauge choice in [18, 19], we can write down the N-P coefficients and null tetrad of the stationary electrovacuum spacetime. Some low order terms have been calculated and can be found in [18]. Calculation of the N-P constants requires higher order terms in the expansions. Consider the following N-P equations $\displaystyle\delta\lambda-{\bar{\delta}}\mu=\bar{\tau}\mu+(\bar{\alpha}-3\beta)\lambda-\Psi_{3}+\Phi_{21},$ (2) $\displaystyle\Delta\lambda-{\bar{\delta}}\nu=2\alpha\nu+(\bar{\gamma}-3\gamma-\mu-\bar{\mu})\lambda-\Psi_{4},$ (3) where $\Phi_{ij}=8\pi\phi_{i}{\bar{\phi}}_{j}$ is the Maxwell stress tensor. The coefficient of $r^{-2}$ in equation (2) yields $\Psi_{3}^{0}=0$. Expanding equation (3) up to $O(r^{-3})$, we obtain $\Psi_{4}^{0}=\Psi_{4}^{1}=\Psi_{4}^{2}=0$. Now we shall use the Killing equation to reduce other dynamical freedoms and get a general asymptotic expansion of the stationary electrovacuum space-time. Write down the time-like Killing vector as $\displaystyle t^{a}=Tl^{a}+n^{a}+{\bar{A}}m^{a}+A{\bar{m}}^{a}.$ The Killing equations are given by $\displaystyle-DT+(\gamma+{\bar{\gamma}})+{\bar{\tau}}A+\tau{\bar{A}}=0,$ (4) $\displaystyle DA+\tau+{\bar{\rho}}A+{\sigma}{\bar{A}}=0,$ (5) $\displaystyle-{D^{\prime}}T-(\gamma+{\bar{\gamma}})T-\nu A-{\bar{\nu}}{\bar{A}}=0,$ (6) $\displaystyle-\tau T+{\bar{\nu}}+{D^{\prime}}A+({\bar{\gamma}}-\gamma)A-\delta T-\tau T-\mu A-{\bar{\lambda}}{\bar{A}}=0,$ (7) $\displaystyle-{\sigma}T+{\bar{\lambda}}+\delta A+({\bar{\alpha}}-\beta)A=0,$ (8) $\displaystyle-\rho T+\mu+\delta{\bar{A}}-({\bar{\alpha}}-\beta){\bar{A}}-{\bar{\rho}}T+{\bar{\mu}}+{\bar{\delta}}A-(\alpha-{\bar{\beta}})A=0.$ (9) Similarly to the analysis in [15], assuming the asymptotic behaviors of $T$ and $A$ as $\displaystyle T$ $\displaystyle=$ $\displaystyle T^{0}+\frac{T^{1}}{r}+\cdots,$ $\displaystyle A$ $\displaystyle=$ $\displaystyle A^{0}+\frac{A^{1}}{r}+\cdots,$ (10) we can solve the Killing equations order by order. The stationary condition implies ${\dot{\sigma}}^{0}=0$. It has been found that the Maxwell field does not change the lowest two powers of $1/r$ in the Killing equations. So the constant terms in the Killing equations yield the same result as in the vacuum case, i.e., $T^{0}=\frac{1}{2}$, ${\dot{T}}^{1}=0$, ${\dot{A}}^{1}=0$. The coefficients of $r^{-1}$ in the Killing equations give rise to ${\sigma}^{0}=0$, $A^{1}=0$, ${\dot{T}}^{2}=0$, $\Psi^{0}_{2}={\bar{\Psi}}^{0}_{2}$, $T^{1}=\frac{1}{2}(\Psi^{0}_{2}+{\bar{\Psi}}^{0}_{2})$ , ${\dot{A}}^{2}=-\frac{1}{2}\eth\Psi^{0}_{2}+\frac{1}{2}\delta_{0}(\Psi^{0}_{2}+{\bar{\Psi}}^{0}_{2})$ and ${\dot{\Psi}}^{0}_{2}=0.$ (11) From the $r^{-2}$ terms in the N-P equation $\displaystyle\delta\nu-\Delta\mu=\gamma\mu-2\nu\beta+\bar{\gamma}\mu+\mu^{2}+|\lambda|^{2}+\Phi_{22}\,,$ (12) we find $8\pi|\phi_{2}^{0}|^{2}={\dot{\Psi}}_{2}^{0}=0$. Hence $\phi_{2}^{0}=0$. From the $r^{-5}$ terms in the N-P equation $\displaystyle\delta\rho-\bar{\delta}\sigma=\tau\rho+(\bar{\beta}-3\alpha)\sigma+(\rho-\bar{\rho})\tau-\Psi_{1}+\Phi_{01}\,,$ (13) we have $\displaystyle\frac{1}{6}({\bar{\eth}}\Psi_{0}^{0}-40\pi\phi_{0}^{0}{\bar{\phi}}_{1}^{0})+\frac{1}{2}{\bar{\eth}}\Psi_{0}^{0}=-\frac{1}{3}({\bar{\eth}}\Psi_{0}^{0}-40\pi\phi_{0}^{0}{\bar{\phi}}_{1}^{0})+{\bar{\eth}}\Psi_{0}^{0}-16\pi\phi_{0}^{0}{\bar{\phi}}_{1}^{0}$ (14) which implies $\displaystyle\phi_{0}^{0}{\bar{\phi}}_{1}^{0}=0$ (15) This equation will play an important role in our proof, which gives $\phi_{0}^{0}=0$ or $\phi_{1}^{0}=0$. Now we discuss the two cases respectively. 1) $\phi_{0}^{0}=0$. Consider the Maxwell equations $\displaystyle D\phi_{1}-\bar{\delta}\phi_{0}$ $\displaystyle=$ $\displaystyle-2\alpha\phi_{0}+2\rho\phi_{1},$ (16) $\displaystyle D\phi_{2}-\bar{\delta}\phi_{1}$ $\displaystyle=$ $\displaystyle-\lambda\phi_{0}+\rho\phi_{2}.$ (17) The coefficients of $r^{-4}$ in these equations yield $\phi_{1}^{1}=\phi_{2}^{2}=0$. Consider the other two Maxwell equations $\displaystyle\delta\phi_{1}-\Delta\phi_{0}$ $\displaystyle=$ $\displaystyle(\mu-2\lambda)\phi_{0}+2\tau\phi_{1}-\sigma\phi_{2},$ (18) $\displaystyle\delta\phi_{2}-\Delta\phi_{1}$ $\displaystyle=$ $\displaystyle-\nu\phi_{0}+2\mu\phi_{1}+(\tau-2\beta)\phi_{2}.$ (19) The $r^{-2}$ terms in equation (18) and the $r^{-3}$ terms in equation (19) yield $\displaystyle\dot{\phi_{1}^{0}}$ $\displaystyle=$ $\displaystyle 0$ (20) $\displaystyle\dot{\phi_{0}^{0}}$ $\displaystyle=$ $\displaystyle\eth\phi_{1}^{0}=0$ (21) where “$\cdot$” denotes ${\frac{\partial}{\partial u}}$. Combining these two equations, we have $\phi_{1}^{0}=constant$. So from the $r^{-3}$ terms of Eq. (17), we obtain $\phi_{2}^{1}=-{\bar{\eth}}\phi_{1}^{0}=0$. 2) $\phi_{1}^{0}=0$. Again, from the $r^{-3}$ terms of Eq.(17), we have $\phi_{2}^{1}=-{\bar{\eth}}\phi_{1}^{0}=0$. Thus in both cases we have $\phi_{2}^{1}=0$. Note that it is $\Phi_{ij}$, instead of $\phi_{i}$, that appear in the N-P equations. The fact that $\phi_{i}=O(r^{-3})$ (except $\phi_{1}\sim O(r^{-2})$ in case 1)) shows that the presence of the electromagnetic field does not contribute to $r^{-1}$ and $r^{-2}$ terms. The electromagnetic field makes contribution only to order $r^{-3}$ and higher orders in the expansions. Combining these results, we obtain the reduced N-P coefficients $\displaystyle\rho$ $\displaystyle=$ $\displaystyle-\frac{1}{r}+\frac{8\pi\phi^{0}_{0}\bar{\phi}^{0}_{0}}{3r^{5}}+O(r^{-6}),$ $\displaystyle{\sigma}$ $\displaystyle=$ $\displaystyle-\frac{\Psi^{0}_{0}}{2r^{4}}-\frac{\Psi^{1}_{0}}{3r^{5}}+O(r^{-6}),$ $\displaystyle\alpha$ $\displaystyle=$ $\displaystyle\frac{\alpha^{0}}{r}-\frac{{\bar{\alpha}}^{0}{\bar{\Psi}}^{0}_{0}}{6r^{4}}+\frac{\alpha^{0}8\pi\phi^{0}_{0}\bar{\phi}^{0}_{0}-\bar{\alpha}^{0}\bar{\Psi}^{1}_{0}-24\pi(\phi_{1}^{0}{\bar{\phi}}_{0}^{1}+\phi^{1}_{1}\bar{\phi}^{0}_{0})}{12r^{5}}+O(r^{-6}),$ $\displaystyle\beta$ $\displaystyle=$ $\displaystyle-\frac{{\bar{\alpha}}^{0}}{r}-\frac{\Psi^{0}_{1}}{2r^{3}}+\frac{\alpha^{0}\Psi^{0}_{0}+2{\bar{\eth}}\Psi^{0}_{0}}{6r^{4}}-\frac{3\Psi^{2}_{1}+8\pi\bar{\alpha}^{0}\phi^{0}_{0}\bar{\phi}^{0}_{0}-\alpha^{0}\Psi^{1}_{0}}{12r^{5}}+O(r^{-6})\,,$ $\displaystyle\tau$ $\displaystyle=$ $\displaystyle-\frac{\Psi^{0}_{1}}{2r^{3}}+\frac{{\bar{\eth}}\Psi^{0}_{0}}{3r^{4}}+\frac{{\bar{\eth}}\Psi^{1}_{0}-8\pi\eth(\phi^{0}_{0}\bar{\phi}^{0}_{0})-48\pi(\phi_{0}^{1}{\bar{\phi}}_{1}^{0}+\phi^{0}_{0}\bar{\phi}^{1}_{1})}{8r^{5}}+O(r^{-6}),$ $\displaystyle{\lambda}$ $\displaystyle=$ $\displaystyle-\frac{{\bar{\Psi}}^{0}_{0}}{12r^{4}}-\frac{3{\bar{\Psi}}^{0}_{0}\Psi^{0}_{2}+{\bar{\Psi}}^{1}_{0}+48\pi\phi^{2}_{2}\bar{\phi}^{0}_{0}}{24r^{5}}+O(r^{-6}),$ $\displaystyle\mu$ $\displaystyle=$ $\displaystyle-\frac{1}{2r}-\frac{\Psi^{0}_{2}}{r^{2}}+\frac{{\bar{\eth}}\Psi^{0}_{1}-16\pi\phi_{1}^{0}{\bar{\phi}}_{1}^{0}}{2r^{3}}-\frac{{\bar{\eth}}^{2}\Psi^{0}_{0}}{6r^{4}}-\frac{6\Psi^{3}_{2}+8\pi\phi^{0}_{0}\bar{\phi}^{0}_{0}}{24r^{5}}+O(r^{-6}),$ $\displaystyle\gamma$ $\displaystyle=$ $\displaystyle-\frac{\Psi^{0}_{2}}{2r^{2}}+\frac{2{\bar{\eth}}\Psi^{0}_{1}-48\pi\phi_{1}^{0}{\bar{\phi}}_{1}^{0}+\alpha^{0}\Psi^{0}_{1}-{\bar{\alpha}}^{0}{\bar{\Psi}}^{0}_{1}}{6r^{3}}$ $\displaystyle-\frac{1}{24}\left[2\left(\alpha^{0}{\bar{\eth}}\Psi^{0}_{0}-{\bar{\alpha}}^{0}\eth{\bar{\Psi}}^{0}_{0}\right)+3{\bar{\eth}}^{2}\Psi^{0}_{0}\right]r^{-4}$ $\displaystyle+\frac{1}{20}[\alpha^{0}8\pi(\phi^{0}_{0}\bar{\phi}^{1}_{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})+\alpha^{0}\Psi^{2}_{1}-{\bar{\alpha}}^{0}8\pi(\phi_{1}^{0}{\bar{\phi}}_{0}^{1}+\phi_{1}^{1}\bar{\phi}^{0}_{0})-{\bar{\alpha}}^{0}\bar{\Psi}^{2}_{1}$ $\displaystyle-|\Psi^{0}_{1}|^{2}-4\Psi^{3}_{2}-32\pi(\phi_{1}^{0}{\bar{\phi}}_{1}^{2}+\phi_{1}^{1}\bar{\phi}_{1}^{1}+\phi_{1}^{2}{\bar{\phi}}_{1}^{0})]r^{-5}+O(r^{-6}),$ $\displaystyle\nu$ $\displaystyle=$ $\displaystyle-\frac{1}{12}\left[{\bar{\Psi}}^{0}_{1}+2{\bar{\eth}}^{2}\Psi^{0}_{1}\right]r^{-3}+\frac{1}{24}\left[\eth\bar{\Psi}_{0}^{0}+{\bar{\eth}}^{3}\Psi_{0}^{0}\right]r^{-4}$ (22) $\displaystyle-\frac{1}{120}[6\Psi_{2}^{1}\bar{\Psi}_{1}^{0}-8\Psi_{2}^{0}\eth\bar{\Psi}_{0}^{0}+24\pi(\phi_{1}^{0}\bar{\phi}_{0}^{1}+\phi_{1}^{1}\bar{\phi}_{0}^{0})+3\bar{\Psi}_{1}^{2}+24\Psi_{3}^{4}$ $\displaystyle+192\pi\phi_{2}^{2}\bar{\phi}_{1}^{1}]r^{-5}+O(r^{-6}).$ and the null tetrad $\displaystyle l^{a}$ $\displaystyle=$ $\displaystyle{\frac{\partial}{\partial r}}\,,$ $\displaystyle n^{a}$ $\displaystyle=$ $\displaystyle{\frac{\partial}{\partial u}}+\left[-\frac{1}{2}-\frac{\Psi^{0}_{2}}{r}+\frac{{\bar{\eth}}\Psi^{0}_{1}+\eth{\bar{\Psi}}^{0}_{1}+64\pi\phi_{1}^{0}{\bar{\phi}}_{1}^{0}}{6r^{2}}\right.-\frac{{\bar{\eth}}^{2}\Psi^{0}_{0}+\eth^{2}{\bar{\Psi}}^{0}_{0}}{24r^{3}}$ $\displaystyle-\frac{1}{20}\left(3|\Psi_{1}^{0}|^{2}+\Psi_{2}^{3}+\bar{\Psi}_{2}^{3}+16\pi(\phi^{0}_{1}\bar{\phi}^{2}_{1}+\phi^{1}_{1}{\bar{\phi}}^{1}_{1}+\phi^{2}_{1}{\bar{\phi}}^{0}_{1})r^{-4}+O(r^{-5})\right]{\frac{\partial}{\partial r}}$ $\displaystyle+\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{3}}\Psi^{0}_{1}-\frac{1+\zeta{\bar{\zeta}}}{12\sqrt{2}r^{4}}{\bar{\eth}}\Psi^{0}_{0}+O(r^{-5})\right]{\frac{\partial}{\partial\zeta}}$ $\displaystyle+\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{3}}{\bar{\Psi}}^{0}_{1}-\frac{1+\zeta{\bar{\zeta}}}{12\sqrt{2}r^{4}}\eth{\bar{\Psi}}^{0}_{0}+O(r^{-5})\right]{\frac{\partial}{\partial{\bar{\zeta}}}}\,,$ $\displaystyle m^{a}$ $\displaystyle=$ $\displaystyle\left[-\frac{\Psi^{0}_{1}}{2r^{2}}+\frac{{\bar{\eth}}\Psi^{0}_{0}}{6r^{3}}-\frac{\Psi_{1}^{2}+8\pi(\phi_{0}^{1}{\bar{\phi}}_{1}^{0}+\phi^{0}_{0}\bar{\phi}^{1}_{1})}{12r^{4}}+O(r^{-5})\right]{\frac{\partial}{\partial r}}$ (23) $\displaystyle+\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{4}}\Psi^{0}_{0}+O(r^{-5})\right]{\frac{\partial}{\partial\zeta}}+\left[\frac{1+\zeta{\bar{\zeta}}}{\sqrt{2}r}+O(r^{-5})\right]{\frac{\partial}{\partial{\bar{\zeta}}}}\,,$ where $\delta_{0}=\frac{(1+\zeta{\bar{\zeta}})}{\sqrt{2}}\frac{\partial}{\partial{\bar{\zeta}}}$, $\zeta=e^{i\phi}\cot\frac{\theta}{2}$, $\eth f=(\delta_{0}+2s{\bar{\alpha}}^{0})f$ ( $s$ is the spin-weight of $f$). The differential operators $\eth$ and ${\bar{\eth}}$ are defined in [18, 20]. Then the components of the Weyl curvature and the electromagnetic tensor reduce to $\displaystyle\Psi_{0}=\frac{\Psi^{0}_{0}}{r^{5}}+\frac{\Psi^{1}_{0}}{r^{6}}+O(r^{-7}),$ $\displaystyle\Psi_{1}=\frac{\Psi^{0}_{1}}{r^{4}}+\frac{\Psi^{1}_{1}}{r^{5}}+\frac{\Psi^{2}_{1}}{r^{6}}+O(r^{-7}),$ $\displaystyle\Psi_{2}=\frac{\Psi^{0}_{2}}{r^{3}}+\frac{\Psi^{1}_{2}}{r^{4}}+\frac{\Psi^{2}_{2}}{r^{5}}+\frac{\Psi^{3}_{2}}{r^{6}}+O(r^{-7}),$ $\displaystyle\Psi_{3}=\frac{\Psi^{2}_{3}}{r^{4}}+\frac{\Psi^{3}_{3}}{r^{5}}+\frac{\Psi^{4}_{3}}{r^{6}}+O(r^{-7}),$ $\displaystyle\Psi_{4}=\frac{\Psi_{4}^{3}}{r^{4}}+\frac{\Psi^{4}_{4}}{r^{5}}+\frac{\Psi^{5}_{4}}{r^{6}}+O(r^{-7}).$ $\displaystyle\phi_{0}=\frac{\phi_{0}^{0}}{r^{3}}+\frac{\phi_{0}^{1}}{r^{4}}+\frac{\phi_{0}^{2}}{r^{5}}+O(r^{-6}),$ $\displaystyle\phi_{1}=\frac{\phi_{1}^{0}}{r^{2}}+\frac{\phi_{1}^{1}}{r^{3}}+\frac{\phi_{1}^{2}}{r^{4}}+\frac{\phi_{1}^{3}}{r^{5}}+O(r^{-6}),$ $\displaystyle\phi_{2}=\frac{\phi_{2}^{2}}{r^{3}}+\frac{\phi_{2}^{3}}{r^{4}}+\frac{\phi_{2}^{4}}{r^{5}}+O(r^{-6}).$ (24) The Bianchi identity takes the form $\displaystyle\bar{\delta}\Psi_{0}-D\Psi_{1}+D\Phi_{01}-\delta\Phi_{00}=4\alpha\Psi_{0}-4\rho\Psi_{1}-2\tau\Phi_{00}+2\rho\Phi_{01}+2\sigma\Phi_{10}\,.$ (25) The coefficient of $r^{-6}$ in equation (25) yields $\Psi^{1}_{1}=-{\bar{\eth}}\Psi^{0}_{0}$. Similarly, the other components of the Bianchi identity and the Maxwell equations lead to $\displaystyle\phi_{1}^{1}=-{\bar{\eth}}\phi_{0}^{0},\quad\phi_{1}^{2}=-\frac{1}{2}{\bar{\eth}}\phi_{0}^{1},\quad\phi_{1}^{3}=-\frac{1}{3}{\bar{\eth}}\phi_{0}^{2}-\frac{1}{2}\bar{\Psi}_{1}^{0}\phi_{0}^{0}.$ $\displaystyle\phi_{2}^{2}=\frac{1}{2}{\bar{\eth}}^{2}\phi_{0}^{0},\quad\phi_{2}^{3}=\frac{1}{6}{\bar{\eth}}^{2}\phi_{0}^{1},$ $\displaystyle\phi_{2}^{4}=\frac{1}{12}{\bar{\eth}}^{2}\phi_{0}^{2}+\frac{1}{12}\eth\bar{\Psi}_{0}^{0}+\frac{1}{2}\bar{\Psi}_{1}^{0}{\bar{\eth}}\phi_{0}^{0}$ $\displaystyle\Psi^{1}_{1}=-{\bar{\eth}}\Psi^{0}_{0},\quad\Psi^{2}_{1}=-\frac{1}{2}{\bar{\eth}}\Psi^{1}_{0}+16\pi(\phi_{0}^{0}\bar{\phi}_{1}^{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})+4\pi\eth(\phi_{0}^{0}\bar{\phi}_{0}^{0}),$ $\displaystyle\Psi^{1}_{2}=-{\bar{\eth}}\Psi^{0}_{1}+16\pi\phi_{1}^{0}{\bar{\phi}}_{1}^{0},\quad\Psi^{2}_{2}=\frac{1}{2}{\bar{\eth}}^{2}\Psi^{0}_{0},$ $\displaystyle\Psi^{3}_{2}=-\frac{2}{3}|\Psi^{0}_{1}|^{2}-\frac{1}{3}{\bar{\eth}}\Psi^{2}_{1}+\frac{16}{9}\pi\eth(\phi_{1}^{0}{\bar{\phi}}_{0}^{1}+\phi_{1}^{1}\bar{\phi}_{0}^{0})-\frac{8}{9}\pi{\bar{\eth}}(\phi_{0}^{0}\bar{\phi}_{1}^{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})-\frac{20}{9}\pi\phi_{0}^{0}\bar{\phi}_{0}^{0}$ $\displaystyle\quad\quad\quad+\frac{80}{9}\pi(\phi_{1}^{0}{\bar{\phi}}_{1}^{2}+\phi_{1}^{1}{\bar{\phi}}_{1}^{1}+\phi_{1}^{2}{\bar{\phi}}_{1}^{0})+\frac{8}{9}\pi{\frac{\partial}{\partial u}}(\phi_{0}^{0}{\bar{\phi}}_{0}^{1}+\phi_{0}^{1}{\bar{\phi}}_{0}^{0}),$ $\displaystyle\Psi^{2}_{3}=\frac{1}{2}{\bar{\eth}}^{2}\Psi^{0}_{1},\quad\Psi^{3}_{3}=-\frac{1}{2}{\bar{\Psi}}^{0}_{1}\Psi^{0}_{2}-\frac{1}{6}{\bar{\eth}}^{3}\Psi^{0}_{0},$ $\displaystyle\Psi^{4}_{3}=-\frac{1}{4}{\bar{\eth}}\Psi_{2}^{3}+\frac{1}{8}\Psi_{2}^{0}\eth\Psi_{0}^{0}+\frac{1}{2}{\bar{\Psi}}_{1}^{0}{\bar{\eth}}\Psi_{1}^{0}+\frac{1}{12}k\eth(\phi_{2}^{2}{\bar{\phi}}_{0}^{0})$ $\displaystyle\quad\quad\quad-\frac{4}{3}\pi{\bar{\eth}}(\phi_{1}^{0}{\bar{\phi}}_{1}^{2}+\phi_{1}^{1}{\bar{\phi}}_{1}^{1}\phi_{1}^{2}{\bar{\phi}}_{1}^{0})+4\pi(\phi_{2}^{2}{\bar{\phi}}_{1}^{1}+\phi_{2}^{3}{\bar{\phi}}_{1}^{0})+4\pi(\phi_{1}^{0}{\bar{\phi}}_{0}^{1}+\phi_{1}^{1}{\bar{\phi}}_{0}^{0})$ $\displaystyle\quad\quad\quad+4\pi\bar{\Psi}_{1}^{0}\phi_{1}^{0}{\bar{\phi}}_{1}^{0}+\frac{4}{3}\pi{\frac{\partial}{\partial u}}(\phi_{1}^{1}{\bar{\phi}}_{0}^{1}+\phi_{1}^{2}{\bar{\phi}}_{0}^{0}),$ $\displaystyle\Psi^{3}_{4}=-\frac{1}{6}{\bar{\eth}}^{3}\Psi_{1}^{0},\quad\Psi^{4}_{4}=-\frac{1}{24}{\bar{\eth}}^{4}\Psi_{0}^{0},$ $\displaystyle\Psi^{5}_{4}=-\frac{1}{5}{\bar{\eth}}\Psi_{3}^{4}-\frac{8}{5}\pi{\bar{\eth}}(\phi_{2}^{2}{\bar{\phi}}_{1}^{1}+\phi_{2}^{3}{\bar{\phi}}_{1}^{0})-\frac{1}{5}{\bar{\Psi}}_{1}^{0}{\bar{\eth}}^{2}\Psi_{1}^{0}-\frac{1}{20}\Psi_{2}^{0}\bar{\Psi}_{0}^{0}$ $\displaystyle\quad\quad\quad+4\pi(\phi_{2}^{2}{\bar{\phi}}_{0}^{0})+\frac{8}{5}\pi{\frac{\partial}{\partial u}}(\phi_{2}^{2}{\bar{\phi}}_{0}^{1}+\phi_{2}^{3}{\bar{\phi}}_{0}^{0}).$ (26) Similarly to the treatment in [15], the $r^{-3}$ terms in the Killing equations lead to $\eth\Psi_{1}^{0}=0$. Thus we have $\displaystyle\Psi^{0}_{1}$ $\displaystyle=$ $\displaystyle\sum^{1}_{m=-1}B_{m}{\ }_{1}Y_{1,m},$ $\displaystyle\Psi^{0}_{2}$ $\displaystyle=$ $\displaystyle C.$ (27) The coefficient of $r^{-3}$ in Eq. (2) gives $\Psi_{3}^{1}={\bar{\delta}}\Psi_{2}^{0}=0$. In order to find more restrictions on $\Psi_{0}$, we need to compute higher order terms of the Killing equations. The terms of order $r^{-4}$ of the Killing equations yield $\displaystyle 3T^{3}+(\gamma^{4}+{\bar{\gamma}}^{4})=0,$ (28) $\displaystyle 4A^{3}=\frac{1}{3}{\bar{\eth}}\Psi^{0}_{0},$ (29) $\displaystyle{\dot{T}}^{4}+\frac{8}{3}\pi\phi_{1}^{0}{\bar{\phi}}_{1}^{0}=0,$ (30) $\displaystyle\frac{1}{2}\Psi^{0}_{1}T^{1}-\tau^{4}+{\bar{\nu}}^{4}+{\dot{A}}^{4}+(\Psi^{0}_{2}+{\bar{\Psi}}^{0}_{2})A^{2}+2A^{3}-\delta_{0}T^{3}+\Psi^{0}_{2}A^{2}=0,$ (31) $\displaystyle\frac{1}{6}\Psi^{0}_{0}+\eth A^{3}=0,$ (32) $\displaystyle 2T^{3}+\mu^{4}+{\bar{\mu}}^{4}+\eth{\bar{A}}^{3}+{\bar{\eth}}A^{3}=0\,.$ (33) Eq.(29) and (32) imply $\displaystyle\Psi^{0}_{0}=\sum^{2}_{m=-2}A_{m}(u){\ }_{2}Y_{2,m},$ (34) Eq.(27) and ${\dot{T}}^{3}=0$ ( which comes from the $r^{-3}$ terms in the Killing equations) imply that $\Psi^{0}_{0}$ is independent of $u$. Combining Eqs.(24),(26),(27) and (34), one finds $\displaystyle I^{3}-27J^{2}\sim O(r^{-21}).$ (35) This result holds for a general asymptotically flat stationary spacetime. As mentioned in the introduction, the AASC requires $\displaystyle I^{3}-27J^{2}\sim O(r^{-22}),$ (36) which is just one order faster than the falloff rate of a general asymptotically flat spacetime. This means that the AASC is a weak requirement and as demonstrated at the end of this section, there exist many asymptotic flat space-times which satisfy this condition. Our purpose is to calculate the Newman-Penrose constants, which are contained in the coefficients of $\Psi^{1}_{0}$. From the $r^{-5}$ terms in the Killing equations, we have $\displaystyle 4T^{4}+(\gamma^{5}+{\bar{\gamma}}^{5})-\frac{1}{2}{\bar{\Psi}}^{0}_{1}A^{2}-\frac{1}{2}\Psi^{0}_{1}{\bar{A}}^{2}=0,$ (37) $\displaystyle A^{4}=\frac{1}{5}\tau^{5}=\frac{1}{40}\left[{\bar{\eth}}\Psi_{0}^{1}-48\pi(\phi_{0}^{0}{\bar{\phi}}_{1}^{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})-8\pi\eth(\phi_{0}^{0}{\bar{\phi}}_{0}^{0})\right],$ (38) $\displaystyle\frac{1}{8}\Psi_{0}^{1}+\frac{3}{8}\Psi_{0}^{0}\Psi_{2}^{0}-2\pi\phi_{0}^{0}{\bar{\phi}}_{2}^{2}-\frac{1}{4}(\Psi_{1}^{0})^{2}+\eth A^{4}=0,$ (39) $\displaystyle-\rho^{5}+2T^{4}+(\mu^{5}+{\bar{\mu}}^{5})+\frac{3}{2}\Psi^{0}_{1}{\bar{A}}^{2}+\frac{3}{2}{\bar{\Psi}}^{0}_{1}A^{2}+\eth{\bar{A}}^{4}+{\bar{\eth}}A^{4}=0\,.$ (40) Eqs. (38) and (39) yield: $\displaystyle\eth{\bar{\eth}}\Psi^{1}_{0}+5\Psi^{1}_{0}=10(\Psi^{0}_{1})^{2}-15\Psi^{0}_{0}\Psi^{0}_{2}+80\pi\phi_{0}^{0}{\bar{\phi}}_{2}^{2}+48\pi\eth(\phi_{0}^{0}{\bar{\phi}}_{1}^{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})+8\pi\eth^{2}(\phi_{0}^{0}{\bar{\phi}}_{0}^{0}).$ (41) The terms of $\phi^{i}_{j}$ on the right-hand side of Eq. (41) are the contribution from the Maxwell field [15]. To simplify this equation, we need to investigate the electromagnetic field in more detail. Since the electromagnetic field is stationary, we have $\pounds_{t}F_{ab}=0$, where $t^{c}$ is the Killing vector. Noting that $\phi_{0}=F_{lm}$ and using the expansion of $t^{c}$, we have $\displaystyle\pounds_{t}\phi_{0}$ $\displaystyle=$ $\displaystyle\pounds_{t}F_{ab}l^{a}m^{b}$ (42) $\displaystyle=$ $\displaystyle(Tl^{c}+n^{c}+{\bar{A}}m^{c}+A{\bar{m}}^{c})\phi_{0}$ $\displaystyle=$ $\displaystyle F_{ab}l^{a}[t,\quad m]^{b}+F_{ab}m^{b}[t,\quad l]^{a}$ $\displaystyle=$ $\displaystyle(\gamma+\bar{\gamma}+\bar{A}\bar{\tau}+A\tau)\phi_{0}-(\tau+\bar{A}\sigma+A\rho)(\phi_{1}-{\bar{\phi}}_{1})$ $\displaystyle+\left[T\bar{\varrho}-\mu+\gamma+\bar{\gamma}-A(\bar{\beta}-\alpha)\right]\phi_{0}+\left[T\sigma-\bar{\lambda}-A(\bar{\alpha}-\beta)\right]{\bar{\phi}}_{0}$ where $[t,\ m]^{b}$ denotes the commutator of $t^{c}$ and $m^{b}$. So we obtain $\displaystyle(Tl^{c}+n^{c}+{\bar{A}}m^{c}+A{\bar{m}}^{c})\phi_{0}$ (43) $\displaystyle=$ $\displaystyle(\gamma+\bar{\gamma}+\bar{A}\bar{\tau}+A\tau)\phi_{0}-(\tau+\bar{A}\sigma+A\rho)(\phi_{1}-{\bar{\phi}}_{1})+\left[T\bar{\varrho}-\mu+\gamma+\bar{\gamma}-A(\bar{\beta}-\alpha)\right]\phi_{0}$ $\displaystyle+\left[T\sigma-\bar{\lambda}-A(\bar{\alpha}-\beta)\right]{\bar{\phi}}_{0}$ Substituting (23) into (43) yields: $\displaystyle{\frac{\partial}{\partial u}}\phi_{0}+\left[-\frac{1}{2}-\frac{\Psi^{0}_{2}}{r}+O(r^{-2})\right]{\frac{\partial}{\partial r}}\phi_{0}+\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{3}}\Psi^{0}_{1}+O(r^{-4})\right]{\frac{\partial}{\partial\zeta}}\phi_{0}$ (44) $\displaystyle+\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{3}}{\bar{\Psi}}^{0}_{1}+O(r^{-4})\right]{\frac{\partial}{\partial{\bar{\zeta}}}}\phi_{0}+T{\frac{\partial}{\partial r}}\phi_{0}-\bar{A}\left[\frac{\Psi^{0}_{1}}{2r^{2}}+O(r^{-3})\right]{\frac{\partial}{\partial r}}\phi_{0}$ $\displaystyle+\bar{A}\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{4}}\Psi^{0}_{0}+O(r^{-5})\right]{\frac{\partial}{\partial\zeta}}\phi_{0}+\bar{A}\left[\frac{1+\zeta{\bar{\zeta}}}{\sqrt{2}r}+O(r^{-5})\right]{\frac{\partial}{\partial{\bar{\zeta}}}}\phi_{0}$ $\displaystyle-A\left[\frac{{\bar{\Psi}}^{0}_{1}}{2r^{2}}+O(r^{-3})\right]{\frac{\partial}{\partial r}}\phi_{0}$ $\displaystyle+A\left[\frac{1+\zeta{\bar{\zeta}}}{6\sqrt{2}r^{4}}{\bar{\Psi}}^{0}_{0}+O(r^{-5})\right]{\frac{\partial}{\partial{\bar{\zeta}}}}\phi_{0}+A\left[\frac{1+\zeta{\bar{\zeta}}}{\sqrt{2}r}+O(r^{-5})\right]{\frac{\partial}{\partial\zeta}}\phi_{0}$ $\displaystyle=$ $\displaystyle(\gamma+\bar{\gamma}+\bar{A}\bar{\tau}+A\tau)\phi_{0}-(\tau+\bar{A}\sigma+A\rho)(\phi_{1}-{\bar{\phi}}_{1})$ $\displaystyle+\left[T\bar{\varrho}-\mu+\gamma+\bar{\gamma}-A(\bar{\beta}-\alpha)\right]\phi_{0}+\left[T\sigma-\bar{\lambda}-A(\bar{\alpha}-\beta)\right]{\bar{\phi}}_{0}$ Again, we compute the $\phi^{i}_{j}$ terms in Eq.(41) in the two cases. For case 1) $\phi_{0}^{0}=0$, computing the coefficient of $r^{-5}$ in Eq. (44), we obtain $\displaystyle\dot{\phi_{0}^{2}}=-3\Psi_{2}^{0}\phi_{0}^{0}=0$ (45) The coefficient of $r^{-5}$ of equation (18) gives $\displaystyle\eth\phi_{1}^{1}-\dot{\phi_{0}^{2}}-2\phi_{0}^{1}-3\Psi_{2}^{0}\phi_{0}^{0}=-\frac{1}{2}\phi_{0}^{1}-\Psi_{1}^{0}\phi_{1}^{0}\,.$ (46) Using $\phi_{0}^{0}=0$ and $\dot{\phi_{0}^{2}}=0$, we get $\displaystyle\phi_{0}^{1}=\frac{2}{3}\phi_{1}^{0}\Psi_{1}^{0}\,.$ (47) By taking $\eth$ on both sides and using $\eth\Psi_{1}^{0}=0$, we have immediately $\displaystyle\eth\phi_{0}^{1}=\frac{2}{3}\phi_{1}^{0}\eth\Psi_{1}^{0}=0.$ (48) Then the $\phi^{i}_{j}$ terms in Eq.(41) become $\displaystyle 80\pi\phi_{0}^{0}{\bar{\phi}}_{2}^{2}+48\pi\eth(\phi_{0}^{0}{\bar{\phi}}_{1}^{1}+\phi_{0}^{1}{\bar{\phi}}_{1}^{0})+8\pi\eth^{2}(\phi_{0}^{0}{\bar{\phi}}_{0}^{0})$ (49) $\displaystyle=$ $\displaystyle 48\pi\eth(\phi_{0}^{1}{\bar{\phi}}_{1}^{0})$ $\displaystyle=$ $\displaystyle(48\pi\eth\phi_{0}^{1}){\bar{\phi}}_{1}^{0}+\phi_{0}^{1}(48\pi\eth{\bar{\phi}}_{1}^{0})$ $\displaystyle=$ $\displaystyle 0\,,$ where Eqs. (21) and (48) have been used in the last step. For case 2) $\phi_{1}^{0}=0$, the coefficient of $r^{-4}$ in Eq. (44) leads to $\displaystyle 0=\dot{\phi_{0}^{1}}-3T^{0}\phi_{0}^{0}+\frac{3}{2}\phi_{0}^{0}=\dot{\phi_{0}^{1}}\,.$ (50) Because the spinweight of $\phi_{0}$ is 1, we can expand $\phi_{0}^{0}$ as $\phi_{0}^{0}=\sum_{l=1}^{\infty}\sum_{m=-l}^{l}d_{l,m}{\ }_{1}Y_{l,m}$, where $d_{l,m}$ are some constants. The $r^{-4}$ terms in (18) yield $\displaystyle\dot{\phi_{0}^{1}}=-{\bar{\eth}}\eth\phi_{0}^{0}=\frac{1}{2}\sum_{l=1}^{\infty}(l+2)(l-1)\sum_{m=-l}^{l}d_{l,m}\ {}_{1}Y_{l,m}\,.$ (51) Combining (50) and (51) and using the fact that spin-weight harmonic function components are linearly independent, we obtain $l=1$. Consequently, $\displaystyle\phi_{0}^{0}=\sum_{m=-1}^{1}d_{m}{\ }_{1}Y_{1,m}\,,$ (52) where $d_{m}$ are constants. By expanding $\phi_{0}^{0}$, we find $\eth\phi_{0}^{0}=0$. The contribution from the Maxwell field in Eq. (41) then leads to: $\displaystyle 80\pi\phi_{0}^{0}{\bar{\phi}}_{2}^{2}+48\pi\eth(\phi_{0}^{0}{\bar{\phi}}_{1}^{1})+8\pi\eth^{2}(\phi_{0}^{0}{\bar{\phi}}_{0}^{0})$ (53) $\displaystyle=$ $\displaystyle 40\pi\phi_{0}^{0}\eth^{2}{\bar{\phi}}_{0}^{0}-48\pi\eth(\phi_{0}^{0}\eth{\bar{\phi}}_{0}^{0})+8\pi\eth(\phi_{0}^{0}\eth{\bar{\phi}}_{0}^{0}+{\bar{\phi}}_{0}^{0}\eth\phi_{0}^{0})$ $\displaystyle=$ $\displaystyle 40\pi\phi_{0}^{0}\eth^{2}{\bar{\phi}}_{0}^{0}-48\pi\eth\phi_{0}^{0}\eth{\bar{\phi}}_{0}^{0}-48\pi\phi_{0}^{0}\eth^{2}{\bar{\phi}}_{0}^{0}+8\pi\eth\phi_{0}^{0}\eth{\bar{\phi}}_{0}^{0}$ $\displaystyle+8\pi\eth{\bar{\phi}}_{0}^{0}\eth\phi_{0}^{0}+8\pi\phi_{0}^{0}\eth^{2}{\bar{\phi}}_{0}^{0}+8\pi{\bar{\phi}}_{0}^{0}\eth^{2}\phi_{0}^{0}$ $\displaystyle=$ $\displaystyle-32\pi\eth\phi_{0}^{0}\eth{\bar{\phi}}_{0}^{0}+8\pi{\bar{\phi}}_{0}^{0}\eth^{2}\phi_{0}^{0}$ $\displaystyle=$ $\displaystyle 0$ where we have used $\phi_{1}^{1}=-{\bar{\eth}}\phi_{0}^{0}$ and $\phi_{2}^{2}=\frac{1}{2}{\bar{\eth}}^{2}\phi_{0}^{0}$. Therefore, the electromagnetic field makes no contribution to the equation of $\Psi_{0}^{1}$. So in either case, the equation of $\Psi_{0}^{1}$ reduces to $\displaystyle\eth{\bar{\eth}}\Psi^{1}_{0}+5\Psi^{1}_{0}=10(\Psi^{0}_{1})^{2}-15\Psi^{0}_{0}\Psi^{0}_{2}\,,$ (54) which is exactly the same equation as that in the vacuum case. Then by imposing the AASC, it is shown in [15] that Eq. (54) implies that all the Newman-Penrose constants must be zero. This completes the proof of our theorem. Remark : The asymptotically algebraically special condition has played an important role in the proof of this paper and in [15]. Obviously, this condition is satisfied by the Kerr-Newman solution. The following arguments show that the AASC is a rather weak condition imposed on a general asymptotically flat spacetime. Note that the Kerr-Newman spacetime is axisymmetric. Such symmetry is not required in our theorem. From Eq.(27), we can see that $\Psi^{0}_{1}$ contains ${}_{1}Y_{1,1}$ and ${}_{1}Y_{1,-1}$ components that do not appear in the Kerr-Newman solution. Simple calculation shows that $span\\{{}_{1}Y_{1,1},{}_{1}Y_{1,0},{}_{1}Y_{1,-1}\\}$ is not a representative space of $SO(3)$. Thus we cannot cancel such components by a rotation. Based on the characteristic initial value method[23], it is not difficult to construct exact solutions with non-zero $B_{1}$ and $B_{-1}$. Furthermore, the spin-weight components of $\Psi^{k}_{0}$ are just the Janis- Newman multi-poles of gravitational field[24]. The AASC only gives a restriction between Janis-Newman’s dipoles and quadrupoles[15]. Since there is no restriction on higher order multi-poles, it is easy to see that there are many solutions which satisfy the conditions of our theorem and are not equivalent to the Kerr-Newman solution. ## 3 Concluding remarks We have proven that all the N-P constants of an asymptotic flat, stationary, asymptotically algebraically special electrovacuum space-time are zero. The Kerr-Newman solution manifestly satisfies all the conditions. So our theorem implies that all the N-P constants of the Kerr-Newman solution are zero. This result has been obtained resently[25] by other authors. In the proof of the theorem, we have assumed that the Maxwell field is stationary. If this condition is not imposed, ${\dot{\phi}}^{1}_{0}$ will not be zero. Then Eq.(51) tells us $\phi^{0}_{0}$ will contain other components of the spin- weight spherical functions. These terms correspond to the Janis-Newman multi- pole of Maxwell field[24]. In the presence of these terms, the N-P constants may not vanish. Last but not least, an interesting issue is to single out the Kerr-Newman solution from solutions which satisfy the conditions of our theorem. From the discussion of the last section, we find that the AASC is not enough to uniquely determine the Kerr-Newman solution. It seems that more restrictions on the Maxwell field are needed. This will be discussed in our future work. ## Acknowledgement This work is supported by the Natural Science Foundation of China (NSFC) under Grant Nos. 10705048, 10605006, 10731080. Authors would like to thank the referees for helpful comments on the asymptotically algebraically special condition. ## References * [1] E. T. Newman and R. Penrose, Proc. Roy. Soc. Lond. A 305 (1968) 175. * [2] R. H. Price, Phys. Rev. D 5 (1972) 2419\. * [3] J.A. Valiente Kroon, Class.Quant.Grav. 16 (1999) 1653. * [4] J.A. Valiente Kroon, J.Math.Phys. 41 (2000) 898. * [5] H. Friedrich and J. Kánnár, J. Math. Phys. 41 (2000) 2195\. * [6] W. B. Bonnor, Classical and Quantum Gravity, 18 (2001) 233. * [7] J.A. Valiente Kroon, Class. Quant. Grav. 20 (2003) L53. * [8] R. Geroch, J. Math. Phys. 11 (1970) 1955, 2580\. * [9] R. Hansen, J. Math. Phys. 15 (1974) 46. * [10] P. K. Kundu, J. Math. Phys. 29 (1988) 1866. * [11] H. Friedrich, “Static vacuum solutions from convergent null dadta expensions at space-like infinity”, gr-qc/0606133. * [12] W. Kinnersely and M. Walker, Phys. Rev. D 2 (1970) 1359. * [13] R. Lazkoz and J. A. Valiente Kroon, Phys. Rev. D62 (2000) 084033. * [14] S. Dain and J. A. Valiente Kroon, Class. Quant. Grav., 19(2002)811. * [15] X. Wu and Y. Shang, Class. Quant. Grav. 24 (2007) 679. * [16] S. Bai et.al., Phys. Rev. D 75 (2007) 044003\. * [17] J. A. Valiente Kroon, Class. Quant. Grav. 24 (2007) 3037\. * [18] R. Penrose and R. Rindler, Spinors and Space-Time Vol.I and II, Cambridge University Press, 1986. * [19] E. T. Newman and T. W. J. Unti, J. Math. Phys. 3 (1962 ) 891. * [20] J. Stewart, Advanced General Relativity, Cambridge University Press, 1990. * [21] D. Kramer, H. Stephani, E. Herlt and M. MacCallum, Exact Solutions of Einstein’s Field Equations, Cambridge University Press, 1980. * [22] X. Wu and S. Bai, “On local uniqueness of Kerr space-time”, Phys.Rev.D 78 (2008) 124009. * [23] H. Friedrich, Proc. R. Soc. Lond. A 378 (1981) 169-184, 401-421. * [24] A. I. Janis and E. T. Newman, J. Math. Phys. 6 (1965) 902. * [25] X. Gong et.al., Phys.Rev.D 76 (2007) 107501.
arxiv-papers
2009-04-15T05:52:34
2024-09-04T02:49:01.881249
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Xiangdong Zhang, Xiaoning Wu and Sijie Gao", "submitter": "Xiangdong Zhang", "url": "https://arxiv.org/abs/0904.2240" }
0904.2266
# NONLINEAR ITERATION SOLUTION FOR THE FULL GLUON PROPAGATOR AS A FUNCTION OF THE MASS GAP V. Gogokhia gogohia@rmki.kfki.hu HAS, CRIP, RMKI, Depart. Theor. Phys., Budapest 114, P.O.B. 49, H-1525, Hungary ###### Abstract We have explicitly shown that QCD is the color gauge invariant theory at non- zero mass gap as well. It has been defined as the value of the regularized full gluon self-energy at some finite point. The mass gap is mainly generated by the nonlinear interaction of massless gluon modes. All this allows one to establish the structure of the full gluon propagator in the explicit presence of the mass gap. In this case, the two independent general types of formal solutions for the full gluon propagator as a function of the regularized mass gap have been found. The nonlinear iteration solution at which the gluons remain massless is explicitly present. The existence of the solution with an effective gluon mass is also demonstrated. ###### pacs: 11.15.Tk, 12.38.Lg ## I Introduction Quantum Chromodynamics (QCD) 1 ; 2 is widely accepted as a realistic quantum field gauge theory of the strong interactions not only at the fundamental (microscopic) quark-gluon level but at the hadronic (macroscopic) level as well. This means that in principle it should describe the properties of experimentally observed hadrons in terms of experimentally never seen colored quarks and gluons (the color confinement phenomenon), i.e., to describe the hadronic world from first principles – an ultimate goal of any fundamental theory. The Lagrangian of QCD, however, does not contain explicitly any of the mass scale parameters which could have a physical meaning even after the corresponding renormalization program is performed. This clearly shows that it is not enough to know it in order to calculate the physical observables in low-energy QCD from first principles. It is also important to know the true dynamical structure of the QCD ground state especially at large distances, which may be source of the above-mentioned mass scale parameter. If it will survive the renormalization program, then QCD is a complete and self- consistent theory without the need to introduce some extra degrees of freedom in order to generate it. In this way it may become a mass gap so needed in non-perturbative (NP) QCD in order to explain the above-mentioned color confinement and other NP effects 3 . It will be responsible for the NP QCD dynamics as $\Lambda_{QCD}$ is responsible for the nontrivial perturbative QCD dynamics (scale violation, asymptotic freedom (AF) 1 ; 2 ). The propagation of gluons is one of the main dynamical effects in the QCD vacuum. In our previous work 4 it has been shown that the only place when the mass gap may appear is the corresponding Schwinger-Dyson (SD) equation of motion for the full gluon propagator. It should be complemented by the corresponding Slavnov-Taylor (ST) identity (see next section). The importance of this equation is due to the fact that its solutions reflect the quantum- dynamical structure of the QCD ground state. It is highly nonlinear (NL) equation, and therefore the number of independent solutions, which should be considered on equal footing, is not fixed $a\ priori$. The color gauge structure of this equation has been investigated in detail in the above- mentioned paper 4 . We have explicitly shown that the color gauge invariance of QCD is consistent with the mass gap, generated in the gluon sector of QCD. Our primary goal in this investigation is to find formal solutions for the full gluon propagator as a function of the regularized mass gap. However, for the sake of completeness and further clarity, it is instructive to describe briefly the main results of Ref. 4 in the subsequent section. ## II The color gauge invariance of QCD at non-zero mass gap QCD is a $SU(3)$ color gauge invariant theory. As underlined above, its dynamical context is determined by the corresponding equations of motion, among which the SD equation for the full gluon propagator plays an important role. It can be written as follows: $D_{\mu\nu}(q)=D^{0}_{\mu\nu}(q)+D^{0}_{\mu\rho}(q)i\Pi_{\rho\sigma}(q;D)D_{\sigma\nu}(q),$ (1) where $D^{0}_{\mu\nu}(q)=i\left\\{T_{\mu\nu}(q)+\xi L_{\mu\nu}(q)\right\\}{1\over q^{2}}$ (2) is the free gluon propagator, and $\xi$ is the gauge-fixing parameter. Also, here and everywhere below $T_{\mu\nu}(q)=\delta_{\mu\nu}-(q_{\mu}q_{\nu}/q^{2})=\delta_{\mu\nu}-L_{\mu\nu}(q)$, as usual. $\Pi_{\rho\sigma}(q;D)$ is the full gluon self-energy which depends on the full gluon propagator due to the non-abelian character of QCD. Thus the gluon SD equation is highly NL one. Evidently, we omit the color group indices, since for the gluon propagator (and hence for its self-energy) they factorize, for example $D^{ab}_{\mu\nu}(q)=D_{\mu\nu}(q)\delta^{ab}$. Diagrammatic representation of the gluon SD equation (2.1) is shown in our previous work 4 , as well as the detail description of the full gluon self- energy $\Pi_{\rho\sigma}(q;D)$. It is the sum of a few terms which are tensors, having the dimensions of mass squared. All these skeleton loop integrals are therefore quadratically divergent in perturbation theory (PT), and so they are assumed to be regularized, as discussed below. Let us note in advance that here and below the signature is Euclidean, since it implies $q_{i}\rightarrow 0$ when $q^{2}\rightarrow 0$ and vice-versa. ### II.1 The mass gap Let us introduce the general mass scale parameter $\Delta^{2}(D)$, having the dimensions of mass squared, by the subtraction from the full gluon self-energy its value at $q=0$. Thus, one obtains $\Pi^{s}_{\rho\sigma}(q;D)=\Pi_{\rho\sigma}(q;D)-\Pi_{\rho\sigma}(0;D)=\Pi_{\rho\sigma}(q;D)-\delta_{\rho\sigma}\Delta^{2}(D),$ (3) which is nothing but the definition of the subtracted full gluon self-energy $\Pi^{s}_{\rho\sigma}(q;D)$. Contrary to QED, QCD being a non-abelian gauge theory can suffer from infrared (IR) singularities in the $q^{2}\rightarrow 0$ limit due to the self-interaction of massless gluon modes. Thus the initial subtraction at zero in the definition (2.3) may be dangerous 1 . That is why in all the quantities below the dependence on the finite (slightly different from zero) dimensionless subtraction point $\alpha$ is to be understood. From a technical point of view, however, it is convenient to put formally $\alpha=0$ in all the derivations below, and to restore the explicit dependence on non-zero $\alpha$ in all the quantities only at the final stage. At the same time, in all the quantities where the dependence on $\lambda$ (which is the dimensionless ultraviolet (UV) regulating parameter) and $\alpha$ is not shown explicitly, nevertheless, it should be assumed. For example, $\Delta^{2}(D)\equiv\Delta^{2}(\lambda,\alpha;D)$ and similarly for all other quantities. So all the expressions are regularized. For our purpose, in principle, it is not important how $\lambda$ and $\alpha$ have been introduced. They should be removed at the final stage only as a result of the renormalization program. By the mass gap we understand some fixed mass squared which is related to $\Delta^{2}(D)$ as follows: $\Delta^{2}(D)=\Delta^{2}\times c(D),$ (4) where the dimensionless constant $c(D)$ depends on $D$, while the fixed mass squared $\Delta^{2}$ does not depend on $D$. It will be called the mass gap. As the general mass scale parameter itself and constant $c(D)$, it may depend on all other dimensionless parameters of the theory, namely $\Delta^{2}\equiv\Delta^{2}(\lambda,\alpha,\xi,g^{2})$, where $g^{2}$ is the coupling constant squared and so on. In this section we will not distinguish between $\Delta^{2}(D)$ and $\Delta^{2}$, calling both the mass gap, for simplicity. From the subtraction (2.3) it follows that the mass gap $\Delta^{2}$, having the dimensions of mass squared, is dynamically generated in the QCD gluon sector. It is defined as the value of the full gluon self- energy at some finite point (see discussion above). It is mainly due to the nonlinear interaction of massless gluon modes. Let us remind that no truncations/approximations/assumptions/, as well as no special gauge choice are made for the regularized skeleton loop integrals, contributing to the full gluon self-energy 4 . ### II.2 The transversality of the full gluon self-energy Let us continue with the general decompositions of the full gluon self-energy and its subtracted counterpart, which enter the subtraction (2.3), as follows: $\displaystyle\Pi_{\rho\sigma}(q;D)$ $\displaystyle=$ $\displaystyle T_{\rho\sigma}(q)q^{2}\Pi(q^{2};D)+q_{\rho}q_{\sigma}\tilde{\Pi}(q^{2};D),$ $\displaystyle\Pi^{s}_{\rho\sigma}(q;D)$ $\displaystyle=$ $\displaystyle T_{\rho\sigma}(q)q^{2}\Pi^{s}(q^{2};D)+q_{\rho}q_{\sigma}\tilde{\Pi}^{s}(q^{2};D),$ (5) where all the invariant functions of $q^{2}$ are dimensionless ones, while in addition the invariant functions $\Pi^{s}(q^{2};D)$ and $\tilde{\Pi}^{s}(q^{2};D)$ cannot have the pole-type singularities in the $q^{2}\rightarrow 0$ limit, since $\Pi^{s}_{\rho\sigma}(0;D)=0$, by definition; otherwise they remain arbitrary. Contracting them with $q_{\rho}$ along with the subtraction (2.3), one obtains $\tilde{\Pi}(q^{2};D)=\tilde{\Pi}^{s}(q^{2};D)+{\Delta^{2}(D)\over q^{2}},$ (6) and $\Pi(q^{2};D)=\Pi^{s}(q^{2};D)+{\Delta^{2}(D)\over q^{2}}.$ (7) It is worth emphasizing that the full gluon self-energy has a massless single particle singularity due to non-zero mass gap $\Delta^{2}(D)$, which is of the non-perturbative (NP) origin. At the same time, its subtracted counterpart cannot have such a singularity, as mentioned above. In other words, this means that in the explicit presence of the mass gap both invariant functions of the full gluon self-energy gain additional contributions due to it (of course, not only at some finite subtraction point $q^{2}=\mu^{2}\neq 0$). If the mass gap is welcome in the transversal invariant function $\Pi(q^{2};D)$, it is not welcome in its longitudinal counterpart $\tilde{\Pi}(q^{2};D)$, since just it violates the ST identity. Let us also note in advance that transversality of the full gluon self-energy and its subtracted counterpart can be achieved only in the formal $\Delta^{2}(D)=0$ limit (for a brief discussion of all these preliminary remarks see subsections below). So in the general case of non-zero $\Delta^{2}(D)$ only two possibilities remain. (i). Both are not transversal and then $\displaystyle q_{\rho}\Pi_{\rho\sigma}(q;D)$ $\displaystyle=$ $\displaystyle q_{\sigma}q^{2}\tilde{\Pi}(q^{2};D)=q_{\sigma}[q^{2}\tilde{\Pi}^{s}(q^{2};D)+\Delta^{2}(D)]\neq 0,$ $\displaystyle q_{\rho}\Pi^{s}_{\rho\sigma}(q;D)$ $\displaystyle=$ $\displaystyle q_{\sigma}q^{2}\tilde{\Pi}^{s}(q^{2};D)=q_{\sigma}[q^{2}\tilde{\Pi}(q^{2};D)-\Delta^{2}(D)].$ (8) The last inequality in the first of the relations (2.8) follows from the fact that $\tilde{\Pi}^{s}(q^{2};D)$ cannot have a single particle singularity $-\Delta^{2}(D)/q^{2}$ in order to cancel $\Delta^{2}(D)$. (ii). Transversality of the subtracted gluon self-energy is maintained, i.e., $\tilde{\Pi}^{s}(q^{2};D)=0$ and then $q_{\rho}\Pi_{\rho\sigma}(q;D)=q_{\sigma}q^{2}\tilde{\Pi}(q^{2};D)=q_{\sigma}\Delta^{2}(D)\neq 0,\quad q_{\rho}\Pi^{s}_{\rho\sigma}(q;D)=0,$ (9) Contrary to the first case, now we know how precisely the transversality of the full gluon self-energy is violated. So it is always violated at non-zero mass scale parameter $\Delta^{2}(D)$. In this connection one thing should be made perfectly clear. It is the initial subtraction (2.3) which leaves the subtracted gluon-self energy logarithmical divergent only, and hence the invariant function $\Pi^{s}(q^{2};D)$ is free of the quadratic divergences, but a logarithmic ones can be still present in it, at any $D$. Since the transversality condition for the full gluon self-energy is violated in these relations, that is why we cannot disregard $\Delta^{2}(D)$ from the very beginning (compare with the pure quark case considered in our initial work 4 ). ### II.3 The ST identity for the full gluon propagator In order to calculate the physical observables in QCD from first principles, we need the full gluon propagator rather than the full gluon self-energy. The basic relation to which the full gluon propagator should satisfy is the corresponding ST identity $q_{\mu}q_{\nu}D_{\mu\nu}(q)=i\xi.$ (10) It is a consequence of the color gauge invarince/symmetry of QCD, and therefore ”is an exact constraint on any solution to QCD” 1 . This is true for any other ST identities. Being a result of this exact symmetry, it is the general one, and it is important for the renormalization of QCD. If some equation, relation or the regularization scheme, etc. do not satisfy it automatically, i.e., without any additional conditions, then they should be modified and not this identity (identity is an equality, where both sides are the same, i.e., there is no room for additional conditions). In other words, all the relations, equations, regularization schemes, etc. should be adjusted to it and not vice versa. It implies that the general tensor decomposition of the full gluon propagator is $D_{\mu\nu}(q)=i\left\\{T_{\mu\nu}(q)d(q^{2})+\xi L_{\mu\nu}(q)\right\\}{1\over q^{2}},$ (11) where the invariant function $d(q^{2})$ is the corresponding Lorentz structure of the full gluon propagator (sometimes we will call it as the full effective charge (”running”), for simplicity). Let us emphasize once more that these basic relations are to be satisfied in any case, for example, whether the mass gap or any other mass scale parameter is put formally zero or not. On account of the exact relations (2.5), (2.6) and (2.7), the initial gluon SD equation (2.1) can be equivalently re-written down as follows: $D_{\mu\nu}(q)=D^{0}_{\mu\nu}(q)+D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}(D)]D_{\sigma\nu}(q)+D^{0}_{\mu\rho}(q)iL_{\rho\sigma}(q)q^{2}\tilde{\Pi}(q^{2};D)D_{\sigma\nu}(q).$ (12) Contracting this equation with $q_{\mu}$ and $q_{\nu}$, one arrives at $q_{\mu}q_{\nu}D_{\mu\nu}(q)=i\xi-i\xi^{2}\tilde{\Pi}(q^{2};D)$, so the ST identity (2.10) is not automatically satisfied. In order to get from this relation the ST identity, one needs to put $\tilde{\Pi}(q^{2};D)=0$, which is equivalent to $\tilde{\Pi}^{s}(q^{2};D)=-(\Delta^{2}(D)/q^{2})$, as it follows from the relation (2.6). This, however, is impossible since $\tilde{\Pi}^{s}(q^{2};D)$ cannot have the power-type singularities at small $q^{2}$, as underlined above. The only solution to the previous relation is to disregard $\Delta^{2}(D)$ from the very beginning, i.e., put formally zero $\Delta^{2}(D)=0$ everywhere. In this case from all the relations it follows that the gluon full self-energy coincides with its subtracted counterpart, and both quantities become purely transversal, i.e., $\Pi(q^{2};D)=\Pi^{s}(q^{2};D)$ and $\tilde{\Pi}(q^{2};D)=\tilde{\Pi}^{s}(q^{2};D)=0$ (see relations (2.5)-(2.7)). The one way to satisfy the ST identity and thus to maintain the color gauge structure of QCD is to discard the mass gap $\Delta^{2}(D)$ from the very beginning, i.e., put it formally zero $\Delta^{2}(D)=0$ in all the equations, relations, etc. In this limit the initial gluon SD equation (2.12) is modified to $D^{PT}_{\mu\nu}(q)=D^{0}_{\mu\nu}(q)+D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)q^{2}\Pi^{s}(q^{2};D^{PT})D^{PT}_{\sigma\nu}(q),$ (13) and the corresponding Lorentz structure which appears in Eq. (2.11) becomes $d^{PT}(q^{2})={1\over 1+\Pi^{s}(q^{2};D^{PT})}.$ (14) It is easy to see that the gluon SD equation (2.13) automatically satisfies the ST identity (2.10) now. Evidently, in the formal $\Delta^{2}(D)=0$ limit we denote $D_{\mu\nu}(q)$ and $d(q^{2})$ as $D^{PT}_{\mu\nu}(q)$ and $d^{PT}(q^{2})$, respectively (for reason see below). As it has been pointed out in Ref. 4 , in this case there will be no problems for ghosts to accomplish their role, namely to cancel the longitudinal component in the full gluon propagator (2.13). ### II.4 The general structure of the full gluon propagator The formal $\Delta^{2}(D)=0$ limit is a real way how to preserve the color gauge invariance in QCD. Then a natural question arises why does the mass gap $\Delta^{2}(D)$ exist in this theory at all? There is no doubt that the color gauge invariance of QCD should be maintained at non-zero mass gap as well, since it is explicitly present in the full gluon self-energy, and hence in the full gluon propagator. However, by keeping it ”alive”, the two important problems arise. The first problem is how to replace the original gluon SD equation (2.12), since it is not consistent with the ST identity unless the mass gap is discarded from the very beginning (see above). The second problem is how to make the full gluon propagator purely transversal when the mass gap is explicitly present. By introducing the spurious technics we were able to show that the ST identity (2.10) can be automatically satisfied at non-zero mass gap $\Delta^{2}(D)$ as well. In other words, our aim is to save the mass gap in the transversal invariant function (2.7), while removing it from the longitudinal invariant function (2.6), but without going formally to the PT $\Delta^{2}=0$ limit. In order to keep the mass gap ”alive”, and, at the same time, to satisfy the ST identity (2.10), we introduced a temporary dependence on $\Delta^{2}(D)$ in the free gluon propagator, thus making it an auxiliary (spurious) free gluon propagator. Substituting it into the initial gluon SD equation (2.12) and restoring again the dependence on the free gluon propagator, such obtained gluon SD equation should satisfy the ST identity (2.10). After doing some tedious algebra, one finally obtains 4 $D_{\mu\nu}(q)=D^{0}_{\mu\nu}(q)+D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}(D)]D_{\sigma\nu}(q).$ (15) Such modified gluon SD equation (2.15) is satisfied by the same expression for the Lorentz structure $d(q^{2})$ in Eq. (2.11) as the original gluon SD equation (2.12), namely $d(q^{2})={1\over 1+\Pi^{s}(q^{2};D)+(\Delta^{2}(D)/q^{2})},$ (16) which is not surprising, since the original gluon SD equation (2.12) and its modified version (2.15) differ from each other only by the longitudinal (unphysical) part. However, the important observation is that now it is not required to put the mass gap $\Delta^{2}(D)$ formally zero everywhere. The spurious mechanism does not affect the dynamical context of the original gluon SD equation. In other words, it makes it possible to retain the mass gap in the transversal part of the gluon SD equation, and, at the same time, to cancel the term in its longitudinal part, which violates the ST identity. In this way, the modified gluon SD equation (2.15) satisfies automatically the ST identity (2.10). Due to AF in QCD the PT regime is realized at $q^{2}\rightarrow\infty$. In this limit all the Green’s functions are possible to approximate by their free PT counterparts (up to the corresponding PT logarithms). However, from the relation (2.16) it follows that in this limit the mass gap term contribution $\Delta^{2}(D)/q^{2}$ is only next-to-next-to-leading order one. The leading order contribution is the subtracted gluon self-energy $\Pi^{s}(q^{2};D)$, which behaves like $\ln q^{2}$ in this limit, as mentioned above. The constant $1$ is the next-to-leading order term in the $q^{2}\rightarrow\infty$ limit. Such a special structure of the relation (2.16), namely the mass gap enters it through the combination $\Delta^{2}(D)/q^{2}$ in its denominator only, explains immediately why the mass gap $\Delta^{2}(D)$ is not important in PT. From this structure it follows that the PT regime at $q^{2}\rightarrow\infty$ is effectively equivalent to the formal $\Delta^{2}(D)=0$ limit and vice versa. That is the reason why this limit can be called the PT limit. And that is why we denote $D_{\mu\nu}(q;\Delta^{2}=0)=D_{\mu\nu}(q;0)\equiv D^{PT}_{\mu\nu}(q)$, and hence $d(q^{2};\Delta^{2}=0)=d(q^{2};0)\equiv d^{PT}(q^{2})$, etc., in accordance with the previous notations. Let us note, however, that sometimes it is useful to distinguish between the asymptotic suppression of the mass gap contribution $\Delta^{2}/q^{2}$ in the $q^{2}\rightarrow\infty$ limit and the formal PT $\Delta^{2}=0$ limit (see our subsequent paper). Thus the formal PT $\Delta^{2}(D)=0$ limit exists, and it is a regular one. As it follows from above, in this limit one recovers the PT QCD system of equations (2.13)-(2.14) from the NP QCD one (2.15)-(2.16). So, we distinguish between the PT and NP phases in QCD by the explicit presence of the mass gap. Its aim is to be responsible for the NP QCD dynamics, since it dominates at $q^{2}\rightarrow 0$ in the ”solution” (2.16). When it is put formally zero, then the PT phase survives only. Evidently, when such a scale is explicitly present then the QCD coupling constant plays no role in the NP QCD dynamics. ### II.5 Transversality of the relevant full gluon propagator The NP QCD system of equations(2.15)-(2.16) depends explicitly on the mass gap $\Delta^{2}$. As it has been discussed in detail in our previous work 4 , then the ghosts are not able to cancel the longitudinal component in the full gluon propagator, i.e., they are of no use in this case (the transversality condition for the full gluon self-energy is always violated, see relations (2.8) and (2.9)). This is the price we have paid to keep the mass gap ”alive” in the full gluon propagator. Our aim here is to formulate a method which allows one to make the gluon propagator, relevant for NP QCD, purely transversal in a gauge invariant way, even if the mass gap is explicitly present. For this purpose let us define the truly NP (TNP) part of the full gluon propagator as follows: $D^{TNP}_{\mu\nu}(q;\Delta^{2})=D_{\mu\nu}(q;\Delta^{2})-D_{\mu\nu}(q;\Delta^{2}=0)=D_{\mu\nu}(q;\Delta^{2})-D^{PT}_{\mu\nu}(q),$ (17) i.e., the subtraction is made with respect to the mass gap $\Delta^{2}$, and therefore the separation between these two terms is exact. So it becomes $D^{TNP}_{\mu\nu}(q;\Delta^{2})=iT_{\mu\nu}(q)\Bigr{[}d(q^{2};\Delta^{2})-d^{PT}(q^{2})\Bigl{]}{1\over q^{2}}=iT_{\mu\nu}(q)d^{TNP}(q^{2};\Delta^{2}){1\over q^{2}},$ (18) where the explicit expression for the TNP Lorentz structure $d^{TNP}(q^{2};\Delta^{2})=d(q^{2};\Delta^{2})-d^{PT}(q^{2})$ can be obtained from the relations (2.16) and (2.14) for $d(q^{2};\Delta^{2})$ and $d^{PT}(q^{2})$, respectively. The subtraction (2.17) is equivalent to $D_{\mu\nu}(q;\Delta^{2})=D^{TNP}_{\mu\nu}(q;\Delta^{2})+D^{PT}_{\mu\nu}(q).$ (19) The TNP gluon propagator (2.18) does not survive in the formal PT $\Delta^{2}=0$ limit. This means that it is free of the PT contributions, by construction. The full gluon propagator in this limit is reduced to its PT counterpart. This means that the full gluon propagator, being also NP, nevertheless, is ”contaminated” by them. The TNP gluon propagator is purely transversal in a gauge invariant way (no special (Landau) gauge choice by hand), while its full counterpart has a longitudinal component as well. There is no doubt that the true NP dynamics of the full gluon propagator is completely contained in its TNP part, since the subtraction (2.19) is nothing but adding zero to the full gluon propagator. We can write $D_{\mu\nu}(q;\Delta^{2})=i\left\\{T_{\mu\nu}(q)d(q^{2};\Delta^{2})+\xi L_{\mu\nu}(q)\right\\}(1/q^{2})-iT_{\mu\nu}(q)d^{PT}(q^{2})(1/q^{2})+iT_{\mu\nu}(q)d^{PT}(q^{2})(1/q^{2})=D^{TNP}_{\mu\nu}(q;\Delta^{2})+D^{PT}_{\mu\nu}(q)$, and so the true NP dynamics in the full gluon propagator is not affected, but contrary exactly separated from its PT dynamics, indeed. In other words, the TNP gluon propagator is the full gluon propagator but free of its PT ”tail”. Taking this important observation into account, we propose instead of the full gluon propagator to use its TNP counterpart (2.18) as the relevant gluon propagator for NP QCD, i.e., to replace $D_{\mu\nu}(q;\Delta^{2})\rightarrow D^{TNP}_{\mu\nu}(q;\Delta^{2})=D_{\mu\nu}(q;\Delta^{2})-D^{PT}_{\mu\nu}(q),$ (20) and hence $d(q^{2};\Delta^{2})\rightarrow d^{TNP}(q^{2};\Delta^{2})=d(q^{2};\Delta^{2})-d^{PT}(q^{2})$. The subtraction (2.20) plays effectively the role of ghosts in our proposal. However, the ghosts cancel only the longitudinal component in the PT gluon propagator, while our proposal leads to the cancellation of the PT contribution in the full gluon propagator as well (and thus to an automatical cancellation of its longitudinal component). Nevertheless, this is not a problem, since the mass gap is not survived in the formal PT limit, anyway. In fact, our proposal is reduced to a rather simple prescription. If one knows a full gluon propagator, and is able to identify the mass scale parameter responsible for the NP dynamics in it, then the full gluon propagator should be replaced in accordance with the subtraction (2.20). The only problem with it is that, being exact, it may not be unique. However, the uniqueness of such kind of separation can be achieved only in the explicit solution for the full gluon propagator as a function of the mass gap (see below). Anyway, this subtraction is a first necessary step, which guarantees transversality of the TNP gluon propagator $D^{TNP}_{\mu\nu}(q;\Delta^{2})$ without losing even one bit of information on the true NP dynamics in the full gluon propagator $D_{\mu\nu}(q;\Delta^{2})$. At the same time, its non-trivial PT dynamics is completely saved in its PT part $D^{PT}_{\mu\nu}(q)$. So it is worth emphasizing that the both terms in the subtraction (2.19) are valid in the whole momentum range, i.e., they are not asymptotics. The full gluon propagator (2.19), keeping the mass gap ”alive”, is not ”physical” in the sense that it cannot be made transversal by ghosts. Therefore it cannot be used for numerical calculations of the physical observables from first principles. However, our proposal makes it possible to present it as the exact sum of the two ”physical” propagators. The TNP gluon propagator is automatically transversal, by construction. It fully contains all the information of the full gluon propagator on its NP context. Just it should be used in accordance with the prescription (2.20) in order to calculate the physical observables in low-energy QCD. In high-energy QCD the PT gluon propagator (2.13) is to be used. It is free of the mass gap and the ghosts can cancel its longitudinal component, making it thus transversal (”physical”). Concluding, in this section we have briefly remind how to preserve the color gauge invariance/symmetry in QCD at non-zero mass gap. This means that from now on we can forget the relations (2.8) and (2.9) at all, since there are no any more their negative consequences for the truly NP QCD. In this connection let us remind the initial subtraction (2.3) has been done in a gauge invariant way (i.e., not in a separate propagators, which enter the skeleton loop integrals, contributing to the full gluon self-energy). ## III Massive solution One of the direct consequences of the explicit presence of the mass gap in the full gluon propagator is that the gluon may acquire an effective mass, indeed 5 . From Eq. (2.16) it follows that ${1\over q^{2}}d(q^{2})={1\over q^{2}+q^{2}\Pi^{s}(q^{2};\xi)+\Delta^{2}c(\xi)},$ (21) where instead of the dependence on $D$ the dependence on $\xi$ is explicitly shown, while here and below the dependence on all other parameters is not shown, for simplicity. The full gluon propagator (2.11) may have a pole-type solution at the finite point if and only if the denominator in Eq. (3.1) has a zero at this point $q^{2}=-m^{2}_{g}$ (Euclidean signature), i.e., $-m^{2}_{g}-m^{2}_{g}\Pi^{s}(-m^{2}_{g};\xi)+\Delta^{2}c(\xi)=0,$ (22) where $m^{2}_{g}\equiv m^{2}_{g}(\xi)$ is an effective gluon mass. The previous equation is a transcendental equation for its determination. Evidently, the number of its solutions is not fixed, $a\ priori$. Excluding the mass gap, one obtains that the denominator in the full gluon propagator becomes $q^{2}+q^{2}\Pi^{s}(q^{2};\xi)+\Delta^{2}c(\xi)=q^{2}+m^{2}_{g}+q^{2}\Pi^{s}(q^{2};\xi)+m^{2}_{g}\Pi^{s}(-m^{2}_{g};\xi).$ (23) Let us now expand $\Pi^{s}(q^{2};\xi)$ in a Taylor series near $m^{2}_{g}$: $\Pi^{s}(q^{2};\xi)=\Pi^{s}(-m^{2}_{g};\xi)+(q^{2}+m^{2}_{g})\Pi^{\prime s}(-m^{2}_{g};\xi)+O\Bigl{(}(q^{2}+m^{2}_{g})^{2}\Bigr{)}.$ (24) Substituting this expansion into the previous relation and after doing some tedious algebra, one obtains $q^{2}+m^{2}_{g}+q^{2}\Pi^{s}(q^{2};\xi)+m^{2}_{g}\Pi^{s}(-m^{2}_{g};\xi)=(q^{2}+m^{2}_{g})[1+\Pi^{s}(-m^{2}_{g};\xi)-m^{2}_{g}\Pi^{\prime s}(-m^{2}_{g};\xi)][1+\Pi^{s,R}(q^{2};\xi)],$ (25) where $\Pi^{s,R}(q^{2};\xi)=0$ at $q^{2}=-m^{2}_{g}$ and it is regular at small $q^{2}$; otherwise it remains arbitrary. The full gluon propagator (2.11) thus now looks $D_{\mu\nu}(q;m^{2}_{g})=iT_{\mu\nu}(q){Z_{3}(m_{g}^{2})\over(q^{2}+m^{2}_{g})[1+\Pi^{s,R}(q^{2};m^{2}_{g})]}+i\xi L_{\mu\nu}(q){1\over q^{2}},$ (26) where, for future purpose, in the invariant function $\Pi^{s,R}(q^{2};m^{2}_{g})$ instead of the gauge-fixing parameter $\xi$ we introduced the dependence on the gluon effective mass squared $m_{g}^{2}$, which depends on $\xi$ itself. The gluon propagator’s renormalization constant is $Z_{3}(m_{g}^{2})={1\over 1+\Pi^{s}(-m^{2}_{g};\xi)-m^{2}_{g}\Pi^{\prime s}(-m^{2}_{g};\xi)}.$ (27) In the formal PT limit $\Delta^{2}=0$, an effective gluon mass is also zero, $m_{g}^{2}(\xi)=0$, as it follows from Eq. (3.2). So an effective gluon mass is the NP effect. At the same time, it cannot be interpreted as the ”physical” gluon mass, since it remains explicitly gauge-dependent quantity (at least at this stage). In other words, we were unable to renormalize it along with the gluon propagator (3.6). In the formal PT $\Delta^{2}=m_{g}^{2}(\xi)=0$ limit the gluon propagator’s renormalization constant (3.7) becomes the standard one 1 ; 2 , namely $Z_{3}(0)={1\over 1+\Pi^{s}(0;\xi)}.$ (28) It is interesting to note that Eq. (3.2) has a second solution in the formal PT $\Delta^{2}=0$ limit. In this case an effective gluon mass remains finite, but $1+\Pi^{s}(-m^{2}_{g};\xi)=0$. So a scale responsible for the NP dynamics is not determined by an effective gluon mass itself, but by this condition. Its interpretation from the physical point of view is not clear. The massive solution (3.6) is difficult to use for the solution of the color confinement problem, since it is smooth in the $q^{2}\rightarrow 0$ limit. However, its existence shows the general possibility for a vector particles to acquire masses dynamically, i.e., without so-called Higgs mechanism 6 , which requires the existence of not yet discovered Higgs particle. Apparently, it can be also useful in the generalization of QCD to non-zero temperature and density 7 ; 8 (and references therein), when the gluons may indeed acquire effective masses. The above-mentioned possibility is due only to the internal dynamics and symmetries of the corresponding gauge theory. The general procedure described above in subsection E of section II can be directly applied to the massive solution (3.6). So it becomes $D_{\mu\nu}(q;m^{2}_{g})=D^{TNP}_{\mu\nu}(q;m^{2}_{g})+D^{PT}_{\mu\nu}(q),$ (29) where $D^{TNP}_{\mu\nu}(q;m^{2}_{g})=iT_{\mu\nu}(q)\left[{Z_{3}(m^{2}_{g})\over(q^{2}+m^{2}_{g})[1+\Pi^{s,R}(q^{2};m^{2}_{g})]}-{Z_{3}(0)\over q^{2}[1+\Pi^{s,R}(q^{2};0)]}\right]$ (30) and $D^{PT}_{\mu\nu}(q)=i\left[T_{\mu\nu}(q){Z_{3}(0)\over[1+\Pi^{s,R}(q^{2};0)]}+\xi L_{\mu\nu}(q)\right]{1\over q^{2}}.$ (31) Let us remind that in the massive solution the role of the mass gap is played by an effective gluon mass, so the formal PT limit is $m^{2}_{g}=0$. In accordance with our prescription (2.20), we should finally replace the full gluon propagator (3.6) as follows: $D_{\mu\nu}(q;m_{g}^{2})\rightarrow D^{TNP}_{\mu\nu}(q;m_{g}^{2})$, where the latter is explicitly given in Eq. (3.10). ## IV General NL iteration solution In order to find another type of the general formal solution for the full gluon propagator (2.15), let us begin again with its ”solution” (2.16) which is $d(q^{2})\equiv d(q^{2};\Delta^{2})={1\over 1+\Pi^{s}(q^{2};d)+c(d)(\Delta^{2}/q^{2})},$ (32) where the dependence on $D$ is replaced by the equivalent dependence on $d$ and the relation (2.4) is already used. It is worth reminding that the invariant function $\Pi^{s}(q^{2};d)$ and $c(d)$ are, in fact, the sum of the corresponding skeleton loop integrals (see section II and our initial paper 4 ). Let us introduce further the dimensionless variable $z=\Delta^{2}/q^{2}$. The full Lorentz structure (4.1) regularly depends on the mass gap, and hence on $z$. Thus it can be expand in a Taylor series in powers of $z$ around zero $z$ as follows: $d(q^{2};\Delta^{2})=d(q^{2};z)=\sum_{k=0}^{\infty}z^{k}f_{k}(q^{2}),$ (33) where the functions $f_{k}(q^{2})$ are the corresponding derivatives of $d(q^{2};z)$ with respect to $z$ at $z=0$, which is equivalent to the PT $\Delta^{2}=0$ limit. For example, $f_{0}(q^{2})=d(q^{2};z=0)=d^{PT}(q^{2})=[1+\Pi^{s}(q^{2};d^{PT}]^{-1}$, $f_{1}(q^{2})=(\partial d(q^{2};z)/\partial z)_{z=0}=\left[\partial[1+\Pi^{s}(q^{2};d)+c(d)z]^{-1}/\partial z\right]_{z=0}=-\left[1+\Pi^{s}(q^{2};d^{PT})\right]^{-2}c(d^{PT})=-[d^{PT}(q^{2})]^{2}c(d^{PT})$, and so on, i.e., $f_{k}(q^{2})=(-1)^{k}d^{PT}(q^{2})[d^{PT}(q^{2})c(d^{PT})]^{k}$. Fortunately, these explicit expressions play no any role in what follows. In any case, they depend on the unknown, in general, quantities $\Pi^{s}(q^{2};d)$ and $c(d)$, which by themselves NL depend on $d$ and finally on $d^{PT}$ and $c(d^{PT})$. So our expansion (4.2) is nothing but the NL iteration series in powers of the mass gap (for the direct NL iteration procedure with $d^{(0)}=1$ as input information see appendix A). To use also unknown functions $f_{k}(q^{2})$ much more convenient from the technical point of view. However, it is worth emphasizing that, contrary to the relation (4.1), the expansion (4.2) can be considered now as a formal solution for $d(q^{2})$, since $f_{k}(q^{2})$ depend on $d^{PT}(q^{2})$, which is assumed to be ”known”. The functions $f_{k}(q^{2})$ are regular functions of the variable $q^{2}$, since they finally depend on $d^{PT}(q^{2})$ which is a regular function of $q^{2}$. Therefore they can be expand in a Taylor series near $q^{2}=0$ (here we can put the subtraction point $\alpha=0$, for simplicity, since all the quantities are already regularized, i.e., they depend on $\alpha$ and so on, see appendix A). Introducing the dimensionless variable $x=q^{2}/M^{2}$, where $M^{2}$ is some fixed auxiliary mass squared, it is convenient to present this expansion as a sum of the two terms, namely $f_{k}(q^{2})=\sum_{n=0}^{k}x^{n}f_{kn}(0)+x^{k+1}B_{k}(x),$ (34) where the coefficient $f_{kn}(0)$ are the corresponding derivatives of the functions $f_{k}(q^{2})\equiv f_{k}(x)$ with respect to $x$ at $x=0$. Of course, these coefficients depend on the parameters of the theory such as $\lambda,\alpha,\xi,g^{2}$, and so on, which are not shown explicitly. The dependence on these parameters will be restored at the final stage of our derivations. The dimensionless functions $B_{k}(x)$ are regular functions of $x$; otherwise they remain arbitrary. So the general Lorentz structure (4.2) becomes $d(q^{2})=\sum_{k=0}^{\infty}z^{k}f_{k}(x)=\sum_{k=0}^{\infty}z^{k}\Big{(}\sum_{n=0}^{k}x^{n}f_{kn}(0)+x^{k+1}B_{k}(x)\Big{)}.$ (35) Omitting all the intermediate tedious derivations (which, nevertheless, are quite obvious), these double sums can be equivalently present as the sum of the three independent terms as follows: $d(q^{2})=z\sum_{k=0}^{\infty}z^{k}\sum_{m=0}^{\infty}\Phi_{km}(0)+a\sum_{k=0}^{\infty}a^{k}\sum_{m=0}^{\infty}A_{km}(x)+d^{PT}(q^{2}),$ (36) where the constant $a=xz=\Delta^{2}/M^{2}$ and the dimensionless functions $A_{km}(x)$ are regular functions of $x$: otherwise they remain arbitrary. $d^{PT}(q^{2})$ denotes the terms which do not depend on the mass gap $\Delta^{2}$ at all, i.e., it is nothing but the Lorentz structure of the PT gluon propagator (2.14), indeed. The summation over $m$ explicitly shows that all iterations invoke each NP IR singularity labeled by $k$ in the first term of the expansion (4.5). Thus it is the general NL formal expansion in powers of the mass gap (this is explicitly seen from appendix A). Going back to the gluon momentum variable $q^{2}$, one obtains $d(q^{2};\Delta^{2})=d^{TNP}(q^{2};\Delta^{2})+d^{PT}(q^{2})=d^{INP}(q^{2};\Delta^{2})+d^{MPT}(q^{2};\Delta^{2})+d^{PT}(q^{2}),$ (37) where the superscripts ”INP” and ”MPT” stand for the intrinsically NP and mixed PT parts of the TNP term, respectively (for reasons see discussion below). In other words, in the general NL iteration solution the TNP part itself is a sum of the two independent terms, i.e., $d^{TNP}(q^{2};\Delta^{2})=d^{INP}(q^{2};\Delta^{2})+d^{MPT}(q^{2};\Delta^{2})$. Their explicit expressions are $d^{INP}(q^{2};\Delta^{2})=\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{k}\Phi_{k}=\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{k}\sum_{m=0}^{\infty}\Phi_{km}$ (38) and $d^{MPT}(q^{2};\Delta^{2})=\Bigl{(}{\Delta^{2}\over M^{2}}\Bigr{)}\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over M^{2}}\Bigr{)}^{k}A_{k}(q^{2})=\Bigl{(}{\Delta^{2}\over M^{2}}\Bigr{)}\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over M^{2}}\Bigr{)}^{k}\sum_{m=0}^{\infty}A_{km}(q^{2}).$ (39) Here and everywhere below all the quantities depend on the parameters of the theory, namely $\Delta^{2}=\Delta^{2}(\lambda,\alpha,\xi,g^{2})$ and $A_{k}(q^{2})=\sum_{m=0}^{\infty}A_{km}(q^{2};\lambda,\alpha,\xi,g^{2})$. At the same time, $\Phi_{km}$ depends in addition on the parameter $a$ as well, i.e., $\Phi_{km}=\Phi_{km}(\lambda,\alpha,\xi,g^{2},a)$. ### IV.1 The exact structure of the NL iteration solution The full gluon propagator (2.11) thus becomes the sum of the three independent terms, namely $D_{\mu\nu}(q;\Delta^{2})=D^{TNP}_{\mu\nu}(q;\Delta^{2})+D^{PT}_{\mu\nu}(q)=D^{INP}_{\mu\nu}(q;\Delta^{2})+D^{MPT}_{\mu\nu}(q;\Delta^{2})+D^{PT}_{\mu\nu}(q),$ (40) where $D^{INP}_{\mu\nu}(q;\Delta^{2})=iT_{\mu\nu}(q)d^{INP}(q^{2};\Delta^{2}){1\over q^{2}}=iT_{\mu\nu}(q){\Delta^{2}\over(q^{2})^{2}}L(q^{2};\Delta^{2})$ (41) with $L(q^{2};\Delta^{2})=\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{k}\Phi_{k}=\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{k}\sum_{m=0}^{\infty}\Phi_{km},$ (42) while $D^{MPT}_{\mu\nu}(q;\Delta^{2})=iT_{\mu\nu}(q)d^{MPT}(q^{2};\Delta^{2}){1\over q^{2}}$ (43) with $d^{MPT}(q^{2};\Delta^{2})$ given in Eq. (4.13) and $D^{PT}_{\mu\nu}(q)=i\Bigr{[}T_{\mu\nu}(q)d^{PT}(q^{2})+\xi L_{\mu\nu}(q)\Bigl{]}{1\over q^{2}}$ (44) with $d^{PT}(q^{2})$ given in Eq. (2.14). For the direct NL iteration procedure see appendix A, as mentioned above. Let us emphasize that the general problem of convergence of formal (but regularized) series, which appear in these relations, is irrelevant here. In other words, it does not make any sense to discuss the convergence of such kind of series before the renormalization program is performed (which will allow one to see whether or not the mass gap survives it at all). The problem how to remove the UV overlapping divergences 9 and usual overall ones 1 ; 2 ; 10 ; 11 is a standard one, i.e., it is not our problem, anyway (let us remind that the mass gap does not survive in the PT $q^{2}\rightarrow\infty$ limit). Our problem will be how to deal with severe infrared (IR) ($q^{2}\rightarrow 0$) singularities due to their novelty and genuine (intrinsic) NP character (in this limit the mass gap dominates the structure of the full gluon propagator). Fortunately, there already exists a well-elaborated mathematical formalism for this purpose, namely the distribution theory (DT) 12 , into which the dimensional regularization method (DRM) 13 should be correctly implemented (see also Refs. 14 ; 15 ). The INP part of the full gluon propagator is characterized by the presence of severe power-type (or, equivalently, NP) IR singularities $(q^{2})^{-2-k},\ k=0,1,2,3,...$. So these IR singularities are defined as more singular than the power-type IR singularity of the free gluon propagator $(q^{2})^{-1}$, which thus can be defined as the PT IR singularity. The INP part of the full gluon propagator (4.10), apart from the structure $(\Delta^{2}/q^{4})$, is nothing but the corresponding Laurent expansion (explicitly shown in Eq. (4.11)) in integer powers of $q^{2}$ accompanied by the corresponding powers of the mass gap squared and multiplied by the $q^{2}$-independent factors, the so-called residues $\Phi_{k}(\lambda,\alpha,\xi,g^{2},a)=\sum_{m=0}^{\infty}\Phi_{km}(\lambda,\alpha,\xi,g^{2},a)$. The sum over $m$ indicates that an infinite number of iterations (all iterations) of the above-mentioned corresponding regularized skeleton loop integrals invokes each severe IR singularity labeled by $k$. It is worth emphasizing that the Laurent expansion (4.11) cannot be summed up into the some known function, since its residues are, in general, arbitrary. However, this arbitrariness is not a problem. The functional dependence, which has been established exactly, is all that matters (this will be explicitly shown in the subsequent paper). Let us note that the expansions (4.10)-(4.11) have been independently obtained in Ref. 14 in a rather different way. The MPT part of the full gluon propagator (4.12), which has the power-type PT IR singularity only, remains undetermined, but depends on the mass gap (that is why we call this term as the mixed PT contribution, but it vanishes in the formal PT $\Delta^{2}=0$ limit). This is the price we have paid to fix exactly the functional dependence of the INP part of the full gluon propagator. With respect to the character of the IR singularity it should be combined with the PT gluon propagator, leading to the so-called general PT (GPT) term, namely $D^{GPT}_{\mu\nu}(q;\Delta^{2})=D^{MPT}_{\mu\nu}(q;\Delta^{2})+D^{PT}_{\mu\nu}(q)=i\Bigr{[}T_{\mu\nu}(q)d^{GPT}(q^{2};\Delta^{2})+\xi L_{\mu\nu}(q)\Bigl{]}{1\over q^{2}},$ (45) where $d^{GPT}(q^{2};\Delta^{2})=d^{MPT}(q^{2};\Delta^{2})+d^{PT}(q^{2})$ is regular at small $q^{2}$, while $d^{MPT}(q^{2};\Delta^{2}=0)=0$ and hence $d^{GPT}(q^{2};\Delta^{2}=0)=d^{PT}(q^{2})$. Thus both terms MPT and PT present the PT-type contributions to the full gluon propagator (4.6). It is worth reminding that all the three terms, which appear in the right-hand-side of Eq. (4.9) are valid in the whole energy/momentum range, i.e., they are not asymptotics. At the same time, we have achieved the separation between the terms responsible for the NP (dominating in the IR ($q^{2}\rightarrow 0$)) and the nontrivial PT (dominating in the UV ($q^{2}\rightarrow\infty$)) dynamics in the true QCD vacuum. The structure of this solution shows clearly that the deep IR region interesting for confinement and other NP effects is dominated by the mass gap. In the formal PT $\Delta^{2}=0$ limit, the nontrivial PT dynamics is all that matters. ## V INP gluon propagator In accordance with our prescription, one should subtract all the types of the PT contributions in order to get the relevant gluon propagator for the truly NP QCD. As it follows from discussion above, in the case of the NL iteration solution, we should subtract the two terms. Doing so in Eq. (4.9), on account of Eq. (4.14), one finally obtains $D_{\mu\nu}(q;\Delta^{2})\rightarrow D^{INP}_{\mu\nu}(q;\Delta^{2})=D_{\mu\nu}(q;\Delta^{2})-D^{GPT}_{\mu\nu}(q;\Delta^{2}),$ (46) and hence $d(q^{2})\rightarrow d^{INP}(q^{2})$ as well, so that $D^{INP}_{\mu\nu}(q;\Delta^{2})=iT_{\mu\nu}(q){\Delta^{2}\over(q^{2})^{2}}L(q^{2};\Delta^{2})=iT_{\mu\nu}(q){\Delta^{2}\over(q^{2})^{2}}\sum_{k=0}^{\infty}\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{k}\Phi_{k},$ (47) where $\Delta^{2}=\Delta^{2}(\lambda,\alpha,\xi,g^{2})$ and $\Phi_{k}=\Phi_{k}(\lambda,\alpha,\xi,g^{2})=\sum_{m=0}^{\infty}\Phi_{km}(\lambda,\alpha,\xi,g^{2})$. In this connection, let us note that after the subtraction (5.1) is completed we can put the intermediate parameter $a=1$, to equate thus the auxiliary fixed mass to the mass gap itself, i.e., put $M^{2}=\Delta^{2}$, not losing generality. In the deep IR region ($q^{2}\rightarrow 0$) the mass gap is only one that’s really matters. All other masses introduced from a technical point of view in order to clarify the derivations play only auxiliary role. It is important to emphasize that the INP gluon propagator (5.2) is uniquely defined because there exists a special regularization expansion for severe (i.e., NP) IR singularities, while for the PT IR singularity such kind of expansion does not exist at all (see Refs. 12 ; 14 ; 15 and references therein). This just determines the principal difference between the NP and PT IR singularities. It is also exactly defined because of its two features. The first one is that the INP gluon propagator depends only on the transversal degrees of freedom of gauge bosons. The second one is that in the formal PT $\Delta^{2}=0$ limit the INP gluon propagator vanishes. Thus, one can conclude that the presence of severe IR singularities only is the first necessary condition, while the regular dependence on the mass gap and transversality is only second sufficient condition for the unique and exact separation of the INP gluon propagator from the PT gluon propagator. At the same time, the TNP gluon propagator is not uniquely defined, since it contains the MPT part, see Eq. (4.9). In other words, the INP gluon propagator is free of all the types of the PT contributions (”contaminations”). Just it should replace the full gluon propagator in order to calculate the physical observables, processes, etc. from first principles in low-energy QCD after the corresponding renormalization program is performed. The INP gluon propagator satisfies its own equation of motion. For the sake of completeness, let us begin with the SD equation for the TNP gluon propagator 4 , namely $\displaystyle D^{TNP}_{\mu\nu}(q;\Delta^{2})$ $\displaystyle=$ $\displaystyle D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[-q^{2}\Pi^{s}(q^{2};D^{PT})+q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{PT}_{\sigma\nu}(q)$ (48) $\displaystyle+$ $\displaystyle D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{TNP}_{\sigma\nu}(q;\Delta^{2})$ with $D^{TNP}_{\mu\nu}(q)=i\left\\{T_{\mu\nu}(q)d^{TNP}(q^{2})+\xi L_{\mu\nu}(q)\right\\}{1\over q^{2}}.$ (49) Here and below we omit the dependence on the mass gap in the propagators and their Lorentz structures, for simplicity. On account of this decomposition, the ”solution” of the previous equation is $d^{TNP}(q^{2})={\Pi^{s}(q^{2};D^{PT})-\Pi^{s}(q^{2};D)-(\Delta^{2}/q^{2})\over[1+\Pi^{s}(q^{2};D)+(\Delta^{2}/q^{2})][1+\Pi^{s}(q^{2};D^{PT})]}.$ (50) This expression coincides with the definition of $d^{TNP}(q^{2})=d(q^{2})-d^{PT}(q^{2})$ on account of the explicit expressions (2.14) and (2.15), as it should be. From Eq. (4.9) it follows that $D^{TNP}_{\mu\nu}(q)=D^{INP}_{\mu\nu}(q)+D^{MPT}_{\mu\nu}(q),$ (51) and substituting it into Eq. (5.3), one obtains the SD equation for the INP gluon propagator, namely $\displaystyle D^{INP}_{\mu\nu}(q)=$ $\displaystyle-$ $\displaystyle D^{MPT}_{\mu\nu}(q)+D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{MPT}_{\sigma\nu}(q)$ (52) $\displaystyle+$ $\displaystyle D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[-q^{2}\Pi^{s}(q^{2};D^{PT})+q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{PT}_{\sigma\nu}(q)$ $\displaystyle+$ $\displaystyle D^{0}_{\mu\rho}(q)iT_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{INP}_{\sigma\nu}(q).$ Using the decompositions (2.2), (4.12) and (4.13), it can be simplified to $\displaystyle q^{2}D^{INP}_{\mu\nu}(q)=$ $\displaystyle-$ $\displaystyle iT_{\mu\nu}(q)\Bigl{(}1+\Pi^{s}(q^{2};D)+(\Delta^{2}/q^{2})\Bigr{)}d^{MPT}(q)$ (53) $\displaystyle-$ $\displaystyle iT_{\mu\nu}(q)\Bigl{(}-\Pi^{s}(q^{2};D^{PT})+\Pi^{s}(q^{2};D)+(\Delta^{2}/q^{2})\Bigr{)}d^{PT}(q)$ $\displaystyle-$ $\displaystyle T_{\mu\sigma}(q)T_{\rho\sigma}(q)[q^{2}\Pi^{s}(q^{2};D)+\Delta^{2}]D^{INP}_{\sigma\nu}(q),$ where $d^{MPT}(q)$ and $d^{PT}(q)$ are given in Eqs. (4.8) and (2.14), respectively. This equation is of no practical use due to its complicated structure. Fortunately, we already have the explicit expression for the INP gluon propagator (4.10)-(4.11) or, equivalently, (5.2). It is only one to be used in order to derive renormalized gluon propagator with the correct confinement properties. However, from Eq. (5.8) it follows an important observation that like the TNP SD equation (5.3) this equation cannot be reduced to the free gluon propagator, when the interaction is to be switched off (i.e., setting formally $\Pi^{s}(q^{2};D^{PT})=\Pi^{s}(q^{2};D)=\Delta^{2}=0$). Evidently, to the same conclusion one comes from the explicit expressions (4.8) and (5.5), on account of the relation $d^{INP}(q^{2};\Delta^{2})=d^{TNP}(q^{2};\Delta^{2})-d^{MPT}(q^{2};\Delta^{2})$, which follows from Eq. (4.6). So in INP QCD the gluon propagator is always ”dressed” as well, and thus this theory has no free gluon propagator in its formalism. As it has been argued in our initial work 4 , it makes it possible to suppress the emission and absorbtion of the colored dressed gluons at large distances by the renormalization of the mass gap. Both the suppression of the dressed gluons and the absence of the free gluons are necessary for the explanation of gluon confinement by INP QCD (see our next paper). On the other hand, the full gluon propagator (2.19) which satisfies Eq. (2.15) is reduced to the free gluon propagator when the interaction is switched off. There is no mechanism to suppress the emission and absorbtion of the free gluons at large distances 4 . That is why the full gluon propagator (2.19) is not confining, while the INP one (5.2) can be. The subtraction (5.1) seems to be necessary, indeed. It makes the relevant gluon propagator (5.2) transversal and excludes the free gluons from the theory at the same time. ## VI Conclusions The structure of the full gluon propagator in the presence of the regularized mass gap has been firmly established. We have shown explicitly that in its presence at least two independent and different typed of formal solutions for the regularized full gluon propagator exist. No truncations/approximations/assumptions are made in order to show the existence of these general types of solutions. Also, our approach, in general, and the above-mentioned solutions, in particular, is gauge-invariant, since no special gauge has been chosen. Let us emphasize that before the renormalization program is performed the gauge invariance should be understood in this sense only. In the presence of the mass gap the gluons may acquire an effective gluon masses, depending on the gauge choice (the so-called massive solution (3.6)), but a gauge-fixing parameter remains arbitrary, i.e., a gauge is not fixed by hand (see remarks above). Its relation to the solution of the color confinement problem is not clear, even after the renormalization program is performed. The general NL iteration solution (4.9)-(4.13) for the full gluon propagator depends explicitly on the mass gap. It is always severely singular in the $q^{2}\rightarrow 0$ limit, so the gluons remain massless, and this does not depend on the gauge choice. However, we argued that only the INP gluon propagator (5.2) is to be used for the numerical calculations of physical observables, processes, etc. in low-energy QCD from first principles. It is worth emphasizing that there exists only one general restriction on the behavior of $\Pi^{s}(q^{2};D)$, which enters the corresponding gluon SD equation (2.15), in the explicit presence of the mass gap within our approach, namely $q^{2}\Pi^{s}(q^{2};D)\rightarrow 0,\quad q^{2}\rightarrow 0,$ (54) at any $D$. It stems from the second of the exact decompositions (2.5), since the subtracted gluon self-energy in this limit (or more precisely at $q^{2}\rightarrow\mu^{2}$) should go to zero. Otherwise the invariant function $\Pi^{s}(q^{2};D)$ remains arbitrary (but it is logarithmic divergent at infinity). Both general types of formal solutions the massive solution and the NL iteration one satisfy it. The existence of some other solution(s) for the full gluon propagator, satisfying the general condition (6.1), should not be excluded $a\ priori$. Let us remind that the gluon SD equation (2.15) is highly NL, so the number of independent solutions is not fixed. Any concrete solution obtained by lattice QCD or by the analytical approach based on the SD system of equations is a particular case of the general types (finite or singular at zero gluon momentum) of the formal solutions established here. They are subject to the different truncations/approximations/assumptions and the concrete gauge choice imposed on the invariant function $\Pi^{s}(q^{2};D)$, which, in general, remains arbitrary but satisfying the above-mentioned general constraint (6.1) within our approach (see, for example recent papers 16 ; 17 ; 18 ; 19 ; 20 ; 21 ; 22 and references therein. Let us also point out Refs. 23 ; 24 ; 25 ; 26 as well, where the gluon propagator is finite and contains the mass scale parameter. However, it, apparently, cannot be interpreted as gluon effective mass). The INP solution (5.2) is interesting for confinement, but the two important problems remain to solve. The first problem is how to perform the renormalization program for the regularized mass gap $\Delta^{2}\equiv\Delta^{2}(\lambda,\alpha,\xi,g^{2})$, and to see whether the mass gap survives it or not (it has been already discussed in our previous work 4 ). The second problem is how to treat correctly severe IR singularities $(q^{2})^{-2-k},\ k=0,1,2,3,...$ inevitably present in this solution (see a few brief remarks above in section IV). Both problems will be addressed and solved in our subsequent paper. ###### Acknowledgements. Support by HAS-JINR grant (P. Levai) is to be acknowledged. The author is grateful to P. Forgács, J. Nyiri, C. Wilkin, T. Biró, M. Faber, Á. Lukács, M. Vasúth and especially to A.V. Kouzushin for useful discussions, remarks and help. ## Appendix A Direct NL iteration procedure In order to find a formal solution for the regularized full gluon propagator (2.11), on account of its effective charge (2.16), let us rewrite the latter one in the form of the corresponding transcendental (i.e., not algebraic) equation, namely $d(q^{2})=1-\Bigl{[}\Pi^{s}(q^{2};d)+{\Delta^{2}\over q^{2}}c(d)\Bigr{]}d(q^{2})=1-P(q^{2};d)d(q^{2}),$ (55) where Eq. (2.4) has been already used, and instead of $D$ an equivalent dependence on $d$ is introduced. It is suitable for the formal NL iteration procedure. For future purposes, it is convenient to introduce short-hand notations as follows: $\displaystyle c(d=d^{(0)}+d^{(1)}+d^{(2)}+...+d^{(m)}+...)$ $\displaystyle=$ $\displaystyle c_{m}\equiv c_{m}(\lambda,\alpha,\xi,g^{2}),$ $\displaystyle\Pi^{s}(q^{2};d=d^{(0)}+d^{(1)}+d^{(2)}+...+d^{(m)}+...)$ $\displaystyle=$ $\displaystyle\Pi^{s}_{m}(q^{2}),$ (56) and $P_{m}(q^{2})=\Bigl{[}\Pi^{s}_{m}(q^{2})+{\Delta^{2}\over q^{2}}c_{m}\Bigr{]},\ m=0,1,2,3,...\ .$ (57) Via the corresponding subscript $m$ it is explicitly seen which iteration for the gluon form factor $d$ is actually done in $c(d)$, $\Pi^{s}(q^{2};d)$ and $P(q^{2};d)$. Let us also point out that all the invariant functions $\Pi^{s}_{m}(q^{2})$ can be expand in a formal Taylor series near the finite subtraction point $\alpha$. If it were possible to express the full gluon form factor $d(q^{2})$ in terms of these quantities then it would be the formal solution for the full gluon propagator. In fact, this is nothing but the skeleton loops expansion, since the regularized skeleton loop integrals, contributing to the gluon self-energy as mentioned above, have to be iterated. This is the so-called general NL iteration solution. This formal expansion is not a PT series. The magnitude of the coupling constant squared and the dependence of the regularized skeleton loop integrals on it is completely arbitrary. It is instructive to describe the general iteration procedure in some details. Evidently, $d^{(0)}=1$, and this corresponds to the approximation of the full gluon propagator by its free counterpart. Doing the first iteration in Eq. (A1), one thus obtains $d(q^{2})=1-P_{0}(q^{2})+...=1+d^{(1)}(q^{2})+...,$ (58) where obviously $d^{(1)}(q^{2})=-P_{0}(q^{2}).$ (59) Carrying out the second iteration, one gets $d(q^{2})=1-P_{1}(q^{2})[1+d^{(1)}(q^{2})]+...=1+d^{(1)}(q^{2})+d^{(2)}(q^{2})+...,$ (60) where $d^{(2)}(q^{2})=-d^{(1)}(q^{2})-P_{1}(q^{2})[1-P_{0}(q^{2})].$ (61) Doing the third iteration, one further obtains $d(q^{2})=1-P_{2}(q^{2})[1+d^{(1)}(q^{2})+d^{(2)}(q^{2})]+...=1+d^{(1)}(q^{2})+d^{(2)}(q^{2})+d^{(3)}(q^{2})+...,$ (62) where $d^{(3)}(q^{2})=-d^{(1)}(q^{2})-d^{(2)}(q^{2})-P_{2}(q^{2})[1-P_{1}(q^{2})(1-P_{0}(q^{2}))],$ (63) and so on for the next iterations. Thus up to the third iteration, one finally arrives at $d(q^{2})=\sum_{m=0}^{\infty}d^{(m)}(q^{2})=1-\Bigl{[}\Pi^{s}_{2}(q^{2})+{\Delta^{2}\over q^{2}}c_{2}\Bigr{]}\Bigl{[}1-\Bigl{[}\Pi^{s}_{1}(q^{2})+{\Delta^{2}\over q^{2}}c_{1}\Bigr{]}\Bigl{[}1-\Pi^{s}_{0}(q^{2})-{\Delta^{2}\over q^{2}}c_{0}\Bigr{]}\Bigr{]}+...\ .$ (64) We restrict ourselves by the iterated gluon form factor up to the third term, since this already allows to show explicitly some general features of the NL iteration solution. ### A.1 Splitting/shifting procedure Doing some tedious algebra, the previous expression (A10) can be rewritten as follows: $\displaystyle d(q^{2})$ $\displaystyle=$ $\displaystyle\Bigl{[}1-\Pi^{s}_{2}(q^{2})+\Pi^{s}_{1}(q^{2})\Pi^{s}_{2}(q^{2})-\Pi^{s}_{0}(q^{2})\Pi^{s}_{1}(q^{2})\Pi^{s}_{2}(q^{2})+...\Bigr{]}$ (65) $\displaystyle+$ $\displaystyle{\Delta^{2}\over q^{2}}\Bigl{[}\Pi^{s}_{2}(q^{2})c_{1}+\Pi^{s}_{1}(q^{2})c_{2}-\Pi^{s}_{0}(q^{2})\Pi^{s}_{1}(q^{2})c_{2}-\Pi^{s}_{0}(q^{2})\Pi^{s}_{2}(q^{2})c_{1}-\Pi^{s}_{1}(q^{2})\Pi^{s}_{2}(q^{2})c_{0}+...\Bigr{]}$ $\displaystyle-$ $\displaystyle{\Delta^{4}\over q^{4}}\Bigl{[}\Pi^{s}_{0}(q^{2})c_{1}c_{2}+\Pi^{s}_{1}(q^{2})c_{0}c_{2}+\Pi^{s}_{2}(q^{2})c_{0}c_{1}+...\Bigr{]}$ $\displaystyle-$ $\displaystyle{\Delta^{2}\over q^{2}}\Bigl{[}c_{2}-{\Delta^{2}\over q^{2}}c_{1}c_{2}+{\Delta^{4}\over q^{4}}c_{0}c_{1}c_{2}+...\Bigr{]}.$ This formal expansion contains three different types of terms. The first type are the terms which contain only different combinations of $\Pi^{s}_{m}(q^{2})$ (they are not multiplied by inverse powers of $q^{2}$); the third type of terms contains only different combinations of $(\Delta^{2}/q^{2})$. The second type of terms contains the so-called mixed terms, containing the first and third types of terms in different combinations. The two last types of terms are multiplied by the corresponding powers of $1/q^{2}$. Such structure of terms will be present in each iteration term for the full gluon form factor. However, any of the mixed terms can be split exactly into the first and third types of terms. For this purpose the formal Taylor expansions for $\Pi^{s}_{m}(q^{2})$ around the finite subtraction point $\alpha$ should be used. Thus an exact IR structure of the full gluon form factor (which just is our primary goal to establish) is determined not only by the third type of terms. It gains contributions from the mixed terms as well, but without changing its functional dependence (see remarks below). To demonstrate this in some detail, it is convenient to express the previous expansion (A11) in terms of dimensionless variables and parameters introduced in section IV, namely $z={\Delta^{2}\over q^{2}},\quad x={q^{2}\over M^{2}},\quad a=zx={\Delta^{2}\over M^{2}},\quad\alpha={\mu^{2}\over M^{2}},$ (66) where $M^{2}$ is some fixed mass squared, and $\mu^{2}$ is the fixed point close to $q^{2}=0$ (to be not mixed up with the tensor index). Also, in the formal PT $\Delta^{2}=0$ limit $a=0$ as well, since $M^{2}$ is fixed. On account of the relations (A12), the expansion (A11) becomes $\displaystyle d(x)$ $\displaystyle=$ $\displaystyle\Bigl{[}1-\Pi^{s}_{2}(x)+\Pi^{s}_{1}(x)\Pi^{s}_{2}(x)-\Pi^{s}_{0}(x)\Pi^{s}_{1}(x)\Pi^{s}_{2}(x)+...\Bigr{]}$ (67) $\displaystyle+$ $\displaystyle z\Bigl{[}\Pi^{s}_{2}(x)c_{1}+\Pi^{s}_{1}(x)c_{2}-\Pi^{s}_{0}(x)\Pi^{s}_{1}(x)c_{2}-\Pi^{s}_{0}(x)\Pi^{s}_{2}(x)c_{1}-\Pi^{s}_{1}(x)\Pi^{s}_{2}(x)c_{0}+...\Bigr{]}$ $\displaystyle-$ $\displaystyle z^{2}\Bigl{[}\Pi^{s}_{0}(x)c_{1}c_{2}+\Pi^{s}_{1}(x)c_{0}c_{2}+\Pi^{s}_{2}(x)c_{0}c_{1}+...\Bigr{]}$ $\displaystyle-$ $\displaystyle z\Bigl{[}c_{2}-\Bigl{(}{a\over x}\Bigr{)}c_{1}c_{2}+\Bigl{(}{a\over x}\Bigr{)}^{2}c_{0}c_{1}c_{2}+...\Bigr{]}.$ Taking into account the above-mentioned formal Taylor expansions $\Pi^{s}_{m}(x)=\sum_{n=0}^{\infty}(x-\alpha)^{n}\Pi^{(n)}_{m}(\alpha)=\sum_{n=0}^{\infty}\Bigl{[}\sum_{k=0}^{n}p_{nk}x^{k}\alpha^{n-k}\Bigr{]}\Pi^{(n)}_{m}(\alpha),$ (68) for example, the mixed term $z\Pi^{s}_{2}(x)c_{1}$ can be then exactly split/decomposed as follows: $c_{1}z\Pi^{s}_{2}(x)=c_{1}z\sum_{n=0}^{\infty}\Bigl{[}\sum_{k=0}^{n}p_{nk}x^{k}\alpha^{n-k}\Bigr{]}\Pi^{(n)}_{2}(\alpha)=zP_{1}(\alpha)+P_{0}(\alpha)+O_{2}(x).$ (69) Here and below the dependence on all other possible parameters is not shown, for simplicity. The dimensionless function $O_{2}(x)$ is of the order $x$ at small $x$; otherwise it remains arbitrary. The first term now is to be shifted to the third type of terms, while the remaining terms are to be shifted to the first type of terms. All other mixed terms of similar structure should be treated absolutely in the same way. The mixed term $z^{2}\Pi^{s}_{0}(x)c_{1}c_{2}$ can be split as $c_{1}c_{2}z^{2}\Pi^{s}_{0}(x)=c_{1}c_{2}z^{2}\sum_{n=0}^{\infty}\Bigl{[}\sum_{k=0}^{n}p_{nk}x^{k}\alpha^{n-k}\Bigr{]}\Pi^{(n)}_{0}(\alpha)=z^{2}P_{2}(\alpha)+zN_{1}(\alpha)+N_{0}(\alpha)+O_{0}(x),$ (70) where the dimensionless function $O_{0}(x)$ is of the order $x$ at small $x$; otherwise it remains arbitrary. Again the first two terms should be shifted to the third type of terms, while the last two terms should be shifted to the first type of terms. Similarly to the formal Taylor expansion (A14), we can write $\Pi^{s}_{m}(x)\Pi^{s}_{m^{\prime}}(x)=\Pi^{s}_{mm^{\prime}}(x)=\sum_{n=0}^{\infty}(x-\alpha)^{n}\Pi^{(n)}_{mm^{\prime}}(\alpha)=\sum_{n=0}^{\infty}\Bigl{[}\sum_{k=0}^{n}p_{nk}x^{k}\alpha^{n-k}\Bigr{]}\Pi^{(n)}_{mm^{\prime}}(\alpha).$ (71) Then, for example the mixed term $z\Pi^{s}_{0}(x)\Pi^{s}_{1}(qx)c_{2}$ can be split as $c_{2}z\Pi^{s}_{0}(x)\Pi^{s}_{1}(x)=c_{2}z\Bigr{)}\Pi_{01}(x)=c_{2}z\sum_{n=0}^{\infty}\Bigl{[}\sum_{k=0}^{n}p_{nk}x^{k}\alpha^{n-k}\Bigr{]}\Pi^{(n)}_{01}(\alpha)=zM_{1}(\alpha)+M_{0}(\alpha)+O_{01}(x),$ (72) where the dimensionless function $O_{01}(x)$ is of the order $x$ at small $x$; otherwise it remains arbitrary. Again the first term should be shifted to the third type of terms, while other two terms are to be shifted to the first type of terms. Completing this exact splitting/shifting procedure in the expansion (A13), and restoring the explicit dependence on the dimensional variable and parameters (A12), one can equivalently present the initial expansion (A11) as follows: $d(q^{2})=\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}B_{1}(\lambda,\alpha,\xi,g^{2},a)+\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{2}B_{2}(\lambda,\alpha,\xi,g^{2},a)+\Bigl{(}{\Delta^{2}\over q^{2}}\Bigr{)}^{3}B_{3}(\lambda,\alpha,\xi,g^{2},a)+...+d_{3}(q^{2};\Delta^{2})+...\ ,$ (73) since the coefficients of the above-used expansions depend, in general, on the same set of parameters: $\lambda,\alpha,\xi,g^{2},a$, etc. The invariant function $d_{3}(q^{2};\Delta^{2})$ is dimensionless, and it is free of the power-type IR singularities; otherwise it remains arbitrary. In the formal PT $\Delta^{2}=0$ limit it survives, and is to be reduced to the sum of the first type of terms in the expansion (A11). In other words, it is a sum of $d^{MPT}(q^{2})$ and $d^{PT}(q^{2})$ up to third order, which have been defined in section IV. The generalization to the next iterations is almost obvious, and one finally obtains expansions (4.9)-(4.13) for the full gluon propagator. Concluding, let us underline that the splitting/shifting procedure does not change the structure of the NL iteration solution at small $q^{2}$. It only changes the coefficients at inverse powers of $q^{2}$ in the corresponding expansion. In other words, it makes it possible to rearrange the terms in the initial expansion (A11) in order to get it in the final form (A19). Also, in the $q^{2}\rightarrow 0$ limit, it is legitimate to suppress the subtracted gluon self-energy in comparison with the mass gap term in the initial Eq. (A1). Nevertheless, as a result of the splitting/shifting procedure, which becomes almost trivial in this case, one will obtain the same expansion (A19) with only different residues, as just mentioned above. It is worth emphasizing that residues remain completely arbitrary (undetermined) in any case. ## References * (1) W. Marciano, H. Pagels, Phys. Rep. C 36 (1978) 137. * (2) M.E. Peskin, D.V. Schroeder, An Introduction to Quantum Field Theory (AW, Advanced Book Program, 1995). * (3) A. Jaffe, E. Witten, Yang-Mills Existence and Mass Gap, $http://www.claymath.org/prize-problems/,\ http://www.arthurjaffe.com$ . * (4) V. Gogokhia, Int. J. Theor. Phys. (2009) DOI: 10.1007/s10773-009-0101-3; arXiv:0806.0247 [hep-th, hep-ph]. * (5) J.M. Cornwall, Phys. Rev. D 26 (1982) 1453. * (6) V.A. Rubakov, Classical Gauge Fields (Editorial YRSS, Moscaw, 1999). * (7) Quark Matter 2005, Edited by T. Csorgo, G. David, P. Levai, G. Papp (ELSEVIER, Amsterdam-…-St. Louis, 2005). * (8) M. Gyulassy, L. McLerran, arXiv:nucl-th/0405013. * (9) M. Baker, Ch. Lee, Phys. Rev. D 15 (1977) 2201. * (10) C. Itzykson, J.-B. Zuber, Quantum Field Theory (Mc Graw-Hill Book Company, 1984). * (11) T. Muta, Foundations of QCD (Word Scientific, 1987). * (12) I.M. Gel’fand, G.E. Shilov, Generalized Functions, Vol. I (Academic Press, New York, 1968). * (13) G. ’t Hooft, M. Veltman, Nucl. Phys. B 44 (1972) 189. * (14) V. Gogohia, Phys. Lett. B 584 (2004) 225. * (15) V. Gogohia, Phys. Lett. B 618 (2005) 103. * (16) V.G. Bornyakov, V.K. Mitrjushkin, M. Müller-Preussker, arXiv:0812.2761 [hep-lat]. * (17) I.L. Bogolubsky, E.-M. Igenfritz, M. Müller-Preussker, A. Sternbeck, arXiv:0901.0736 [hep-lat]. * (18) A. Cucchieri, T. Mendes, arXiv:0904.4033 [hep-lat]. * (19) A. Cucchieri, T. Mendes, Phys. Rev. Lett., 100 (2008) 241601, arXiv:0712.3517 [hep-lat]. * (20) A.C. Aguilar, D. Binosi, J. Papavassiliou, Phys. Rev. D 78 (2008) 025010, arXiv:0802.1870 [hep-ph]. * (21) R. Alkofer, L. von Smekal, Phys. Rep. 353 (2001) 281. * (22) C.S. Fischer, A. Maas, J.H. Pawlowski, arXiv:0810.1987 [hep-ph]. * (23) S.P. Sorella, arXiv:0905.1010 [hep-th]. * (24) D. Dudal, J.A. Gracey, S.P. Sorella, N. Vandersickel, H. Verschelde, Phys. Rev. D 78 (2008) 065047, arXiv:0806.4348 [hep-th]. * (25) D. Zwanziger, arXiv:0904.2380 [hep-th]. * (26) K.-I. Kondo, arXiv:0907.3249 [hep-th].
arxiv-papers
2009-04-15T09:21:43
2024-09-04T02:49:01.888627
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "V. Gogokhia", "submitter": "V. Gogokhia", "url": "https://arxiv.org/abs/0904.2266" }
0904.2422
# Higher derivatives estimate for the 3D Navier-Stokes equation Alexis Vasseur Department of Mathematics, University of Texas Abstract: In this article, a non linear family of spaces, based on the energy dissipation, is introduced. This family bridges an energy space (containing weak solutions to Navier-Stokes equation) to a critical space (invariant through the canonical scaling of the Navier-Stokes equation). This family is used to get uniform estimates on higher derivatives to solutions to the 3D Navier-Stokes equations. Those estimates are uniform, up to the possible blowing-up time. The proof uses blow-up techniques. Estimates can be obtained by this means thanks to the galilean invariance of the transport part of the equation. Keywords: Navier-Stokes equation, fluid mechanics, blow-up techniques. Mathematics Subject Classification: 76D05, 35Q30. ## 1 Introduction In this paper, we investigate estimates of higher derivatives of solutions to the incompressible Navier-Stokes equations in dimension 3, namely: $\begin{array}[]{l}\displaystyle{\partial_{t}u+\mathrm{div}(u\otimes u)+\nabla P-\Delta u=0\qquad t\in(0,\infty),\ x\in\mathbb{R}^{3},}\\\\[8.53581pt] \displaystyle{\mathrm{div}u=0.}\end{array}$ (1) The initial value problem is endowed with the conditions: $\displaystyle u(0,\cdot)=u^{0}\in L^{2}(\mathbb{R}^{3}).$ The existence of weak solutions for this problem was proved long ago by Leray [7] and Hopf [5]. For this, Leray introduces a notion of weak solution. He shows that for any initial value with finite energy $u^{0}\in L^{2}(\mathbb{R}^{3})$ there exists a function $u\in L^{\infty}(0,\infty;L^{2}(\mathbb{R}^{3}))\cap L^{2}(0,\infty;\dot{H}^{1}(\mathbb{R}^{3}))$ verifying (1) in the sense of distribution. From that time on, much effort has been made to establish results on the uniqueness and regularity of weak solutions. However those two questions remain yet mostly open. Especially it is not known until now if such a weak solution can develop singularities in finite time, even considering smooth initial data. We present our main result on a laps of time $(0,T)$ where the solution is indeed smooth (with possible blow-ups both at $t=0$ and $t=T$). We will carefully show, however, that the estimates do not depend on the blow-up time $T$, but only on $\|u^{0}\|_{L^{2}}$ and $\inf(t,1)$. The aim of this paper is to show the following theorem. ###### Theorem 1 For any $t_{0}>0$, any $\Omega$ bounded subset of $(t_{0},\infty)\times\mathbb{R}^{3}$, any integer $n\geq 1$, any $\gamma>0$, and any $p\geq 0$ such that $\frac{4}{p}>n+1,$ (2) there exists a constant $C$, such that the following property holds. For any smooth solution $u$ of (1) on $(0,T)$ (with possible blow-up at 0 and $T$), we have $\|\nabla^{n}u\|_{L^{p}(\Omega\cap[(0,T)\times\mathbb{R}^{3}])}\leq C\left(\|u^{0}\|^{2(1+\gamma)/p}_{L^{2}(\mathbb{R}^{3})}+1\right).$ Note that the constant $C$ does not depend on the solution $u$ nor on the blowing-up time $T$. Note that for $n\geq 3$ we consider $L^{p}$ spaces with $p<1$. Those spaces are not complete. For this reason the result cannot be easily extend to general weak solutions after the possible blow-up time. However, up to $d=2$, the result can be proven in this context. For this reason, along the proof, we will always consider suitable weak solutions, following [2]. That is, solutions verifying in addition to (1) the generalized energy inequality in the sense of distribution: $\partial_{t}\frac{|u|^{2}}{2}+\mathrm{div}\left(u\frac{|u|^{2}}{2}\right)+\mathrm{div}(uP)+|\nabla u|^{2}-\Delta\frac{|u|^{2}}{2}\leq 0\qquad t\in(0,\infty),\ x\in\mathbb{R}^{3}.$ (3) Moreover, by interpolation, the result of Theorem 1 can be extended to the whole real derivative coefficients, $1<d\leq 2$, for $\|\Delta^{d/2}u\|_{L^{p}}$ with $\frac{4}{p}>d+1.$ Our result can be seen as a kind of anti-Sobolev result. Indeed, as we will see later, $\|\nabla u\|^{2}_{L^{2}}$ is used as a pivot quantity to control higher derivatives on the solution. The result for $d=2$ was obtained in a slightly better space, with completely different techniques by Lions [9]. He shows that $\nabla^{2}u$ can be bounded in the Lorentz space $L^{4/3,\infty}$. In a standard way, using the energy inequality and interpolation, we get estimates on $\Delta^{d/2}u\in L^{p}((0,\infty)\times\mathbb{R}^{3})$ for $\frac{5}{p}=d+\frac{3}{2},\qquad 0\leq d\leq 1.$ (4) The Serrin-Prodi conditions (see [14],[4], [16]) ensure the regularity for solutions such that $\Delta^{d/2}u\in L^{p}((0,\infty)\times\mathbb{R}^{3})$ for $\frac{5}{p}=d+1,\qquad 0\leq d<\infty.$ (5) Those two families of spaces are given by an affine relation on $d$ with respect to $1/p$ with slope $5$. Notice that the family of spaces present in Theorem 1 has a different slope. Imagine, that we were able to extend this result along the same line with $d<1$. For $d=0$, we would obtain almost $u\in L^{4}((0,\infty)\times\mathbb{R}^{3})$, which would imply that the energy inequality (3) is an equality (see [17]). Notice also that the line of this new family of spaces crosses the line of the critical spaces (5) at $d=-1$, $1/p=0$. This point corresponds (at least formally) to the Tataru and Koch result on regularity of solutions small in $L^{\infty}(0,\infty;BMO^{-1}(\mathbb{R}^{3}))$ (see [6]). However, at this time, due to the “anti-Sobolev” feature of the proof, obtaining results for $d<1$ seems out of reach. To see where lie the difficulties, let us focus on the result on the third derivatives. Consider the gradient of the Navier-Stokes equations (1). $\partial_{t}\nabla u-\Delta\nabla u=-\nabla u\cdot\nabla u-\nabla^{2}P-(u\cdot\nabla)\nabla u.$ Note that the two first right-hand side terms lie in $L^{1}((0,\infty)\times\mathbb{R}^{3})$ (for the pressure term, see [9]). Parabolic regularity are not complete in $L^{1}$. This justify the fact that we miss the limit case $L^{1}$. But, surprisingly, the worst term is the transport one $(u\cdot\nabla)\nabla u$. To control it in $L^{1}$ using the control on $D^{2}u$ in $L^{4/3,\infty}$ of Lions [9], we would need $u\in L^{4,1}$, which is not known. To overcome this difficulty, we will consider the solution in another frame, locally, by following the flow. The idea of the proof comes from the result of partial regularity obtained by Caffarelli, Kohn and Nirenberg [2]. This paper extended the analysis about the possible singular points set, initialized by Scheffer in a series of paper [10, 11, 12, 13]. The main remark in [2] is that the dissipation of entropy $\mathcal{D}(u)=\int_{0}^{\infty}\int_{\mathbb{R}^{3}}|\nabla u|^{2}\,dx\,dt$ (6) has a scaling, through the standard invariance of the equation, which is far more powerful that any other quantities from the energy scale (4). Let us be more specific. The standard invariance of the equation gives that for any $(t_{0},x_{0})\in\mathbb{R}^{+}\times\mathbb{R}^{3}$ and $\varepsilon>0$, if $u$ is a suitable solution of the Navier-Stokes equations (1) (3), then $u_{\varepsilon}(t,x)=\varepsilon u(t_{0}+\varepsilon^{2}t,x_{0}+\varepsilon x)$ (7) is also solution to (1) (3). The dissipation of energy of this quantity is then given by $\mathcal{D}(u_{\varepsilon})=\varepsilon^{-1}\mathcal{D}(u).$ This power of $\varepsilon$ made possible in [2] to show that the Hausdorff dimension of the set of blow-up points is at most 1. This was a great improvement of the result obtained by Scheffer who gives 5/3 as an upper bound for the Hausdorff dimension of this set. We can notice that it is what we get considering the quantity of the energy scale (4) with $d=0,p=10/3$: $\mathcal{F}(u)=\int_{0}^{\infty}\int_{\mathbb{R}^{3}}|u|^{10/3}\,dx\,dt.$ Indeed: $\mathcal{F}(u_{\varepsilon})=\varepsilon^{-5/3}\mathcal{F}(u).$ The idea of this paper is to give a quantitative version of the result of [2], in the sense, of getting control of norms of the solution which have the same nonlinear scaling that $\mathcal{D}$. Indeed, for any norm of the non linear scaling (2), we have (in the limit case) $\|\nabla^{n}u_{\varepsilon}\|^{p}_{L^{p}}=\varepsilon^{-1}\|\nabla^{n}u\|^{p}_{L^{p}}.$ The paper is organized as follows. In the next section, we give some preliminaries and fix some notations. We introduce the local frame following the flow in the third section. The fourth section is dedicated to a local result providing a universal control of the higher derivatives of $u$ from a local control of the dissipation of the energy $\|\nabla u\|^{2}_{L^{2}}$ and a corresponding quantity on the pressure (see Proposition 10). Ideally, we would like to consider a quantity on the pressure which has the same nonlinear scaling as $\mathcal{D}(u)$. The corresponding quantity is $\|\nabla^{2}P\|_{L^{1}}$. Unfortunately, we need a slightly better integrability in time for the local study. This is the reason why we miss the limit case $L^{p,\infty}$ with $\frac{4}{p}=n+1.$ This is also the reason why we need to work with fractional Laplacian for the pressure: $\|\Delta^{-s}\nabla^{2}P\|_{L^{p}}$ with $0<s<1/2$. In the last section, we show how this local study leads to our main theorem. ## 2 Preliminaries and notations Let us denote $Q_{r}=(-r^{2},0)\times B_{r}$ where $B_{r}=B(0,r)$, the ball in $\mathbb{R}^{3}$ of radius $r$ and centered at 0. For $F\in L^{p}(\mathbb{R}^{+}\times\mathbb{R}^{3})$, we define the Maximal function in $x$ only by $MF(t,x)=\sup_{r>0}\frac{1}{r^{3}}\int_{B_{r}}|F(t,x+y)|\,dy.$ We recall that for any $1<p<\infty$, there exists $C_{p}$ such that for any $F\in L^{p}(\mathbb{R}^{+}\times\mathbb{R}^{3})$ $\|MF\|_{L^{p}(\mathbb{R}^{+}\times\mathbb{R}^{3})}\leq C_{p}\|F\|_{L^{p}(\mathbb{R}^{+}\times\mathbb{R}^{3})}.$ Moreover, there exists a constant $C$ such that for any $F\in L^{1}(\mathbb{R}^{+};\mathcal{H}(\mathbb{R}^{3}))$, (where $\mathcal{H}$ stands for the Hardy space), then $\|MF\|_{L^{1}(\mathbb{R}^{+}\times\mathbb{R}^{3})}\leq C\|F\|_{L^{1}(\mathbb{R}^{+};\mathcal{H}(\mathbb{R}^{3}))}.$ We begin with an interpolation lemma. It is a straightforward consequence of a result in [1]. We state it here for further reference. ###### Lemma 2 For any function F such that $(-\Delta)^{d_{1}/2}F$ lies in $L^{p_{1}}(0,\infty;L^{q_{1}}(\mathbb{R}^{3}))$ and $(-\Delta)^{d_{2}/2}F\in L^{p_{2}}(0,\infty;L^{q_{2}}(\mathbb{R}^{3}))$ with $d_{1},d_{2}\in\mathbb{R},\qquad 1\leq p_{1},p_{2}\leq\infty,\qquad 1<q_{1},q_{2}<\infty,$ we have $(-\Delta)^{d/2}F\in L^{p}(0,\infty;L^{q}(\mathbb{R}^{3}))$ with $\displaystyle\|(-\Delta)^{d/2}F\|_{L^{p}(0,\infty;L^{q}(\mathbb{R}^{3}))}$ $\displaystyle\qquad\leq\|(-\Delta)^{d_{1}/2}F\|^{\theta}_{L^{p_{1}}(0,\infty;L^{q_{1}}(\mathbb{R}^{3}))}\|(-\Delta)^{d_{2}/2}F\|^{1-\theta}_{L^{p_{2}}(0,\infty;L^{q_{2}}(\mathbb{R}^{3}))},$ for any $d,p,q$ such that $\displaystyle\frac{1}{q}=\frac{\theta}{q_{1}}+\frac{1-\theta}{q_{2}},$ $\displaystyle\frac{1}{p}=\frac{\theta}{p_{1}}+\frac{1-\theta}{p_{2}},$ $\displaystyle d=\theta d_{1}+(1-\theta)d_{2},$ where $0<\theta<1$. Proof. Exercise 31 page 168 in [1] shows that for any $0<t<\infty$, we have $\|(-\Delta)^{d/2}F(t)\|_{L^{p}(\mathbb{R}^{3})}\leq\|(-\Delta)^{d_{1}/2}F(t)\|^{\theta}_{L^{p_{1}}(\mathbb{R}^{3})}\|(-\Delta)^{d_{2}/2}F(t)\|^{1-\theta}_{L^{p_{2}}(\mathbb{R}^{3})}.$ Interpolation in the time variable gives the result. In the second lemma we show that we can control a local $L^{1}$ norm on a function $f$ by its mean value and some local control on the maximal function of $(-\Delta)^{-s}\nabla f$, $0<s<1/2$. This extends the fact that we can control the local $L^{1}$ norm by the mean value and a local $L^{p}$ norm of the gradient. But due to the nonlocal feature of the fractional Laplacian, we need to consider the maximal function to recapture all the information needed. ###### Lemma 3 Let $0<s<1/2$, $q\geq 1$, $p\geq 1$. For any $\phi\in C^{\infty}(\mathbb{R}^{3})$, $\phi\geq 0$, compactly supported in $B_{1}$ with $\int_{\mathbb{R}^{3}}\phi(x)\,dx=1$, there exists $C>0$ such that, for any function $f\in L^{q}(\mathbb{R}^{3})$ with $(-\Delta)^{-s}\nabla f\in L^{p}(\mathbb{R}^{3})$ and $|\int f\phi\,dx|$ bounded, we have $f\in L^{1}(B_{1})$ and $\|f\|_{L^{1}(B_{1})}\leq C\left(\left|\int_{\mathbb{R}^{3}}f(x)\phi(x)\,dx\right|+\|M((-\Delta)^{-s}\nabla f)\|_{L^{p}(B_{1})}\right).$ Proof. Let us denote $g=(-\Delta)^{-s}\nabla f$. Since $f\in L^{q}(\mathbb{R}^{3})$, we have $f=-(-\Delta)^{s-1}\mathrm{div}g.$ So, for any $x\in B_{1}$ $f(x)=C_{s}\int_{\mathbb{R}^{3}}\frac{g(y)}{|x-y|^{2(1+s)}}\cdot\frac{(x-y)}{|x-y|}\,dy,$ and $\displaystyle f(x)-\int_{\mathbb{R}^{3}}\phi(z)\,f(z)\,dz$ $\displaystyle\qquad=C_{s}\int_{\mathbb{R}^{3}}\int_{\mathbb{R}^{3}}\phi(z)g(y)\left(\frac{(x-y)/|x-y|}{|x-y|^{2(1+s)}}-\frac{(z-y)/|z-y|}{|y-z|^{2(1+s)}}\right)\,dy\,dz.$ Note that, for $k\geq 2$, $y\in B_{2^{k}}\setminus B_{2^{k-1}}$, $x\in B_{1}$, $z\in B_{1}$, we have $\left|\frac{(x-y)/|x-y|}{|x-y|^{2(1+s)}}-\frac{(z-y)/|z-y|}{|y-z|^{2(1+s)}}\right|\leq\frac{C}{2^{k(3+2s)}}.$ Moreover $\displaystyle\int_{B_{1}}\int_{B_{1}}\int_{B_{2}}\phi(z)|g(y)|\left|\frac{(x-y)/|x-y|}{|x-y|^{2(1+s)}}-\frac{(z-y)/|z-y|}{|y-z|^{2(1+s)}}\right|\,dy\,dz\,dx$ $\displaystyle\qquad\leq\int_{B_{3}}\int_{B_{1}}\int_{B_{2}}\frac{\phi(z)|g(y)|}{|x|^{2(1+s)}}\,dy\,dz\,dx+\int_{B_{1}}\int_{B_{3}}\int_{B_{2}}\frac{\sup|\phi||g(y)|}{|z|^{2(1+s)}}\,dy\,dz\,dx$ $\displaystyle\qquad\leq 2C_{s}\|g\|_{L^{1}(B_{1})}\leq 2C_{s}\|Mg\|_{L^{1}(B_{1})},$ since $2(1+s)<3$. Hence $\displaystyle\qquad\qquad\left\|f-\int\phi(z)f(z)\,dz\right\|_{L^{1}(B_{1})}$ $\displaystyle\leq\int_{B_{1}}\int_{B_{1}}\int_{B_{2}}\phi(z)|g(y)|\left|\frac{(x-y)/|x-y|}{|x-y|^{2(1+s)}}-\frac{(z-y)/|z-y|}{|y-z|^{2(1+s)}}\right|\,dy\,dz\,dx$ $\displaystyle\qquad+\sum_{k=2}^{\infty}\int_{B_{1}}\int_{B_{1}}\int_{(B_{2^{k}}\setminus B_{2^{k-1}})}\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\phi(z)|g(y)|\left|\frac{(x-y)/|x-y|}{|x-y|^{2(1+s)}}-\frac{(z-y)/|z-y|}{|y-z|^{2(1+s)}}\right|$ $\displaystyle\leq 2C_{s}\|Mg\|_{L^{1}(B_{1})}+C\sum_{k=2}^{\infty}\int_{B_{2^{k}}}\frac{|g(y)|}{2^{k(3+2s)}}\,dy$ $\displaystyle\leq 2C_{s}\|Mg\|_{L^{1}(B_{1})}+8C\sum_{k=2}^{\infty}2^{-2sk}\frac{1}{|B_{2^{k+1}}|}\int_{B_{1}}\int_{B_{2^{k+1}}}|g(y+u)|\,dy\,du$ $\displaystyle\leq 2C_{s}\|Mg\|_{L^{1}(B_{1})}+C\|Mg\|_{L^{1}(B_{1})}\sum_{k=2}^{\infty}[2^{-2s}]^{k}$ $\displaystyle\leq C_{s}\|Mg\|_{L^{1}(B_{1})},$ whenever $0<s<1/2$. We give now very standard results of parabolic regularity. There are not even optimal, but enough for our study. ###### Lemma 4 For any $1<p<\infty$, $t_{0}>0$, there exists a constant $C$ such that the following is true. Let $f,g\in L^{p}((-t_{0},0)\times\mathbb{R}^{3})$ be compactly supported in $B_{1}$. Then there exists a unique $u\in L^{p}(-t_{0},0;W^{1,p}(\mathbb{R}^{3}))$ solution to $\displaystyle\partial_{t}u-\Delta u=g+\mathrm{div}f,\qquad-t_{0}\leq t\leq 0,\ \ x\in\mathbb{R}^{3},$ $\displaystyle u(-t_{0},x)=0,\qquad x\in\mathbb{R}^{3}.$ Moreover, $\|u\|_{L^{p}(-t_{0},0;W^{1,p}(B_{1}))}\leq C(\|f\|_{L^{p}((-t_{0},0)\times\mathbb{R}^{3})}+\|g\|_{L^{p}((-t_{0},0)\times\mathbb{R}^{3})}).$ (8) If $g\in L^{1}(-t_{0},0;L^{\infty}(\mathbb{R}^{3}))$ and $f\in L^{1}(-t_{0},0;W^{1,\infty}(\mathbb{R}^{3}))$, then $\|u\|_{L^{\infty}(-t_{0},0)\times\mathbb{R}^{3})}\leq C(\|g\|_{L^{1}(-t_{0},0;L^{\infty}(\mathbb{R}^{3}))}+\|f\|_{L^{1}(-t_{0},0;W^{1,\infty}(\mathbb{R}^{3}))}).$ Proof. We get the solution using the Green function: $u(t,x)=\int_{-t_{0}}^{t}\frac{1}{4\pi(t-s)^{3/2}}\int_{\mathbb{R}^{3}}e^{-\frac{|x-y|^{2}}{4(t-s)}}(g(s,y)+\mathrm{div}f(s,y))\,dy\,ds.$ From this formulation, using that $z^{n}e^{-z^{2}}$ are bounded functions, we find that $|u(t,x)|\leq C\frac{\|f\|_{L^{1}((-t_{0},0)\times B_{1})}+\|g\|_{L^{1}((-t_{0},0)\times B_{1})}}{|x|^{3}},\qquad\mathrm{for}\ |x|>2,-t_{0}\leq t<0.$ (9) Standard Solonnikov’s parabolic regularization result gives (8) (see for instance [15]). Finally, if $g\in L^{1}(-t_{0},0;L^{\infty}(\mathbb{R}^{3}))$ and $f\in L^{1}(-t_{0},0;W^{1,\infty}(\mathbb{R}^{3}))$, then the function $v(t,x)=\int_{0}^{t}(\|g(s)\|_{L^{\infty}}+\|\mathrm{div}f(s)\|_{L^{\infty}})\,ds$ is a supersolution thanks to (9). The global bound follows. The last lemma of this section is a standard decomposition of the pressure term as a close range part and a long range part. ###### Lemma 5 Let $\overline{B}$ and $\underline{B}$ be two balls such that $\overline{B}\subset\subset\underline{B}.$ Then for any $1<p<\infty$, there exists a constant $C>0$ and a family of constants $\\{C_{d,q}\ \setminus\ d,q\ \ \mathrm{integers}\\}$ (depending only on $p$, $\underline{B}$ and $\overline{B}$) such that for any $R\in L^{1}(\underline{B})$ and $A\in[L^{p}(\underline{B})]^{N\times N}$ symmetric matrix, verifying $-\Delta R=\mathrm{div}\mathrm{div}A,\qquad\mathrm{in}\ \ \underline{B},$ we have a decomposition $R=R_{1}+R_{2},$ with, for any integer $q\geq 0$, $d\geq 0$: $\displaystyle\|R_{1}\|_{L^{p}(\overline{B})}\leq C\|A\|_{L^{p}(\underline{B})},$ $\displaystyle\|\nabla^{d}R_{2}\|_{L^{\infty}(\overline{B})}\leq C_{d,q}\left(\|A\|_{L^{1}(\underline{B})}+\|R\|_{W^{-q,1}(\underline{B})}\right).$ Moreover, if $A$ is Lipschitzian, then we can choose $R_{1}$ such that $\|R_{1}\|_{L^{\infty}(\overline{B})}\leq C\left(\|\nabla A\|_{L^{\infty}(\underline{B})}+\|A\|_{L^{\infty}(\underline{B})}\right).$ Proof. Let $B^{*}$ be a a ball such that $\overline{B}\subset\subset B^{*}\subset\subset\underline{B},$ with a distance between $\overline{B}$ and ${B^{*}}^{c}$ bigger that $D/2$, where $D$ is the distance between $\overline{B}$ and $\underline{B}^{c}$. Consider a smooth nonnegative cut-off function $\psi$, $0\leq\psi\leq 1$ such that $\displaystyle\psi(x)$ $\displaystyle=$ $\displaystyle 1\qquad\mathrm{in}\ B^{*},$ $\displaystyle=$ $\displaystyle 0\qquad\mathrm{in}\ \underline{B}^{c}.$ Then the function $\psi R$ (defined in $\mathbb{R}^{3}$) is solution in $\mathbb{R}^{3}$ to $\displaystyle-\Delta(\psi R)$ $\displaystyle=$ $\displaystyle\mathrm{div}\mathrm{div}(\psi A)$ $\displaystyle+R\Delta\psi+A:\nabla^{2}\psi$ $\displaystyle-2\mathrm{div}\\{\nabla\psi\cdot A+R\nabla\psi\\}.$ We denote $\displaystyle R_{1}=(-\Delta)^{-1}\mathrm{div}\mathrm{div}(\psi A),$ $\displaystyle R_{2}=(-\Delta)^{-1}\left(R\Delta\psi+A:\nabla^{2}\psi-2\mathrm{div}\\{\nabla\psi\cdot A+R\nabla\psi\\}\right).$ We have, on $\overline{B}$, $R=R_{1}+R_{2}$. The operator $(-\Delta)^{-1}\mathrm{div}\mathrm{div}$ is a Riesz operator, so there exists a constant (depending only on $p$ and $\psi$) such that $\displaystyle\|R_{1}\|_{L^{p}(\mathbb{R}^{3})}\leq C\|\psi A\|_{L^{p}(\mathbb{R}^{3})}\leq C\|A\|_{L^{p}(\underline{B})},$ $\displaystyle\|R_{1}\|_{C^{\alpha}(\mathbb{R}^{3})}\leq C\|\psi A\|_{C^{\alpha}(\mathbb{R}^{3})}\leq C\left(\|\nabla A\|_{L^{\infty}(\underline{B})}+\|A\|_{L^{\infty}(\underline{B})}\right).$ Using the fact that $\nabla\psi$ and $\nabla^{2}\psi$ vanishes on $B^{*}\cup\underline{B}^{c}$, we have for any $x\in\overline{B}$: $\displaystyle|\nabla^{d}R_{2}(x)|=\left|\int_{\mathbb{R}^{3}}\nabla^{d}\left(\frac{1}{|x-y|}\right)\left(R\Delta\psi+A:\nabla^{2}\psi\right)(y)\,dy\right.$ $\displaystyle\qquad\qquad\qquad\left.+2\int_{\mathbb{R}^{3}}\nabla^{d+1}\left(\frac{1}{|x-y|}\right)\\{\nabla\psi\cdot A+R\nabla\psi\\}(y)\,dy\right|$ $\displaystyle\qquad\leq\|\nabla^{2}\psi\|_{L^{\infty}}\|A\|_{L^{1}(\underline{B})}\sup_{|x-y|\geq D/2}\left|\nabla^{d}\left(\frac{1}{|x-y|}\right)\right|$ $\displaystyle\qquad\qquad+2\|\nabla\psi\|_{L^{\infty}}\|A\|_{L^{1}(\underline{B})}\sup_{|x-y|\geq D/2}\left|\nabla^{d+1}\left(\frac{1}{|x-y|}\right)\right|$ $\displaystyle\qquad\qquad+\|R\|_{W^{-q,1}(\underline{B})}\sup_{|x-y|\geq D/2}\left|\nabla^{q}\left[\nabla^{d}\left(\frac{1}{|x-y|}\right)\Delta\psi\right]\right|$ $\displaystyle\qquad\qquad+2\|R\|_{W^{-q,1}(\underline{B})}\sup_{|x-y|\geq D/2}\left|\nabla^{q}\left[\nabla^{d+1}\left(\frac{1}{|x-y|}\right)\nabla\psi\right]\right|$ $\displaystyle\qquad\leq C_{d}\left[\left(\frac{2}{D}\right)^{d+2}+\left(\frac{2}{D}\right)^{d+1}\right]\|A\|_{L^{1}(\underline{B})}$ $\displaystyle\qquad\qquad+C_{d,q}\left[\left(\frac{2}{D}\right)^{d+1}+\left(\frac{2}{D}\right)^{q+d+2}\right]\|R\|_{W^{-q,1}(\underline{B})}.$ ## 3 Blow-up method along the trajectories Our result relies on a local study, which was the keystone of the partial regularity result of [2]. (see [8] for an other proof). We use, here, the version of [18]. This version is better for our purpose because it requires a bound on the pressure only in $L^{p}$ in time for any $p>1$. ###### Proposition 6 [18] For any $p>1$, there exists $\eta>0$, such that the following property holds. For any $u$, suitable weak solution to the Navier-Stokes equation (1), (3), in $Q_{1}$, such that $\displaystyle\sup_{-1<t<0}\\!\\!\left(\int_{B_{1}}\\!\\!|u(t,x)|^{2}\,dx\right)+\\!\int_{Q_{1}}\\!\\!|\nabla u|^{2}\,dx\,dt\\!+\\!\int_{-1}^{0}\\!\\!\left(\int_{B_{1}}\\!\\!|P|\,dx\right)^{p}\\!dt\leq\eta,$ (10) we have $\sup_{(t,x)\in Q_{1/2}}|u(t,x)|\leq 1.$ As explained in the introduction, the proof of Theorem 1 relies on this local control. From there we can get control on higher derivatives of $u$. We first show the following lemma. It introduces the pivot quantity. Note that the ideal pivot quantity would be $\|\nabla u\|^{2}_{L^{2}(L^{2})}+\|\nabla^{2}P\|_{L^{1}(L^{1})}$. This is because this quantity scales as $1/\varepsilon$ through the canonical scaling. However, to use Proposition 6 locally, we need a better integrability in time on the pressure. For this reason, we add the quantity on the pressure involving the fractional Laplacian. We get a better integrability in time on the pressure, at the cost of a slightly worst rate of change in $\varepsilon$ through the canonical scaling. Finally, due to the nonlocal character of the fractional Laplacian, the maximal function is used in order to recapture all the local information needed (see Lemma 3). ###### Lemma 7 For any $0<\delta<1$, there exists $\gamma>0$ and a constant $C>0$ such that for any $u$ solution to (1) (3), with $u^{0}\in L^{2}(\mathbb{R}^{3})$, we have $\displaystyle\int_{0}^{\infty}\int_{\mathbb{R}^{3}}\left(|M((-\Delta)^{-\delta/2}\nabla^{2}P)|^{1+\gamma}+|\nabla^{2}P|+|\nabla u|^{2}\right)\,dx\,dt$ $\displaystyle\qquad\qquad\leq C\left(\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}+\|u^{0}\|^{2(1+\gamma)}_{L^{2}(\mathbb{R}^{3})}\right).$ Moreover, $\gamma$ converges to 0 when $\delta$ converges to 0. Proof. Integrating in $x$ the energy equation (3) gives that $\int_{0}^{\infty}\int_{\mathbb{R}^{3}}|\nabla u|^{2}\,dx\,dt\leq\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})},$ (11) together with $\|u\|^{2}_{L^{\infty}(0,\infty;L^{2}(\mathbb{R}^{3}))}\leq\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}.$ By Sobolev imbedding and interpolation, this gives in particular that $\|u\|^{2}_{L^{4}(0,\infty;L^{3}(\mathbb{R}^{3}))}\leq C\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}.$ (12) For the pressure, we have $\nabla^{2}P\in L^{1}(\mathcal{H})$ (see Lions [9]). Indeed, $\displaystyle\nabla^{2}P=(\nabla^{2}\Delta^{-1})\sum_{ij}\partial_{i}u_{j}\partial_{j}u_{i}$ $\displaystyle\qquad=(\nabla^{2}\Delta^{-1})\sum_{i}(\partial_{i}u)\cdot\nabla u_{i}.$ For any $i$, we have $\mathrm{rot}(\nabla u_{i})=0$ and $\mathrm{div}\ \partial_{i}u=0$. Hence, from the div-rot lemma (see Coifman, Lions, Meyer and Semmes [3]), we have $\|\sum_{i}\partial_{i}u\cdot\nabla u_{i}\|_{L^{1}(\mathcal{H})}\leq\|\nabla u\|^{2}_{L^{2}}.$ But $\nabla^{2}\Delta^{-1}$ is a Riesz operator (in $x$ only) which is bounded from $\mathcal{H}$ to $\mathcal{H}$. Hence: $\|\nabla^{2}P\|_{L^{1}(\mathbb{R}^{+}\times\mathbb{R}^{3})}\leq C\|\nabla^{2}P\|_{L^{1}(\mathbb{R}^{+};\mathcal{H}(\mathbb{R}^{3}))}\leq C\|\nabla u\|^{2}_{L^{2}(\mathbb{R}^{+}\times\mathbb{R}^{3})}.$ (13) By Sobolev imbedding, for any $0<s<1$, we have $\|(-\Delta)^{-s/2}\nabla^{2}P\|_{L^{1}(0,\infty;L^{p}(\mathbb{R}^{3}))}\leq C\|u^{0}\|^{2}_{L^{2}}$ (14) for $\frac{1}{p}=1-\frac{s}{3}.$ we have also $(-\Delta)^{-1/2}\nabla^{2}P=\sum_{ij}[(-\Delta)^{-3/2}\nabla^{2}\partial_{i}](\partial_{j}u_{i}u_{j}).$ The operators $(-\Delta)^{-3/2}\nabla^{2}\partial_{i}$ are Riesz operators so, together with (11) (12), we have $\|(-\Delta)^{-1/2}\nabla^{2}P\|_{L^{4/3}(0,\infty;L^{6/5}(\mathbb{R}^{3}))}\leq C\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}.$ (15) By interpolation with (14), using Lemma 2 with $\theta=1/(1+4s)$, we find $\|M[(-\Delta)^{-\delta/2}\nabla^{2}P]\|_{L^{1+\gamma}((0,\infty)\times\mathbb{R}^{3})}\leq C\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}$ with $\delta=\frac{5s}{1+4s},\qquad\qquad\gamma=\frac{s}{1+3s}.$ Note that $\gamma$ converges to 0 when $\delta$ goes to 0. This, together with (13) and (11), gives the result. Let us fix from now on a smooth cut-off function $0\leq\phi\leq 1$ compactly supported in $B_{1}$ and such that $\int_{\mathbb{R}^{3}}\phi(x)\,dx=1.$ (16) For any $\varepsilon>0$, we define $u_{\varepsilon}(t,x)=\int_{\mathbb{R}^{3}}\phi(y)u(t,x+\varepsilon y)\,dy.$ (17) Note that $u_{\varepsilon}\in L^{\infty}(0,\infty;C^{\infty}(\mathbb{R}^{3}))$ and $\mathrm{div}u_{\varepsilon}=0$. We define the flow: $\begin{array}[]{l}\displaystyle{\frac{\partial X}{\partial s}=u_{\varepsilon}(s,X(s,t,x))}\\\\[8.5359pt] \displaystyle{X(t,t,x)=x.}\end{array}$ (18) Consider, for any $0<\delta<1$ and $\eta^{*}>0$: $\Omega^{\delta}_{\varepsilon}=\left\\{(t,x)\in(4\varepsilon^{2},\infty)\times\mathbb{R}^{3}\ |\ \frac{1}{\varepsilon}\int_{t-4\varepsilon^{2}}^{t}\int_{B_{2\varepsilon}}\\!\\!\\!\\!F^{\delta}(s,X(s,t,x)+y)\,ds\,dy\leq\eta^{*}\varepsilon^{\delta}\right\\},$ where $F^{\delta}(t,x)=|M((-\Delta)^{-\delta/2}\nabla^{2}P)|^{1+\gamma}+|\nabla u|^{2}+|\nabla^{2}P|,$ and $\gamma$ is defined in Lemma 7. We then have the following lemma. ###### Lemma 8 There exists a constant $C$ such that for any $0<\varepsilon<1$, $0<\delta<1$, and $\eta^{*}>0$ we have $|[\Omega^{\delta}_{\varepsilon}]^{c}|\leq C\left(\frac{\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}+\|u^{0}\|^{2(1+\gamma)}_{L^{2}(\mathbb{R}^{3})}}{\eta^{*}}\right)\varepsilon^{4-\delta}.$ Proof. Define for $t>4\varepsilon^{2}$ $F^{\delta}_{\varepsilon}(t,x)=\frac{1}{(2\varepsilon)^{5}}\int_{t-4\varepsilon^{2}}^{t}\int_{B_{2\varepsilon}}F^{\delta}(s,X(s,t,x)+y)\,ds\,dy.$ (19) We have $\displaystyle\qquad\qquad\int_{4\varepsilon^{2}}^{\infty}\int_{\mathbb{R}^{3}}F^{\delta}_{\varepsilon}(t,x)\,dx\,dt$ $\displaystyle=\int_{4\varepsilon^{2}}^{\infty}\int_{\mathbb{R}^{3}}\frac{1}{(2\varepsilon)^{5}}\int_{-4\varepsilon^{2}}^{0}\int_{B_{2\varepsilon}}F^{\delta}(t+s,X(t+s,t,x)+y)\,ds\,dy\,dx\,dt$ $\displaystyle=\frac{1}{(2\varepsilon)^{5}}\int_{B_{2\varepsilon}}\int_{-4\varepsilon^{2}}^{0}\int_{4\varepsilon^{2}}^{\infty}\int_{\mathbb{R}^{3}}F^{\delta}(t+s,X(t+s,t,x)+y)\,dx\,dt\,ds\,dy$ $\displaystyle=\frac{1}{(2\varepsilon)^{5}}\int_{B_{2\varepsilon}}\int_{-4\varepsilon^{2}}^{0}\int_{4\varepsilon^{2}}^{\infty}\int_{\mathbb{R}^{3}}F^{\delta}(t+s,z+y)\,dz\,dt\,ds\,dy$ $\displaystyle\leq\left(\frac{1}{(2\varepsilon)^{5}}\int_{B_{2\varepsilon}}\int_{-4\varepsilon^{2}}^{0}\,ds\,dy\right)\int_{0}^{\infty}\int_{\mathbb{R}^{3}}F^{\delta}(\underline{t},\underline{z})\,d\underline{z}\,d\underline{t}$ $\displaystyle=\int_{0}^{\infty}\int_{\mathbb{R}^{3}}\left(|M((-\Delta)^{-\delta/2}\nabla^{2}P)|^{1+\gamma}+|\nabla u|^{2}+|\nabla^{2}P|\right)\,dx\,dt.$ In the second equality, we have used Fubini, in the third we have used the fact that $X$ is an incompressible flow. In the fourth equality we did the change of variable in $(t,z)$ $\underline{t}=t+s\qquad\underline{z}=y+z.$ We then find, thanks to Tchebychev inequality, $\left|\left\\{F^{\delta}_{\varepsilon}(t,x)\geq\frac{\eta^{*}\varepsilon^{\delta}}{2(2\varepsilon)^{4}}\right\\}\right|\leq 2^{5}\frac{\int_{0}^{\infty}\int_{\mathbb{R}^{3}}F^{\delta}_{\varepsilon}(t,x)\,dx\,dt}{\eta^{*}}\varepsilon^{4-\delta}.$ We conclude thanks to Lemma 7. We fix $\delta>0$. For any fixed $(t,x)\in\Omega^{\delta}_{\varepsilon}$ with $t\geq 4\varepsilon^{2}$, we define $v_{\varepsilon},P_{\varepsilon}$, (depending on this fixed point $(t,x)$) as functions of two local new variables $(s,y)\in Q_{2}$: $\displaystyle v_{\varepsilon}(s,y)=\varepsilon u(t+\varepsilon^{2}s,X(t+\varepsilon^{2}s,t,x)+\varepsilon y)$ $\displaystyle\qquad\qquad\qquad-\varepsilon u_{\varepsilon}(t+\varepsilon^{2}s,X(t+\varepsilon^{2}s,t,x)),$ (20) $\displaystyle P_{\varepsilon}(s,y)=\varepsilon^{2}P(t+\varepsilon^{2}s,X(t+\varepsilon^{2}s,t,x)+\varepsilon y)$ $\displaystyle\qquad\qquad\qquad+\varepsilon y\partial_{s}[u_{\varepsilon}(t+\varepsilon^{2}s,X(t+\varepsilon^{2}s,t,x))].$ (21) We have the following proposition. ###### Proposition 9 The function $(v_{\varepsilon},P_{\varepsilon})$ is solution to (1) (3) for $(s,y)\in(-4,0)\times\mathbb{R}^{3}$. It verifies: $\displaystyle\int_{\mathbb{R}^{3}}\phi(y)v_{\varepsilon}(s,y)\,dy=0,\qquad s\geq-4,$ (22) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|\nabla v_{\varepsilon}|^{2}\,dy\,ds\leq\eta^{*},$ (23) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|\nabla^{2}P_{\varepsilon}|\,dy\,ds\leq\eta^{*},$ (24) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|M[(-\Delta)^{-\delta/2}\nabla^{2}P_{\varepsilon}]|^{1+\gamma}\,dy\,ds\leq\eta^{*}.$ (25) Proof. The fact that $(v_{\varepsilon},P_{\varepsilon})$ is solution to (1) (3) and verifies (22) comes from its definition (20), (21), (16) and (17). We have $\begin{array}[]{l}\displaystyle{\qquad\qquad\int_{Q_{2}}(|\nabla v_{\varepsilon}|^{2}+|\nabla^{2}P_{\varepsilon}|)\,dy\,ds+\int_{Q_{2}}|M[(-\Delta)^{-\delta/2}\nabla^{2}P_{\varepsilon}]|^{1+\gamma}\,dy\,ds}\\\\[8.5359pt] \displaystyle{=\int_{Q_{2}}\left(\varepsilon^{4}(|\nabla u|^{2}+|\nabla^{2}P|)+\varepsilon^{(4-\delta)(1+\gamma)}|M[(-\Delta)^{-\delta/2}\nabla^{2}P]|^{1+\gamma}\right)}\\\\[8.5359pt] \qquad\qquad\qquad\qquad\qquad\qquad\qquad\qquad\displaystyle{(t+\varepsilon^{2}s,X(t+\varepsilon^{2}s,t,x)+\varepsilon y)\,dy\,ds}\\\\[8.5359pt] \displaystyle{\leq\frac{1}{\varepsilon^{1+\delta}}\int_{t-4\varepsilon^{2}}^{t}\int_{B_{2\varepsilon}}(|\nabla u|^{2}+|\nabla^{2}P|+M[(-\Delta)^{-\delta/2}\nabla^{2}P]^{1+\gamma})}\\\\[8.5359pt] \qquad\qquad\qquad\qquad\qquad\qquad\qquad\qquad\qquad\qquad\qquad\displaystyle{(s,X(s,t,x)+y)\,ds\,dy}\\\\[8.5359pt] \leq\eta^{*}.\end{array}$ (26) In the first equality, we used the definition of $v_{\varepsilon}$ and $P_{\varepsilon}$, in the second, we used the change of variable $(t+\varepsilon^{2}s,\varepsilon y)\to(s,y)$ (together with the fact that $\delta<4$ and $\gamma\geq 0$), and the last inequality comes from the fact that $(s,y)$ lies in $\Omega^{\delta}_{\varepsilon}$. Our aim is to apply proposition 6 to $v_{\varepsilon}$. It will be a consequence of the following section. ## 4 Local study This section is dedicated to the following Proposition. ###### Proposition 10 For any $\gamma>0$ and any $0<\delta<1$, there exists a constant $\overline{\eta}<1$, and a sequence of constants $\\{C_{n}\\}$ such that for any solution $(u,P)$ of (1) (3) in $Q_{2}$ verifying $\displaystyle\int_{\mathbb{R}^{3}}\phi(y)u(t,x)\,dx=0,\qquad t\geq-4,$ (27) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|\nabla u|^{2}\,dx\,dt\leq\overline{\eta},$ (28) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|\nabla^{2}P|\,dx\,dt\leq\overline{\eta},$ (29) $\displaystyle\int_{-4}^{0}\int_{B_{2}}|M[(-\Delta)^{-\delta/2}\nabla^{2}P]|^{1+\gamma}\,dx\,dt\leq\overline{\eta},$ (30) the velocity $u$ is infinitely differentiable in $x$ at $(0,0)$ and $|\nabla^{n}u(0,0)|\leq C_{n}.$ Proof. We want to apply Proposition 6. Then, by a bootstrapping argument we will get uniform controls on higher derivatives. For this, we first need a control of $u$ in $L^{\infty}(L^{2})$ and a control on $P$ in $L^{\gamma+1}(L^{1})$. The equation is on $\nabla P$ (not the pressure itself). Therefore, changing $P$ by $P-\int_{B_{2}}\phi P\,dx$ we can assume without loss of generality that $\int_{\mathbb{R}^{3}}\phi(x)P(t,x)\,dx=0,\qquad-4<t<0.$ To get a control in $L^{1+\gamma}(L^{1})$ on the pressure it is then enough to control $\nabla P$. Step 1: Control on $u$ in $L^{\infty}(L^{3/2})$ in $Q_{3/2}$. Thanks to Hypothesis (27), there exists a constant $C$, depending only on $\phi$, such that for any $-4<t<0$ $\|u(t)\|_{L^{6}(B_{2})}\leq C\|\nabla u(t)\|_{L^{2}(B_{2})}.$ (31) So $\|(u\cdot\nabla)u\|_{L^{1}(-4,0;L^{3/2}(B_{2}))}\leq C\|\nabla u\|^{2}_{L^{2}(Q_{2})}\leq C\overline{\eta}.$ We need the same control on $\nabla P$. First, multiplying (1) by $\phi(x)$, integrating in $x$, and using Hypothesis (27), we find for any $-4<t<0$ $\int\phi(x)(u\cdot\nabla)u\,dx+\int\phi(x)\nabla P\,dx-\int\Delta\phi u\,dx=0.$ (32) So $\left\|\int\phi(x)\nabla P\,dx\right\|_{L^{1}(-4,0)}\leq C\left(\|\nabla u\|^{2}_{L^{2}(Q_{2})}+\|u\|_{L^{2}(-4,0;L^{6}(B_{2}))}\right)\leq C\sqrt{\overline{\eta}}.$ But, as for $u$, $\left\|\nabla P-\int\phi\nabla P\,dx\right\|_{L^{1}(-4,0;L^{3/2}(B_{2}))}\leq C\|\nabla^{2}P\|_{L^{1}(Q_{2})}.$ So, finally $\||(u\cdot\nabla)u|+|\nabla P|\|_{L^{1}(-4,0;L^{3/2}(B_{2}))}\leq C\sqrt{\overline{\eta}}.$ (33) Note that $\displaystyle\frac{3}{2}\frac{u}{|u|^{1/2}}\partial_{t}u=\frac{3}{2}\frac{1}{|u|^{1/2}}\partial_{t}\frac{|u|^{2}}{2}$ $\displaystyle\qquad\qquad=\frac{3}{2}|u|^{1/2}\partial_{t}|u|=\partial_{t}|u|^{3/2},$ $\displaystyle\frac{3}{2}\frac{u}{|u|^{1/2}}\Delta u=\frac{3}{2}\mathrm{div}\left(\frac{u}{|u|^{1/2}}\nabla u\right)-\frac{3}{2}\frac{|\nabla u|^{2}}{|u|^{1/2}}+\frac{3}{4}\frac{|\nabla|u||^{2}}{|u|^{1/2}}$ $\displaystyle\qquad\qquad\leq\Delta|u|^{3/2},$ since $|\nabla u|\geq|\nabla|u||$. We consider $\psi_{1}\in C^{\infty}(\mathbb{R}^{4})$ a nonnegative function compactly supported in $Q_{2}$ with $\psi_{1}=1$ in $Q_{3/2}$ and $|\nabla_{t,x}\psi_{1}|+|\nabla_{t,x}^{2}\psi_{1}|\leq C.$ Multiplying (1) by $(3/2)\psi_{1}(t,x)u/|u|^{1/2}$ and integrating in $x$ gives $\displaystyle\qquad\frac{d}{dt}\int\psi_{1}(t,x)|u|^{3/2}\,dx$ $\displaystyle\leq\int(|\partial_{t}\psi_{1}|+|\Delta\psi_{1}|)|u|^{3/2}\,dx$ $\displaystyle\qquad\qquad+\frac{3}{2}\|\psi_{1}^{1/3}|u|^{1/2}\|_{L^{3}(\mathbb{R}^{3})}\|\psi_{1}^{2/3}((u\cdot\nabla)u+\nabla P)\|_{L^{3/2}(B_{2})}$ $\displaystyle\leq\int(|\partial_{t}\psi_{1}|+|\Delta\psi_{1}|)|u|^{3/2}\,dx$ $\displaystyle\qquad\qquad+\frac{3}{2}\left(\int\psi_{1}(t,x)|u|^{3/2}\,dx\right)^{1/3}\|((u\cdot\nabla)u+\nabla P)\|_{L^{3/2}(B_{2})}$ $\displaystyle\leq\alpha(t)\left(1+\int\psi_{1}(t,x)|u|^{3/2}\,dx\right),$ with $\alpha(t)=\int(|\partial_{t}\psi_{1}|+|\Delta\psi_{1}|)|u|^{3/2}\,dx+\frac{3}{2}\|((u\cdot\nabla)u+\nabla P)\|_{L^{3/2}(B_{2})}.$ Thanks to (31) and (33) $\|\alpha\|_{L^{1}(-4,0)}\leq C\sqrt{\overline{\eta}}.$ Denoting $Y(t)=1+\int\psi_{1}(t,x)|u|^{3/2}\,dx$, we have $\dot{Y}\leq\alpha Y,\qquad Y(-4)=1.$ Gronwall’s lemma gives that for any $-4<t<0$ we have $Y(t)\leq exp\left(\int_{-4}^{t}\alpha(s)\,ds\right).$ Hence, for $\overline{\eta}$ small enough: $\|u\|_{L^{\infty}(-(3/2)^{2},0;L^{3/2}(B_{3/2}))}\leq C{\overline{\eta}}^{1/3}.$ (34) Step 2: Control on $u$ in $L^{\infty}(L^{2})$ in $Q_{1}$. We consider $\psi_{2}\in C^{\infty}(\mathbb{R}^{4})$ a nonnegative function compactly supported in $Q_{3/2}$ with $\psi_{2}=1$ in $Q_{1}$ and $|\nabla_{t,x}\psi_{2}|+|\nabla_{t,x}^{2}\psi_{2}|\leq C.$ Multiplying inequality (3) by $\psi_{2}$ and integrating in $x$ gives $\displaystyle\qquad\qquad\frac{d}{dt}\left(\int\psi_{2}\frac{|u|^{2}}{2}\,dx\right)$ $\displaystyle\leq\int u\cdot\nabla\psi_{2}\left(\frac{|u|^{2}}{2}+P\right)\,dx+\int(\partial_{t}\psi_{2}+\Delta\psi_{2})\frac{|u|^{2}}{2}\,dx.$ equalities (31) together with (33) and Sobolev imbedding gives $\||u|^{2}+P\|_{L^{1}(-(3/2)^{2},0;L^{3}(B_{3/2}))}\leq C{\overline{\eta}}^{1/2}.$ Together with (34), this gives that $\|u\|_{L^{\infty}(-1,0;L^{2}(B_{1}))}\leq C{\overline{\eta}}^{1/4}.$ (35) Step 3. $L^{\infty}$ bound in $Q_{1/2}$. We need now to get better integrability in time on the pressure. From (32) and (35), we get $\left\|\int\phi(x)\nabla P\,dx\right\|_{L^{2}(-1,0)}\leq C\sqrt{\overline{\eta}}.$ With Lemma 3 and (30), this gives for $\gamma<1$ $\|\nabla P\|_{L^{1+\gamma}(-1,0;L^{1}(B_{1}))}\leq C\sqrt{\overline{\eta}}.$ Together with (35), (28), and Proposition 6, this shows that for $\overline{\eta}$ small enough, we have $|u|\leq 1\qquad\mathrm{in}\ \ Q_{1/2}.$ Step 4: Obtaining more regularity. We now obtain higher derivative estimates by a standard bootstrapping method. We give the details carefully to ensure that the bounds obtained are universal, that is, do not depend on the actual solution $u$. For $n\geq 1$ we define $r_{n}=2^{-n-3}$, $\overline{B}_{n}=B_{r_{n}}$ and $\overline{Q}_{n}=Q_{r_{n}}$. We denote also $\overline{\psi}_{n}$ such that $0\leq\overline{\psi}_{n}\leq 1$, $\overline{\psi}_{n}\in C^{\infty}(\mathbb{R}^{4})$, $\displaystyle\overline{\psi}_{n}(t,x)$ $\displaystyle=$ $\displaystyle 1\qquad(t,x)\in\overline{Q}_{n},$ $\displaystyle=$ $\displaystyle 0\qquad(t,x)\in\overline{Q}_{n-1}^{c}.$ For every $n$ we have $\partial_{t}\nabla^{n}u+\mathrm{div}A_{n}+\nabla R_{n}-\Delta\nabla^{n}u=0,$ (36) with $A_{n}=\nabla^{n}(u\otimes u),\qquad R_{n}=\nabla^{n}P.$ So we have $\|A_{n}\|_{L^{p}(\overline{Q}_{n-1})}\leq C_{n}\|u\|^{2}_{L^{2p}(-r^{2}_{n-1},0;W^{n,2p}(\overline{B}_{n-1}))}$ (37) and thanks to Lemma 5, we can split $R_{n}$ as $R_{n}=R_{1,n}+R_{2,n},$ with $\displaystyle\|R_{1,n}\|_{L^{p}(\overline{Q}_{n-1})}\leq C_{n}\|A_{n}\|_{L^{p}(\overline{Q}_{n-2})},$ (38) $\displaystyle\|R_{2,n}\|_{L^{1}(-r^{2}_{n-1},0;W^{2,\infty}(\overline{B}_{n-1}))}\leq C_{n}\left(\|A_{n}\|_{L^{p}(\overline{Q}_{n-2})}+\|\nabla P\|_{L^{1}(\overline{Q}_{n-2})}\right)$ $\displaystyle\qquad\qquad\qquad\qquad\qquad\qquad\leq C_{n}\left(\|A_{n}\|_{L^{p}(\overline{Q}_{n-2})}+1\right).$ (39) Moreover we have: $\displaystyle\partial_{t}(\overline{\psi}_{n}\nabla^{n}u)-\Delta(\overline{\psi}_{n}\nabla^{n}u)$ $\displaystyle\qquad=-\mathrm{div}(A_{n}\overline{\psi}_{n})+\nabla\overline{\psi}_{n}A_{n}$ $\displaystyle\qquad\qquad-\nabla(\overline{\psi}_{n}R_{n})+(\nabla\overline{\psi}_{n})R_{n}$ $\displaystyle\qquad\qquad+\Delta\overline{\psi}_{n}\nabla^{n}u-2\mathrm{div}(\nabla\overline{\psi}_{n}\nabla^{n}u)$ $\displaystyle\qquad\qquad+(\partial_{t}\overline{\psi}_{n})\nabla^{n}u.$ Note that $\overline{\psi}_{n}\nabla^{n}u=0$ on $\partial\overline{Q}_{n-1}$. So $\overline{\psi}_{n}\nabla^{n}u=V_{1,n}+V_{2,n}$ (40) with $\displaystyle\partial_{t}V_{1,n}-\Delta V_{1,n}=-\mathrm{div}(A_{n}\overline{\psi}_{n})+\nabla\overline{\psi}_{n}A_{n}$ $\displaystyle\qquad-\nabla(\overline{\psi}_{n}R_{1,n})+(\nabla\overline{\psi}_{n})R_{1,n}$ $\displaystyle\qquad+\Delta\overline{\psi}_{n}\nabla^{n}u-2\mathrm{div}(\nabla\overline{\psi}_{n}\nabla^{n}u)$ $\displaystyle\qquad+(\partial_{t}\overline{\psi}_{n})\nabla^{n}u$ $\displaystyle\qquad\qquad\qquad=F_{n},$ $\displaystyle V_{1,n}=0\qquad\mathrm{for}\ t=-r_{n-1}^{2},$ and $\displaystyle\partial_{t}V_{2,n}-\Delta V_{2,n}=-\nabla(\overline{\psi}_{n}R_{2,n})+R_{2,n}(\nabla\overline{\psi}_{n}),$ $\displaystyle V_{2,n}=0\qquad\mathrm{for}\ t=-r_{n-1}^{2}.$ Thanks to (37) and (38), we have $\|F_{n}\|_{L^{p}(-r^{2}_{n-1},0;W^{-1,p}(\overline{B}_{n-1}))}\leq C_{n}\left(1+\|u\|^{2}_{L^{2p}(-r^{2}_{n-2},0;W^{n,2p}(\overline{B}_{n-2}))}\right).$ So, from Lemma 4, $\displaystyle\|V_{1,n}\|_{L^{p}(-r^{2}_{n-1},0;W^{1,p}(\overline{B}_{n-1}))}\leq C\|F_{n}\|_{L^{p}(-r^{2}_{n-1},0;W^{-1,p}(\mathbb{R}^{3}))},$ $\displaystyle\|V_{2,n}\|_{L^{\infty}(-r^{2}_{n-1},0;W^{1,\infty}(\overline{B}_{n-1}))}\leq C\|\overline{\psi}_{n}\nabla R_{2,n}\|_{L^{1}(-r^{2}_{n-1};W^{1,\infty}(\mathbb{R}^{3}))}$ $\displaystyle\qquad\qquad\qquad\qquad+C\|R_{2,n}(\nabla\overline{\psi}_{n})\|_{L^{1}(-r^{2}_{n-1}W^{1,\infty}(\mathbb{R}^{3}))}$ $\displaystyle\qquad\qquad\leq C_{n}\left(1+\|u\|^{2}_{L^{2p}(-r^{2}_{n-2},0;W^{n,2p}(\overline{B}_{n-2}))}\right),$ where we have used (37) and (39) in the last line. Hence, from (40) and using that $\overline{\psi}_{n}=1$ on $\overline{Q}_{n}$, we have for any $1<p<\infty$ $\|\nabla^{n}u\|_{L^{p}(-r^{2}_{n},0;W^{1,p}(\overline{B}_{n}))}\leq C_{n}\left(1+\|u\|^{2}_{L^{2p}(-r^{2}_{n-2},0;W^{n,2p}(\overline{B}_{n-2}))}\right).$ By induction we find that for any $n\geq 1$, and any $1\leq p<\infty$, there exists a constant $C_{n,p}$ such that $\|u\|_{L^{2^{-n}p}(-r^{2}_{n},0;W^{n,2^{-n}p}(\overline{B}_{n}))}\leq C_{n,p}.$ This is true for any $p$, so for $n$ fixed, taking $p$ big enough and using Sobolev imbedding, we show that for any $1\leq q<\infty$, there exists a constant $C_{n,q}$ such that $\|u\|_{L^{q}(-r^{2}_{n+1},0;W^{n,\infty}(\overline{B}_{n+1}))}\leq C_{n,q}.$ As (37), we get that $\|A_{n}\|_{L^{1}(-r^{2}_{n+3},0;W^{2,\infty}(\overline{B}_{n+3}))}\leq C_{n}.$ Thanks to Lemma 5, we get $\displaystyle\|R_{1,n}\|_{L^{1}(-r^{2}_{n+4},0;W^{1,\infty}(\overline{B}_{n+4}))}\leq C_{n},$ $\displaystyle\|R_{2,n}\|_{L^{1}(-r^{2}_{n+4},0;W^{1,\infty}(\overline{B}_{n+4}))}\leq C_{n}.$ Hence $\|\partial_{t}\nabla^{n}u\|_{L^{1}(-r^{2}_{n+4},0;L^{\infty}(\overline{B}_{n+4}))}\leq C_{n},$ and finally $\|\nabla^{n}u\|_{L^{\infty}(\overline{Q}_{n+4})}\leq C_{n}.$ ## 5 From local to global Let us fix $\delta>0$. We take $\eta^{*}\leq\overline{\eta}$ and consider any $\varepsilon>0$ such that $4\varepsilon^{2}\leq t_{0}$. Then from Proposition 10 and Proposition 9, for any $(t,x)\in\Omega^{\delta}_{\varepsilon}\cap\\{t\geq t_{0}\\}$, we have $|\nabla^{n}_{y}v_{\varepsilon}(0,0)|\leq C_{n},$ where $v_{\varepsilon}$ is defined by (20). But for any $n\geq 1$, we have $\nabla^{n}_{y}v_{\varepsilon}(0,0)=\varepsilon^{n+1}\nabla^{n}u(t,x).$ Hence $\left|\left\\{(t,x)\in\Omega\setminus|\nabla^{n}u(t,x)|\geq\frac{C_{n}}{\varepsilon^{n+1}}\right\\}\right|\leq|[\Omega^{\delta}_{\varepsilon}]^{c}|.$ And thanks to Lemma 8, This measure is smaller than $\frac{C}{\eta^{*}}\left(\|u^{0}\|^{2}_{L^{2}(\mathbb{R}^{3})}+\|u^{0}\|_{L^{2}(\mathbb{R}^{3})}^{2(\gamma+1)}\right)\varepsilon^{4-\delta}.$ We denote $R=\left(1+\frac{4}{t_{0}}\right)^{\frac{n+1}{2}}.$ For $k\geq 1$, we use our estimate with $\varepsilon^{n+1}=R^{-k}$ to get $\left|\left\\{(t,x)\in\Omega\setminus\frac{|\nabla^{n}u(t,x)|}{C_{n}}\geq R^{k}\right\\}\right|\leq\frac{C\left(1+\|u^{0}\|_{L^{2}(\mathbb{R}^{3})}^{2(\gamma+1)}\right)}{R^{k\frac{4-\delta}{n+1}}}.$ So, for $p<\frac{4-\delta}{n+1}$ $\displaystyle\left\|\frac{\nabla^{n}u}{C_{n}}\right\|^{p}_{L^{p}(\Omega)}\leq\left|\left\\{(t,x)\in\Omega\setminus\frac{|\nabla^{n}u(t,x)|}{C_{n}}\leq R\right\\}\right|R^{p}$ $\displaystyle\qquad\qquad+\sum_{k=1}^{\infty}R^{(k+1)p}\left|\left\\{(t,x)\in\Omega\setminus\frac{|\nabla^{n}u(t,x)|}{C_{n}}\geq R^{k}\right\\}\right|$ $\displaystyle\qquad\leq|\Omega|R^{p}+CR^{p}\left(1+\|u^{0}\|_{L^{2}(\mathbb{R}^{3})}^{2(\gamma+1)}\right)\sum_{k=1}^{\infty}R^{k\left(p-\frac{4-\delta}{n+1}\right)}$ $\displaystyle\leq|\Omega|R^{p}+\frac{CR^{p}}{1-R^{p-\frac{4-\delta}{n+1}}}\left(1+\|u^{0}\|_{L^{2}(\mathbb{R}^{3})}^{2(\gamma+1)}\right).$ The results holds for any $\delta>0$ which ends the proof of Theorem 1. Acknowledgment: This work was partially supported by NSF Grant DMS-0607053. We thank Prof. Caffarelli for many insightful discussions and advices. ## References * [1] J. Bergh and J. Löfström. Interpolation spaces. An introduction. Springer-Verlag, Berlin, 1976. Grundlehren der Mathematischen Wissenschaften, No. 223. * [2] L. Caffarelli, R. Kohn, and L. Nirenberg. Partial regularity of suitable weak solutions of the Navier-Stokes equations. Comm. Pure Appl. Math., 35(6):771–831, 1982. * [3] R. Coifman, P.-L. Lions, Y. Meyer, and S. Semmes. Compensated compactness and Hardy spaces. J. Math. Pures Appl. (9), 72(3):247–286, 1993. * [4] E. B. Fabes, B. F. Jones, and N. M. Rivière. The initial value problem for the Navier-Stokes equations with data in $L^{p}$. Arch. Rational Mech. Anal., 45:222–240, 1972. * [5] E. Hopf. Über die Anfangswertaufgabe für die hydrodynamischen Grundgleichungen. Math. Nachr., 4:213–231, 1951. * [6] H. Koch and D. Tataru. Well-posedness for the Navier-Stokes equations. Adv. Math., 157(1):22–35, 2001. * [7] J. Leray. Sur le mouvement d’un liquide visqueux emplissant l’espace. Acta. Math., 63:183–248, 1934. * [8] F. Lin. A new proof of the Caffarelli-Kohn-Nirenberg theorem. Comm. Pure Appl. Math., 51(3):241–257, 1998. * [9] P.-L. Lions. Mathematical topics in fluid mechanics. Vol. 1, volume 3 of Oxford Lecture Series in Mathematics and its Applications. The Clarendon Press Oxford University Press, New York, 1996. Incompressible models, Oxford Science Publications. * [10] V. Scheffer. Partial regularity of solutions to the Navier-Stokes equations. Pacific J. Math., 66(2):535–552, 1976. * [11] V. Scheffer. Hausdorff measure and the Navier-Stokes equations. Comm. Math. Phys., 55(2):97–112, 1977. * [12] V. Scheffer. The Navier-Stokes equations in space dimension four. Comm. Math. Phys., 61(1):41–68, 1978. * [13] V. Scheffer. The Navier-Stokes equations on a bounded domain. Comm. Math. Phys., 73(1):1–42, 1980. * [14] J. Serrin. The initial value problem for the Navier-Stokes equations. In Nonlinear Problems (Proc. Sympos., Madison, Wis., pages 69–98. Univ. of Wisconsin Press, Madison, Wis., 1963. * [15] V. A. Solonnikov. A priori estimates for solutions of second-order equations of parabolic type. Trudy Mat. Inst. Steklov., 70:133–212, 1964. * [16] M. Struwe. On partial regularity results for the Navier-Stokes equations. Comm. Pure Appl. Math., 41(4):437–458, 1988. * [17] R. Temam. Navier-Stokes equations. AMS Chelsea Publishing, Providence, RI, 2001. Theory and numerical analysis, Reprint of the 1984 edition. * [18] A. Vasseur. A new proof of partial regularity of solutions to Navier-Stokes equations. NoDEA Nonlinear Differential Equations Appl., 14(5-6):753–785, 2007\.
arxiv-papers
2009-04-16T03:25:12
2024-09-04T02:49:01.898036
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Alexis F Vasseur", "submitter": "Alexis Vasseur", "url": "https://arxiv.org/abs/0904.2422" }
0904.2513
# Significant foreground unrelated non-acoustic anisotropy on the one degree scale in WMAP 5-year observations Bi-Zhu Jiang11affiliation: Physics Department and Center for Astrophysics, Tsinghua University, Beijing 100084, China. 22affiliation: Department of Physics, University of Alabama, Huntsville, AL 35899. , Richard Lieu22affiliation: Department of Physics, University of Alabama, Huntsville, AL 35899. , Shuang-Nan Zhang11affiliation: Physics Department and Center for Astrophysics, Tsinghua University, Beijing 100084, China. 22affiliation: Department of Physics, University of Alabama, Huntsville, AL 35899. 33affiliation: Key Laboratory of Particle Astrophysics, Institute of High Energy Physics, Chinese Academy of Sciences, Beijing, China , and Bart Wakker44affiliation: Department of Astronomy, University of Wisconsin, 475 N. Charter St, Madison, WI 53706, USA ###### Abstract The spectral variation of the cosmic microwave background (CMB) as observed by WMAP was tested using foreground reduced WMAP5 data, by producing subtraction maps at the 1∘ angular resolution between the two cosmological bands of V and W, for masked sky areas that avoid the Galactic disk. The resulting $V-W$ map revealed a non-acoustic signal over and above the WMAP5 pixel noise, with two main properties. Firstly, it possesses quadrupole power at the $\approx$ 1 $\mu K$ level which may be attributed to foreground residuals. Second, it fluctuates also at all values of $\ell>$ 2, especially on the $1^{\circ}$ scale ($200\lesssim\ell\lesssim 300$). The behavior is random and symmetrical about zero temperature with a r.m.s. amplitude of $\approx$ 7 $\mu K$, or 10 % of the maximum CMB anisotropy, which would require a ‘cosmic conspiracy’ among the foreground components if it is a consequence of their existences. Both anomalies must be properly diagnosed and corrected if ‘precision cosmology’ is the claim. The second anomaly is, however, more interesting because it opens the question on whether the CMB anisotropy genuinely represents primordial density seeds. ## 1 Introduction Studies of the cosmic microwave background (CMB, Penzias and Wilson (1965)), the afterglow radiation of the Big Bang, are currently in a period of renaissance after the breakthrough discovery of anisotropy by the COBE mission (Smoot et al (1992)). Confirmed with much improved resolution and statistics by WMAP (Hinshaw et al (2009)), the phenomenon provides vital information on the primordial ‘seeds’ of structure formation. The anisotropy is attributed to frequency shift of CMB light induced by these ‘seed’ density perturbations, which has the unique property that it leads to changes in the temperature of the black body spectrum and not the shape of it. The CMB has maximum anisotropy power at the 1∘ scale, or harmonic number $\ell\approx$ 220, with lower amplitude secondary and tertiary peaks at higher $\ell$. The $\Lambda$CDM cosmological model (Spergel et al(2007)) explains the entire power spectrum remarkably using six parameters, by attributing the peaks to acoustic oscillations of baryon and dark matter fluids, as long wavelength modes of density contrast enter the horizon and undergo causal physical evolution. CMB light emitted from within an overdense region of the oscillation are redshifted by a constant fractional amount, resulting in a cold spot, which is a lowering by $\delta T$ of the black body temperature $T$, and is frequency independent, i.e. $\delta T/T=\delta\nu/\nu=$ constant. The opposite effect of blueshift applies to underdense regions, leading to hot spots. Therefore, if the anisotropy is genuinely due to acoustic oscillations, the inferred change in $T$ at a given region should be the same for all the ‘clean’ frequency passbands of the WMAP mission. Since a corresponding variation of the CMB flux $B(\nu,T)$ at any given frequency $\nu$ is $\delta B=(\partial B/\partial T)\delta T$ if the cause is solely $\delta T$ with no accompanying distortion of the functional form of $B$ itself, the expected $\delta B$ at constant $\delta T$ is then the ‘dipole spectrum’ $\partial B/\partial T$ which is well measured by COBE-FIRAS (Mather et al(1994)). Moreover, the WMAP data are calibrated w.r.t. this dipole response. A noteworthy point about the acoustic peaks is that one needs to employ the technique of cross correlation to reduce the noise contamination at high $\ell$, especially the harmonics of the second and higher acoustic peaks. Specifically one computes the all-sky cross power spectrum $C_{\ell}^{ij}=\frac{1}{2\ell+1}\sum_{m}~{}a_{\ell m}^{i}a_{\ell m}^{j*},$ (1) where the indices $i$ and $j$ denote independent data streams with uncorrelated noise that arise from a pair of maps at different frequency bands (or same band but taken at different times), and $a_{\ell m}^{i}=\delta T_{\ell m}^{i}$ is the apparent CMB temperature anisotropy for the spherical harmonics $(\ell,m)$ as recorded by observation $i$. Since the use of multiple passbands is crucial to the accurate profiling of the acoustic oscillations, it is important that we do compare them with care, down to the level of measurement uncertainties. Only a priori statistically consistent maps should be cross correlated, in the sense that any real discrepancies between such maps may carry vital information about new physical processes that their cross power spectrum does not reveal. In one previous attempt to address this point (see Figure 9 of Bennett et al(2003a)) WMAP1 data downgraded to an angular resolution commensurate with COBE were used to produce a difference (subtraction) map between the two missions. When displayed side by side with the map of the expected noise for each resulting pixel, the two maps did appear consistent. Nevertheless, this powerful method of probing the CMB anisotropy does, in the context of the specific datasets used by Bennett et al(2003a), suffer from one setback: it is limited by the sensitivity and resolution of COBE. In another test of a similar kind, we observe that each amplitude $a_{\ell m}^{i}$ can further be factorized as $a_{\ell m}^{i}=a_{\ell m}b_{\ell}^{i}$, where the array $b_{\ell}^{i}$ accounts for the smoothing effects of both the beam and the finite sky map pixel size, and $a_{\ell m}=\delta T_{\ell m}$ is the true amplitude of the CMB anisotropy. The results (see Figure 13 of Hinshaw et al (2007)) indicate agreement of the variance $C_{\ell}^{ij}$, hence $\delta T_{\ell}$, within the margin of a few percent for $\ell\lesssim$ 400 among the many cross power spectra formed by the various possible combinations of pairs of all-sky maps. This offers more ground for optimism, but to be definitive the remaining discrepancy needs to be demonstrably attributed to noise, instrumental systematics, or foreground emission. The purpose of our investigation is to perform further, more revealing comparisons than the two past ones described above, initially by focussing upon the angular scale of the first acoustic peak, which is $\sim$ 1∘. Our analysis will be done in both real (angular) and harmonic domains, because while most of the effort have hitherto been pursued in the latter, the former is the domain in which the raw data were acquired and organized. ## 2 The all sky difference map between the WMAP5 V and W bands We adopted the Healpix111See http://healpix.jpl.nasa.gov. pixelization scheme to ensure that all pixels across the sky have the same area (or solid angle). Firstly the W band data is smoothed to the V band resolution. Then the whole sky map is downgraded to $\approx$ 1∘ diameter (corresponding to nside of 64 in the parametrization of the WMAP database), which is not only commensurate with the scale of global maximum $\delta T$ power, but also large enough to prevent data over-sampling due to the use of too high a resolution, as the size is comfortably bigger than the beam width of the WMAP V band (61 GHz) larger than that of the W band. The resulting $\delta T$ values for the two cosmological passbands of V and W, span $\approx$ 35,000 clean (i.e. ext-masked222ext is short for external temperature analysis. and foreground subtracted333For foreground subtracted WMAP5 maps see http://lambda.gsfc.nasa.gov/product/map/current/m_products.cfm.) pixels, from which a $V-W$ difference map at this $\approx$ 1∘ resolution was made. After removing the monopole and dipole residuals (the latter aligned with the original COBE dipole), this map is displayed in Figure 1 along with the corresponding pixel noise map for reference; the latter represents the expected appearance of the $V-W$ map if the CMB anisotropy is genuinely acoustic in nature, so that the map would consist only of null pixels should the WMAP5 instruments that acquired them be completely noise free. When comparing the real data map of Figure 1a with the simulated map of Figure 1b, the former appears visibly noisier on the resolution scale $\approx$ 1∘; moreover, the Leo and Aquarius (i.e. the first and third) sky quadrants contain more cold pixels than the other half of the sky, indicative of the existence of a quadrupole residual. The extra signals revealed by the $V-W$ subtraction map are elucidated further in respect of their aforementioned properties by examining the statistical distribution of the pixel values across the four sky quadrants. As shown in Figure 2, the distribution of the 1∘ anisotropy is considerably wider than that expected from the WMAP5 pixel noise for all the quadrants, by $\approx$ 10 $\mu K$, which is $\sim$ 10 % of the $\approx$ 75 $\mu K$ power in the first acoustic peak, and is therefore very significant. A detailed confirmation by Gaussian curve fitting is given in Table 1. The $V-W$ quadrupole is more subtle, and is evident in the residual plots at the bottom of each graph in Figure 2, from which a slight skewness of the data to the right is apparent in quadrants 1 and 3 (the quadrants of the CMB dipole), with 2 and 4 exhibiting the opposite behavior. For this reason, the effect does not manifest itself as shifts in the Gaussian mean value $\mu$ of Table 1. Rather, the high statistical significance of both the quadrupole and the degree-scale signals, with the former having a magnitude of $\approx$ 1 $\mu K$, are established by computing the cross power spectra of the temperature difference maps, Figure 4. This was performed at the resolution of nside$=$ 64 using the PolSpice software444Available from http://www.planck.fr/article141.html.. From Figure 4 also, the presence of excess non-acoustic anisotropy at all harmonics $\ell>2$, including the cosmologically important $\theta\approx 1^{\circ}$ angular scale, appears robust. At the $1^{\circ}$ scale ($200\lesssim\ell\lesssim 300$), the r.m.s. is about 7 $\mu K$, or 10 % of the maximum CMB anisotropy. Lastly, the $V-W$ quadrupole may be displayed in isolation by arranging the data of the subtracted map as a multipole expansion $\delta T(\theta,\phi)=\sum_{\ell,m}a_{\ell m}Y_{\ell m}(\theta,\phi),$ (2) and evaluating at $\ell=2$ the amplitude $\delta T_{\ell}(\theta,\phi)=\sum_{m}a_{\ell m}Y_{\ell m}(\theta,\phi),$ (3) (note $\delta T_{\ell}(\theta,\phi)$ is always a real number if the original data $\delta T(\theta,\phi)$ are real). The ensuing whole sky map is in Figure 3, and the coordinates of the axes are in Table 2. ## 3 Interpretation of results The WMAP5 $V-W$ map reveals two principal anomalies to be explained: (a) the quadrupole at $\ell=2$, with an amplitude of $\approx 1\mu K$, and (b) the higher harmonic signals, especially the $\approx 8~{}\mu K$ anisotropy at $\ell\gtrsim$ 200 (Figure 4). Similar findings are also made by others, like the noticeable hemispherical power asymmetry in the WMAP1 analysis of Eriksen et al (2004) and confirmed in the WMAP5 data by Hoftuft et al (2009), or the large scale distribution investigated by Diego et al (2009). Also because both (a) and (b) are not small effects, claims to precision cosmology are overstatements until they are properly accounted for and the cosmological model accordingly adjusted. Concerning (a), unlike the dipole, there is no previous known CMB quadrupole of sufficient amplitude to justify its dismissal as a cross band calibration residual. In fact, our reported amplitude of $1~{}\mu$K is about 7 % of the 211 $\mu$K2 WMAP5 anisotropy in the unsubtracted maps of the individual bands at $\ell=$ 2, which is far larger than the calibration uncertainty of $\approx$ 0.5 % (Hinshaw et al (2009)) for each band. It will probably be more rewarding to search for remaining foreground contamination not yet removed by the standard data filtering and correction procedures of the WMAP5 team (Bennett et al(2003b), Gold et al(2009)). Thermal dust emission might have a power law spectrum with an index too close to that of the Rayleigh-Jeans tail in the V and W bands for an appreciable V - W signal, although this is an interesting scenario worthy of further study (Diego et al 2009). We consider here another possibility, viz. free-free emission from High Velocity Clouds (HVCs, Wakker et al (2009) and references therein). The clouds are moving at velocities sufficiently large for any H$\alpha$ emission from them to be outside the range555Example of a HVC missed by WHAM is Hill et al 2009, a cloud of unit emission measure. A notable exception (counter example) would be the HVC K-complex (Haffner et al 2001), with an emission measure of 1.1 units, that happens to fall inside the velocity window of WHAM. of the WHAM survey, the database employed to estimate the free-free contribution to the WMAP foreground. HVC parameters for the larger and brighter clouds can reach: $n_{e}\approx$ 0.2 $cm^{-3}$ and column density $\approx$ 3 $\times$ 1019 cm-2 (Wakker et al 2008). This corresponds to an emission measure of two units, or 6 $\times$ 1018 cm-5, or $\approx$ 0.6 $\mu K$ of V-W temperature excess (Finkbeiner D.P. (2003)), on par with the 1 $\mu K$ of our observed quadrupole. Moreover, as can be seen from the all-sky map of $N_{{\rm HI}}$ and an estimate of the V-W excess in Figure 5 when they are compared with Figures 3 and 4, the strength and distribution of HVCs do appear to be responsible for a non-negligible fraction of the observed anomaly on very large scales. Further work in this area is clearly necessary, and will be pursued in a future, separate paper. We now turn to (b), the effect that occurs on the much smaller and cosmologically most significant angular scale of 1∘. Calibration issues are again immediately excluded here, since the 8 $\mu K$ anomalous amplitude is on par with the pixel noise of WMAP5 for the scale in question (Table 1). Moreover, because the subtracted $V-W$ dipole and the (unsubtracted) $V-W$ quadrupole, the latter being (a), are both relatively feeble phenomena, of amplitudes $\approx$ 0.2 and 1 $\mu K$ respectively as compared to the 7 $\mu K$ amplitude of (b), the prospect of smaller scale fluctuations having been enhanced by a larger scale one can be ruled out here. CMB spectral distortion during the recombination era, or subsequently from the Sunyaev-Zeld́ovich (SZ) scattering, or from other foreground re-processing that were not properly compensated by the data cleaning procedure of WMAP5, could all be responsible for the observed anomaly. Although the first two interactions (Sunyaev and Chluba (2008), Birkinshaw and Gull (1983)) exert much smaller influences than 7 $\mu K$ (bearing in mind that the degree of SZ needs to be averaged over the scale of the whole sky), the foreground could potentially play a relevant role in a similar way as it did at very low $\ell$. Thus, in respect of free-free emission by HVCs alone, until a full survey at high angular resolution is performed one cannot be certain that the emission measure from these clouds is too weak to account for our (b) anomaly. However, the action of the foreground is systematic in that it does not lead to random and symmetric temperature excursions (about zero) between two frequencies of V and W. More precisely, because the sources or sinks involved have a characteristic spectrum that differs from black body in a specific way, any widening in Figure 2 of the data distribution w.r.t. the expected simulated gaussian ought to be highly asymmetric. This obviously contradicts our findings, i.e. we note from Figure 2 that the widening of the data histogram is highly symmetric. As a result, the symptoms do not point to the foreground as responsible cause. ## 4 Conclusion We performed a new way of testing the black body nature of the CMB degree scale anisotropy, by comparing the all-sky distribution of temperature difference between the WMAP5 cosmological bands of V and W, with their expected pixel noise behavior taken fully into consideration by means of simulated data. In this way a non acoustic signal is found in the ext-masked $V-W$ map at the $\approx$ 1∘ resolution of nside $=$ 64, with the following two properties. It has a quadrupole amplitude $\approx$ 1 $\mu$K (Figures 2, 3, and 4) which may in part be attributed to unsubstracted foreground emission. It also has excess anisotropy (or fluctuation) on all scales $\ell>$ 2, including and especially the scales of $200\lesssim\ell\lesssim 300$ where most of the acoustic power resides, and about which the anomaly we reported is in the form of a symmetric random excursion about zero temperature with a r.m.s. $\approx$ 8 $\mu K$ (Figures 2 and 4, Table 1) which is $\approx$ 10 % of the maximum acoustic amplitude found at $\ell\approx$ 220\. This type of excursion frustrates attempts to explain the effect as foreground residuals, i.e. it opens the question of whether the WMAP anisotropy on the 1∘ scale is genuinely related to the seeds of structure formation. In any case, it is clear that both anomalies have sufficiently large magnitudes to warrant their diagnoses through future, further investigations, if the status of precision cosmology is to be reinstated. Figure 1: The ext-masked and point sources subtracted WMAP5 $V-W$ map, viz. the difference map between the CMB anisotropy as measured in the V band and the W band, for the real data after the removal of residual monopole and dipole components (top), and simulated pixel noise that reflect precisely the observational condition (bottom). Both maps are plotted in Galactic coordinates with the Galactic center $(l,b)=(0,0)$ in the middle and Galactic longitude $l$ increasing to the left. To avoid the problems of beam size variation from one band to the next, the W band data is smoothed to the V band resolution, then the pixels were downgraded to the common resolution of nside$=$ 64 using the foreground-reduced WMAP5 data (see section 2); this resolution under-samples the data in both bands. The color scale is coded within a symmetrical range: those pixels with values beyond $\pm 40~{}\mu$K are displayed in the same (extreme) color; most of such pixels are around the masked regions. The existence of additional non- black body signal in the real data can readily be seen from this comparison, as the simulated map is noticeably quieter. Figure 2: The data points show quadrant sky occurrence frequency distribution of the difference in the degree-scale (nside$=64$) anisotropy between the WMAP5 V and W bands, while the errors in the data are due to the WMAP5 pixel noise for the same ext-masked quadrant sky area, i.e. they are the statistical fluctuations in the various parts of the solid line, which gives the mean histogram of this noise. The orientation of each quadrant follows the same convention as the sky maps of Figure 1, with the 1st and 3rd quadrants marking the COBE dipole. Figure 3: $V-W$ quadrupole of the nside$=64$ WMAP5 temperature difference maps, after ext-masking and point source subtraction. The mathematical procedure of extracting each multipole $\ell$ is given in eqs. (3) and (4) of the text, and the software used to do these computations was from anafast of Healpix. Figure 4: Real and simulated (noise) power spectra of the WMAP5 $V-W$ map. These are V-W cross power spectra computed by cross correlating the first three years of observations with the last two. The errors in the real data of the first two graphs represent the pixel noise power of the last graph, i.e. 4c is the average of 1,000 simulated realizations of the V-W WMAP5 pixel noise. Thus, if the noise power at harmonic $\ell$ is $(\delta T_{\ell})^{2}$ from 4c, the upper error bar in 4a and 4b will extend from $T_{l}^{2}$ to $(T_{\ell}+\delta T_{\ell})^{2}$ where $T_{\ell}$ is the observed V-W anisotropy of each real data point (given by the intersection of the error bars with the zig-zag line) in 4a and 4b. The rising trend ($\sim l^{2}$) of all three curves towards higher $l$ simply reflects the relatively larger pixel noise for smaller angular areas. For $l>$ 200 the real data of 4a and 4b rapidly become noise dominated. Figure 5: Upper map shows 21 cm data of HVCs with HI column density ($N_{{\rm HI}}$) larger than 7 $\times$ 1018 cm-2 (i.e. the greyscale shows $N_{{\rm HI}}$ with the outer contour at 7 $\times$ 1018 cm-2). Complex C is the cloud in the region $l=$ 90∘ – 130∘, $b=$ 40∘ – 60∘. Complex A is around $l=$ 150∘, $b=$ 30∘ – 45∘. The Magellanic Stream (MS) and Bridge is at $l=$ 280∘ – 310∘, $b<$ -30∘. The Leading Arm of the MS, plus some other bright HVCs are at $l=$ 240∘ – 300∘, $b=$ 10∘ – 30∘. Lower map gives our estimated V-W temperature excess due to HVCs. Note that because the dynamic range of conversion from $N_{{\rm HI}}$ to this excess (via free-free emission measure $EM$ of $N_{{\rm HII}}$) is not linear (e.g. Putman et al 2003, Hill et al 2009). Our approach is to assign 0.5 and 1.0 unit of $EM$, or 0.15 and 0.3 $\mu$K of V-W excess, to every direction with $N_{{\rm HI}}\geq$ 2 $\times$ 1019 cm-2 and 5 $\times$ 1019 cm-2 respectively. V - W | $\mu(\mu$K) | error ($\mu$K) | $\sigma$ ($\mu$K) | error ($\mu$K) ---|---|---|---|--- | WMAP5 | -0.23 | 0.15 | 16.23 | 0.13 Quadrant 1 | Simulation | 0.00 | 0.13 | 14.70 | 0.12 | Difference $\Delta$ | -0.23 | 0.20 | 6.88 | 0.40 | WMAP5 | 0.24 | 0.12 | 14.47 | 0.10 Quadrant 2 | Simulation | -0.04 | 0.12 | 12.10 | 0.10 | Difference $\Delta$ | 0.28 | 0.17 | 7.94 | 0.24 | WMAP5 | -0.11 | 0.16 | 16.22 | 0.13 Quadrant 3 | Simulation | 0.03 | 0.15 | 14.70 | 0.12 | Difference $\Delta$ | -0.14 | 0.22 | 6.86 | 0.40 | WMAP5 | 0.40 | 0.13 | 14.80 | 0.10 Quadrant 4 | Simulation | -0.01 | 0.13 | 12.26 | 0.10 | Difference $\Delta$ | 0.41 | 0.18 | 8.30 | 0.23 Table 1: Parameters for the gaussian curves that fitted the WMAP5 data and the pixel noise histograms (the latter are the solid lines) of Figure 2. Each parameter uncertainty is set by the $\chi^{2}_{{\rm min}}+1$ criterion, which represents the usual 68 % (or unit standard deviation) confidence interval for one interesting parameter, when the error bars shown in Figure 2 are employed for fitting both the real and pixel noise data. The difference in the width $\sigma$ between the two models, which gives the distribution width of the additional random signal, is given by $(\Delta\sigma)^{2}=\sigma_{r}^{2}-\sigma_{s}^{2}$. The smaller simulated gaussian widths for quadrants 2 and 4 (relative to 1 and 3) is due to the higher exposure times there (which contain the heavily scanned ecliptic poles) leading to lower pixel noise. V-W quadrupole location $(l,b)$ --- hot | $(-132.1^{\circ},-14.4^{\circ})$,$(48.0^{\circ},14.4^{\circ})$ cold | $(-81.5^{\circ},68.0^{\circ})$,$(98.5^{\circ},-68.0^{\circ})$ Table 2: Orientation of the quadrupole in the WMAP5 V-W map of Figure 3. We are grateful to the referee for very valuable suggestions towards the improvement of this paper. Lyman Page, Priscilla Frisch, Gary Zank, and Barry Welsh are also acknowledged for helpful discussions. Some of the results were obtained by means of the HEALPix package (G$\acute{o}$rski et al (2005)). ## References * Bennett et al (2003a) Bennett, C.L., et al. 2003a, ApJS, 148, 1 * Bennett et al (2003b) Bennett, C.L., et al. 2003b, ApJS, 148, 97 * Birkinshaw and Gull (1983) Birkinshaw, M. and Gull, S.F. 1983, Nature, 302, 315 * Diego et al (2009) Diego, J.M., Cruz, M., Gonz$\acute{a}$lez-Nuevo, J., Maris, M., Ascasibar, Y., Burigana, C., preprint(arXiv:0901.4344 [astro-ph]), MNRAS submitted * Eriksen et al (2004) Eriksen, H.K., Hansen, F.K., Banday, A.J., G$\acute{o}$rski, K.M., Lilje, P.B. 2004, ApJ, 605, 14 * Gold et al (2009) Gold, B., et al. 2009, ApJS, 180, 265 * G$\acute{o}$rski et al (2005) G$\acute{o}$rski, K.M., Hivon, E., Banday, A.J., Wandelt, B.D., Hansen, F.K., Reinecke, M., and Bartelmann, M. 2005, ApJ, 622, 759-771 * Finkbeiner D.P. (2003) Finkbeiner, D.P. 2003, ApJS, 146, 407 * Haffner et al (2001) Haffner, L.M., Reynolds, R.J., Tufte, S.L., 2001, ApJ, 556, L33 * Hill et al (2009) Hill, A.S., Haffner, L.M., Reynolds, R.J. 2009, ApJ, 703, 1832 * Hinshaw et al (2007) Hinshaw, G., et al. 2007, ApJS, 170, 288 * Hinshaw et al (2009) Hinshaw, G., et al. 2009, ApJS, 180, 225 * Hoftuft et al (2009) Hoftuft, J., Eriksen, H.K., Banday, A.J., G$\acute{o}$rski, K.M., Hansen, F.K., Lijie, P.B. 2009, ApJ, 699, 2 * Hou et al (2009) Hou, Z., Banday, A.J., G$\acute{o}$rski, K.M. 2009, MNRAS, 396, 3 * Mather et al (1994) Mather, J.C., et al. 1994, ApJ, 420, 439 * Penzias and Wilson (1965) Penzias, A.A. and Wilson, R.W. 1965, ApJ, 142, 419 * Putman (2003) Putman, M.E., Bland-Hawthorn, J., Veilleux, S., Gibson, B.K., Freeman, K.C., Maloney, P.R. 2003, ApJ, 597, 948 * Spergel et al (2007) Spergel, D.N., et al. 2007, ApJS, 170, 377 * Sunyaev and Chluba (2008) Sunyaev, R.A. and Chluba, J. 2008, ASPC 395, 35S * Smoot et al (1992) Smoot,G., et al. 1992, ApJ, 396, 1 * Wakker et al (2008) Wakker, B.P., et al. 2008, ApJ, 672, 298
arxiv-papers
2009-04-16T15:07:23
2024-09-04T02:49:01.908253
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Bi-Zhu Jiang, Richard Lieu, Shuang-Nan Zhang, and Bart Wakker", "submitter": "Bizhu Jiang", "url": "https://arxiv.org/abs/0904.2513" }
0904.2549
# Planetary nebulae and the chemical evolution of the Magellanic Clouds W. J. Maciel 11affiliation: Instituto de Astronomia, Geofísica e Ciências Atmosféricas, Universidade de São Paulo, Brazil. R. D. D. Costa 11affiliationmark: and T. E. P. Idiart11affiliationmark: W. J. Maciel, R. D. D. Costa and T. E. P. Idiart: Instituto de Astronomia, Geofísica e Ciências Atmosféricas, Universidade de São Paulo - Rua do Matão 1226, CEP 05508-900, São Paulo SP, Brazil (maciel@astro.iag.usp.br, roberto@astro.iag.usp.br, thais@astro.iag.usp.br.) ###### Abstract The determination of accurate chemical abundances of planetary nebulae (PN) in different galaxies allows us to obtain important constraints of chemical evolution models for these systems. We have a long term program to derive abundances in the galaxies of the Local Group, particularly the Large and Small Magellanic Clouds. In this work, we present our new results on these objects and discuss their implications in view of recent abundance determinations the literature. In particular, we obtain distance-independent correlations involving He, N, O, Ne, S, and Ar, and compare the results with data from our own Galaxy and other galaxies in the Local Group. As a result of our observational program, we have a large database of PN in the Galaxy and the Magellanic Clouds, so that we can obtain reliable constraints to the nucleosynthesis processes in the progenitor stars in galaxies of different metallicities. ISM: planetary nebulae: general galaxies: Magellanic Clouds galaxies: abundances ## 0.1 Introduction The study of the chemical evolution of the galaxies in the Local Group, particularly the Milky Way and the Magellanic Clouds, can be significantly improved by the consideration of the chemical abundances of planetary nebulae (PN) (see for example Maciel et al. 2006a, Richer & McCall 2006, Buzzoni et al. 2006, and Ciardullo 2006). These objects are produced by low and intermediate mass stars, with main sequence masses roughly between 0.8 and 8$\,M_{\odot}$, and present a reasonably large age and metallicity spread. As a conclusion, they provide important constraints to the chemical evolution models applied to these systems, and can also be used to test nucleosynthetic processes in the PN progenitor stars. In particular, the PN abundances in the nearby Magellanic Clouds can be derived with a high acuracy, comparable to the objects in the Milky Way, so that they can be especially useful in the study of the chemical evolution of these galaxies. In this work, we present some recent results on the determination of chemical abundances from PN in the Large and Small Magellanic Clouds derived by our group, and compare these results with recent data from our own Galaxy and other galaxies in the Local Group. We also take advantage of the inclusion of similar determinations from the recent literature, so that the database of PN in the Magellanic Clouds is considerably increased, allowing a better determination of observational constraints of the nucleosynthetic processes ocurring in the progenitor stars. Preliminary results of this work have been presented by Maciel, Costa & Idiart (2006a, 2008). ## 0.2 The Sample We have considered a sample of PN both in the LMC and SMC on the basis of observations secured at the 1.6m LNA telescope located in southeast Brazil and the ESO 1.5m telescope in La Silla, Chile. Details of the observations and the resulting abundances can be found in the following references: de Freitas Pacheco et al. (1993a, 1993b), Costa et al. (2000), and Idiart et al. (2007). In these papers, abundances of He, N, O, S, Ne and Ar have been determined for 23 nebulae in the LMC and 46 objects in the SMC. The abundances presented in Idiart et al. (2007) were based on average fluxes obtained by taking into account some recent results from the literature, so that there may be some differences compared with our originally derived values. For details the reader is referred to the discussion in that paper. In order to increase the PN database in the Magellanic Clouds, we have also taken into account the samples by Stasińska et al. (1998), which included abundances of He, N, O, and Ne for 61 nebulae in the SMC and 139 objects in the LMC, and Leisy & Dennefeld (2006), containing 37 objects in the SMC and 120 nebulae in the LMC. In Stasińska et al. (1998), a collection was obtained of photometric and spectroscopic data of PN in five different galaxies, including the Magellanic Clouds. Although the original sources of the data are rather heterogeneous, the plasma diagnostics and determination of the chemical abundances were processed in the same way, so that the degree of homogeneity of the data was considerably increased. The Leisy & Dennefeld (2006) sample is a more homogeneous one, in which a larger fraction of the observations were made by the authors themselves, and all abundances were re-derived in an homogeneous way, as in Stasińska et al. (1998). As we will show in the next section, the similarity of the methods in the abundance determinations warrants comparable abundances, so that a larger sample was obtained. ## 0.3 Results and discussion ### 0.3.1 Average abundances Average abundances of all elements in the SMC and LMC according to the three samples considered are shown in Table 1. Helium abundances are given as He/H by number as usual, while for the heavier elements the quantity given is $\epsilon({\rm X})=\log{\rm X/H}+12$. Although the samples considered here are probably the largest ones with carefullly derived abundances in the Magellanic Clouds, they cannot be considered as complete. The total number of PN in these systems is not known, but recent estimates point to about 130 and 980 objects for the SMC and LMC, respectively (cf. Jacoby 2006 and Shaw 2006). Therefore, incompleteness effects may still affect the results presented in this paper. The He abundances show a good agreement in all samples within the average uncertainties. The IAG and Leisy samples show a slightly higer He abundance in the LMC compared to the SMC, but the differences between these objects are in all cases smaller than the estimated uncertainties. The O/H abundances, which are in general the best determined of all heavy elements considered here, also show a good agreement among the samples. Moreover, in all cases the LMC is richer than the SMC, as expected, and the average metallicity difference is in the range 0.3 to 0.5 dex, which is consistent with the metallicities given by Stanghellini (2008), namely $Z=0.004$ and $Z=0.008$ for the SMC and LMC, respectively. The Ar/H and Ne/H ratios show a similar behaviour as O/H, noticing that the IAG data do not include Ne abundances for the LMC, and that Stasińska et al. (1998) do not list Ar/H abundances for both galaxies. The sulfur abundances seem to be less reliable, as can be seen from the large standard deviations obtained in the IAG and Leisy & Dennefeld samples. Moreover, the estimated average S/H ratio in the SMC is slightly larger than in the LMC according to the IAG data, contrary to our expectations, while in the Leisy & Dennefeld sample the LMC abundance is larger by only 0.27 dex in comparison with the SMC. In fact, these characteristics of the sulfur abundances in Magellanic Cloud PN can be observed in previous analyses, as for example in the summary by Kwok (2000, Table 19.1, p. 202), where the S/H ratios in the SMC and LMC are indistinguishable within the given uncertainties. Clearly, the determination of S/H abundances in the Magellanic Cloud PN - and galactic nebulae as well - is apparently affected by some additional effects, as compared to the previous elements. In the following we will give further evidences on the problem of sulfur abundances in planetary nebulae. From Table 1, it can be seen that the nitrogen abundances also follow the same pattern as O/H, Ar/H, and Ne/H, even though the N/H ratio is affected by the dredge-up episodes occuring in the PN progenitor stars. This is further discussed in Section 5, but from the results shown in the last column of Table 1, it is suggested that the average nitrogen contamination from the PN progenitor stars is small. Average N/H abundances of of Magellanic Cloud PN are given by Stanghellini (2008), where an effort was made to take into account objects of different morphologies. The average N/H abundances in the whole sample are $1.48\times 10^{-4}$ and $0.29\times 10^{-4}$ for the LMC and SMC, respectively, which correspond to $\epsilon({\rm N})=8.17$ and 7.46, in the notation of Table 1. These results correctly indicate that the LMC is richer in N than the SMC, as also reported in Table 1, and the absolute value of the SMC abundances given by Stanghellini (2008) is very similar to the results of the 3 samples considered here, but the average abundance for the LMC nebulae is much higher than our results. In fact, the N/H abundances of the LMC given in Stanghellini (2008) are close to the Milky Way values, which is paradoxical, as the LMC has a much lower metallcity than the Galaxy. Part of the discrepancy may be caused by the fact that the sample used in that paper includes a larger proportion of bipolar nebulae, which are ejected by higher mass progenitor stars, which produce a larger nitrogen contamination than the lower mass objects. This problem needs further clarification. -2cm-2cm Table 1: Average abundances of PN in the Magellanic Clouds. | He | O | S | Ar | N | Ne ---|---|---|---|---|---|--- IAG/USP | | | | | | SMC | $0.097\pm 0.035$ | $7.89\pm 0.44$ | $6.98\pm 0.58$ | $5.59\pm 0.36$ | $7.35\pm 0.49$ | $7.14\pm 0.42$ LMC | $0.119\pm 0.023$ | $8.40\pm 0.20$ | $6.72\pm 0.31$ | $6.01\pm 0.25$ | $7.69\pm 0.50$ | — Stasińska | | | | | | SMC | $0.094\pm 0.025$ | $7.74\pm 0.50$ | — | — | $7.46\pm 0.37$ | $7.10\pm 0.40$ LMC | $0.090\pm 0.032$ | $8.10\pm 0.31$ | — | — | $7.76\pm 0.45$ | $7.44\pm 0.41$ Leisy | | | | | | SMC | $0.093\pm 0.025$ | $8.01\pm 0.29$ | $6.86\pm 0.67$ | $5.57\pm 0.27$ | $7.39\pm 0.47$ | $7.14\pm 0.36$ LMC | $0.105\pm 0.035$ | $8.26\pm 0.35$ | $7.13\pm 0.67$ | $5.99\pm 0.26$ | $7.77\pm 0.57$ | $7.46\pm 0.48$ Orion | $0.098\pm 0.004$ | $8.55\pm 0.07$ | $7.02\pm 0.10$ | $6.52\pm 0.18$ | $7.78\pm 0.12$ | $7.82\pm 0.16$ Sun | $0.092\pm 0.009$ | $8.80\pm 0.11$ | $7.26\pm 0.08$ | $6.48\pm 0.11$ | $7.97\pm 0.07$ | $8.08\pm 0.01$ 30 Dor | $0.087\pm 0.001$ | $8.33\pm 0.02$ | $6.84\pm 0.10$ | $6.09\pm 0.10$ | $7.05\pm 0.08$ | $7.65\pm 0.06$ NGC 346 | — | $8.15$ | $6.40$ | $5.82$ | $6.81$ | $7.32$ ### 0.3.2 Abundances of individual nebulae Figure 1: Abundances of O/H (solid dots), N/H (empty triangles) and Ne/H (empty circles) from the sample by Stasińska et al. (1998) as a function of data from the IAG/USP group for the SMC. Figure 2: The same as Fig. 1 for the LMC. No Ne/H data is available in the IAG sample for this galaxy. Figure 3: Abundances of O/H (solid dots), S/H (stars), Ar/H (crosses), N/H (empty triangles), and Ne/H (empty circles) from the sample by Leisy & Dennefeld (2006) as a function of data from the IAG/USP group for the SMC. Figure 4: The same as Fig. 3 for the LMC. No Ne/H data is available in the IAG sample. In order to illustrate the internal agreement of the three PN samples considered in this work, we present in Figs. 1 and 2 the abundances of O/H (solid dots), N/H (empty triangles) and Ne/H (empty circles) as derived by Stasińska et al. (1998) as a function of the IAG/USP data, for the SMC and LMC nebulae, respectively. The same comparisons are shown in Figs. 3 and 4 taking into account the data by Leisy & Dennefeld (2006), in which case we also include abundances of S/H (stars) and Ar/H data (crosses). An average error bar is included at the lower right corner of the figures. The agreement of both samples with our own data is generally very good, within the average uncertainties of the abundance data, which are about 0.1 to 0.2 dex for the best derived abundances, and of 0.2 to 0.3 for the less accurate element ratios. Some scatter is to be expected, especially taking into account that the abundances of several nebulae are flagged as uncertain (:) by Leisy & Dennefeld (2006). The main discrepancies between the IAG data and the results by Stasińska et al. (1998) occur for a few objects in the SMC, for which our O/H and Ne/H abundances differ by an amount larger than the average uncertainty (cf. Fig. 1), while for the LMC a small group of nebulae have higher N/H abundances as derived by Stasińska et al. (1998) (cf. Fig. 2). Concerning the Leisy & Dennefeld (2006) sample, the main discrepancies are restricted to some S/H data, as can be seen from Figs. 3 and 4. The origin of these discrepancies is not clear, but it should be stressed that the vast majority of the objects in common in the 3 samples have similar results, as illustrated in Figs. 1 to 4. ### 0.3.3 Metallicity differences: the Galaxy and the Magellanic Clouds The PN abundances of the heavy elements O, S, Ne, and Ar as given in Table 1 are expected to reflect the average metallicities of the Magellanic Clouds, which are a few dex lower than in the Milky Way, as these elements are not produced by the PN progenitor stars. This can be confirmed by comparing the PN abundances with the abundances in the Orion Nebula, which can be taken as representative of the present heavy element abundances in the Galaxy. From the compilation by Stasińska (2004), we obtain the abundances given at the end of Table 1. For comparison purposes, the average solar abundances from the same source are also included. For the Orion Nebula and the Sun the uncertainties given are not the intrinsic uncertainties of the data, but the dispersion of the measurements in the recent literature as considered by Stasińska (2004). It can be seen that the Orion Nebula abundances are higher than the Magellanic Clouds PN by about 0.2 to 0.5 dex for the LMC and 0.5 to 0.8 dex for the SMC in the case of oxygen. The average for the Orion Nebula, $\epsilon_{ON}({\rm O})\simeq 8.55$, is also essentially the same as in the galactic PN, $\epsilon_{PN}({\rm O})\simeq 8.65$ (cf. Maciel et al. 2006a). For S, Ne, and Ar a similar comparison is obtained, although the S abundance in the LMC is actually somewhat higher than in the Orion Nebula according to the data by Leisy & Dennefeld (2006). The difference in the abundances is also smaller in the case of nitrogen, which is a clear evidence of the N enhancement in the PN progenitor stars. ### 0.3.4 The metallicity distribution Figure 5: The O/H abundance distribution of the Magellanic Clouds from the IAG/USP data. Figure 6: The same as Fig. 5 for the data by Stasińska et al. (1998). Figure 7: The same as Fig. 5 for the data by Leisy & Dennefeld (2006). The available data on PN in the Magellanic Clouds can be used to infer the metallicity distribution in these systems, on the basis of the derived abundances of O, S, Ne, and Ar. A comparison of the distributions in different systems can be used to infer their average metallicities, with consequences on the star formation rates. As an example, Figs. 5. 6 and 7 show the O/H distribution in the Magellanic Clouds according to the three samples considered in this work. The metallicity difference between the SMC and the LMC can be clearly observed in all samples, amounting to about 0.4 to 0.5 dex in average. The difference is especially well defined in our sample, as shown in Fig. 5. In a comparison with the Milky Way, the galactic disk nebulae extend to a higher metallicity, up to $\epsilon({\rm O})\simeq 9.2$, while the LMC objects reach $\epsilon({\rm O})\simeq 8.8$ and the lowest metallicities in the SMC are about $\epsilon({\rm O})\simeq 7.0$. Concerning the remaining elements that are not affected by the evolution of the PN progenitor stars, the Ar/H abundance distribution has a similar pattern, while the S/H data is less clear, as already mentioned. We will discuss this element in more detail in the next section. For Ne/H we have no IAG data for the LMC, but the larger Leisy & Dennefeld (2006) sample clearly confirms the 0.4 to 0.5 dex difference between the LMC and the SMC. The metallicity distribution of the PN as shown in Figs. 5, 6, and 7 can also be compared with galactic data, both for disk and bulge PN. Cuisinier et al. (2000) considered a sample of 30 bulge nebulae and a compilation containing about 200 disk PN, and concluded that both O/H distributions are similar, peaking around 8.7–8.8 dex, and extending form $\epsilon({\rm O})\simeq 8.0$ to $\epsilon({\rm O})\simeq 9.2$. More recently, Escudero et al. (2004) obtained a similar distribution using a bulge sample twice as large, which extended to about 7.5 dex (see also Costa et al. 2008). According to Figs. 5–7, the O/H distributions are displaced relative to the Milky Way by approximately 0.4 and 0.7 dex towards shorter metallicities for the LMC and SMC, respectively, in good agreement with the results discussed in Section 4.1. ### 0.3.5 Abundance correlations: elements not produced by the progenitor stars Photoionized nebulae, comprising both PN and HII regions, are extremely useful to study chemical abundances in different systems. While HII regions reflect the present chemical composition of star-forming systems, PN is helpful to trace the time evolution of the abundances, especially when an effort is made to establish their age distribution (see for example Maciel et al. 2006b). The elements S, Ar and Ne are probably not produced by the PN progenitor stars, as they are manufactured in the late evolutionary stages of massive stars. Therefore, S, Ar, and Ne abundances as measured in PN should reflect the interstellar composition at the time the progenitor stars were formed. Since in the interstellar medium of star-forming galaxies such as the Magellanic Clouds the production of O and Ne is believed to be dominated by type II supernovae, we may conclude that the original O and Ne abundances are not significantly modified by the stellar progenitors of bright PN. The variation of the ratios S/H, Ar/H and Ne/H with O/H usually show a good positive correlation for all studied systems in the Local Group, with similar slopes close to unity. The main differences lie in the average metallicity of the different galaxies, which can be inferred from the observed metallicity range, as we have seen in the previous section. Fig. 8 shows the Ne/H ratio as a function of O/H for the SMC, while Fig. 9 corresponds to the LMC. In these figures we include the combined samples mentioned in Section 2 as follows: IAG/USP data (filled circles), Stasińska et al. (1998) (empty circles), and Leisy & Dennefeld (2006) (crosses). Average error bars are included at the lower right corner of the figures. It can be seen that the correlation is very good, with a slope in the range 0.8–0.9 in both cases. The Ne/H $\times$ O/H relation is probably the best example provided by PN regarding the nucleosynthesis in massive stars. This correlation is very well defined, as shown in Figs. 8 and 9, and is essentially the same as derived from HII regions in different star forming galaxies of the Local Group, including the Milky Way, and in emission line galaxies as well, as clearly shown by Richer & McCall (2006) and Richer (2006, see also Henry et al. 2006). The Ar/H data shows a similar correlation with O/H, as can be seen from Figs. 10 and 11, but the correlation is poorer, which may be due to the fact that the samples are smaller, since Stasińska et al. (1998) do not present argon data. Again, the main discrepancy lies in the S/H data, as can be seen from Figs. 12 and 13. Although most objects define a positive correlation, which is especially true for the LMC, the dispersion is much larger in the S/H data compared to the previous elements, again suggesting that a problem remains in the interpretation of the S/H abundances in planetary nebulae. In particular, both the IAG/USP and Leisy & Dennefeld data suggest a scattering diagram on the S/H $\times$ O/H plane for the SMC, with an average abundance around $\epsilon({\rm S/H})=\log({\rm S/H})+12\simeq 7.0$. A weaker correlation involving sulfur is to be expected, since the diagnostic lines for this element are weaker than e.g. for oxygen or neon. However, the real situation may be more complex, so that a more detailed discussion is appropriate. Figure 8: Distance-independent correlation of Ne/H $\times$ O/H for the SMC. Filled circles: IAG/USP data; empty circles: Stasińska et al. (1998); crosses: Leisy & Dennefeld 2006). Figure 9: The same as Fig. 8, for the LMC. No IAG/USP data is available for this object. Figure 10: Distance-independent correlation of Ar/H $\times$ O/H for the SMC. Symbols are as in Fig. 8. Figure 11: The same as Fig. 10, for the LMC. Figure 12: Distance-independent correlation of S/H $\times$ O/H for the SMC. Symbols are as in Fig. 8. Figure 13: The same as Fig. 12, for the LMC. Figure 14: Comparison of the Spitzer results by Bernard- Salas et al. (2008) and the IAG/USP sample. circles: SMC, Ne/H data; triangles: SMC, S/H abundances; crosses: LMC, S/H data. A hint on the problem of the sulfur abundances in PN can be obtained by comparing our S/H abundances with the recent determinations by Bernard-Salas et al. (2008), who have presented Ne/H and S/H abundances for 25 PN in the Magellanic Clouds using Spitzer data. These results have been obtained on the basis of high-resolution spectroscopic observations in the infrared, and are in principle more accurate compared with the abundances of our present sample, since the uncertainties in the electron temperatures do not affect the infrared lines, the interstellar extinction effects are smaller, and the use of the often uncertain ionization correction factors is greatly reduced (cf. Bernard-Salas et al. 2008). A comparison of the Ne/H and S/H abundances from this source and those by the IAG/USP group is shown in Fig. 14, where the adopted uncertainties are also shown. There are eleven objects in common, which is a small but representative sample. In the figure, the circles refer to Ne/H and the triangles for S/H for the SMC, while the crosses are S/H data for PN in the LMC. It can be seen that the Ne/H abundances show a very good agreement with the infrared data, while for S/H there is a tedency for our values to be larger than those by Bernard-Salas et al. (2008). Although the differences are not very large except for a few nebulae, it may be suggested that the S/H data presented here should be considered as upper limits. Inspecting Figs. 12 and 13, that would be expected especially for those nebulae having lower oxygen abundances, which would explain the scatter diagram observed in Fig. 12. In Bernard-Salas et al. (2008), a similar comparison of the Spitzer S/H abundances with data by Leisy & Dennefeld (2006) was presented, and it was shown that the latter are also systematically larger than the infrared results. This was interpreted by Bernard-Salas et al. (2008) as the ionization correction factors used by Leisy & Dennefeld (2006) overestimated the contribution of the S+3 ion to the total sulfur abundances. In fact, several of the S/H values for Magellanic Cloud PN in Leisy & Dennefeld (2006) are flagged as upper limits. While commenting on the large dispersion of their $\log{\rm S/H}\ \times\log{\rm O/H}$ plot, the authors stress that the sulfur abundances are affected by several problems, such as the lack of [SIV] or [SIII] lines, blending with oxygen lines, and innacuracies in the adopted electron temperatures. By considering only the nebulae for which the sulfur data is more reliable, Leisy & Dennefeld (2006) obtain a somewhat reduced dispersion on the $\log{\rm S/H}\ \times\log{\rm O/H}$ plane, but it is still concluded that the sulfur abundances are not good metallicity indicators for Magellanic Cloud planetary nebulae. A discussion of the sulfur abundance problem in PN was recently given by Henry et al. (2004, 2006). These authors identified a so-called “sulfur anomaly”, or the lack of agreement of the S/H ratio in PN with corresponding data from HII regions and other objects. From an analysis of the abundances in Milky Way planetary nebulae, HII regions and blue compact galaxies, it was suggested that the origin of the “sulfur anomaly” is probably linked to the presence of S+3 ions, which would affect the total sulfur abundances, at least in some nebulae. According to this view, the abundances of at least some of the galactic PN are underestimated, in the sense that the measured S/H ratio is lower than expected on the basis of the derived O/H abundances. If this explanation is valid for Magellanic Cloud PN, it would probably affect those objects with higher O/H ratios, so it is an alternative to the previous suggestion based on the comparison of optical abundances with infrared data. However, other factors may play a role, such as the weakness of the sulfur lines, the assumptions leading to the ionization correction factors, etc., so that this problem deserves further investigation. ### 0.3.6 Abundance correlations: elements produced by the progenitor stars Considering now the elements that are produced during the evolution of the PN progenitor stars, namely, He and N, Figs. 15 and 16 show the derived correlations of N/H and O/H for the SMC and LMC, respectively. As expected, a positive correlation is observed, which is especially evident in the case of the LMC, but the dispersion of the data is larger than in the case of Ne and Ar. This is due to the fact that the PN display both the original N present at the formation of the star and the contamination that is dredged up at the AGB branch of the stellar evolution. In other words, the N/H ratio measured in PN shows some contamination, or enrichment, in comparison with the original abundances in the progenitor star. Figure 15: Distance-independent correlation of N/H $\times$ O/H for the SMC. Symbols are as in Fig. 8. Figure 16: The same as Fig. 15, for the LMC. Figure 17: Distance-independent correlation of N/H $\times$ He/H for the SMC. Symbols are as in Fig. 8. Figure 18: The same as Fig. 17, for the LMC. Figure 19: Distance-independent correlation of N/O $\times$ He/H for the SMC. Symbols are as in Fig. 8. Figure 20: The same as Fig. 19, for the LMC. Figure 21: Distance-independent correlation of N/O $\times$ O/H for the SMC. Symbols are as in Fig. 8. Figure 22: The same as Fig. 21, for the LMC. An estimate of the nitrogen enrichment from the PN progenitor stars can be made by comparing the average N/H abundances of Table 1 with those of HII regions. The Orion value given in the table is similar to the PN abundances for the 3 samples considered, but HII regions in the lower metallicity Magellanic Clouds have accordingly lower nitrogen abundances. As an example, for 30 Doradus, the brightest HII region in the LMC, Peimbert (2003) estimates $\epsilon({\rm N})=7.05$ based on echelle spectrophotometry, assuming no temperature fluctuations ($t^{2}=0.00$). Comparing this result with the data of Table 1, an average enrichment of about 0.6–0.7 dex is obtained for the N/H ratio. Concerning HII regions in the SMC, Relaño et al. (2002) estimate $\epsilon({\rm N})=6.81$ for NGC 346 on the basis of photoionization models, which implies an enrichment of 0.5–0.6 dex for the PN samples listed in Table 1. These enrichment factors may be affected by the chemical evolution of the host galaxy, which includes the average increase of the metallicity as the galaxy evolves, but it is interesting that similar factors are obtained both for the LMC and SMC. The quoted values for 30 Dor and NGC 346 are included at the bottom of Table 1, as representative of HII in the Magellanic Clouds. Figs. 17 and 18 show the N/H abundances as a function of the He/H ratio, while Figs. 19 and 20 are the corresponding plots for N/O as a function of He/H. As pointed out in the literature (cf. Kwok 2000), these ratios present enhancements relative to the average interstellar values. The dispersion is again large, but a positive correlation can also be observed, as expected, since the same processes that increase the nitrogen abundances in PN also affect the He/H ratio. A plot similar to Figs. 19 and 20 was presented by Shaw (2006), in an effort to separate PN of different morphologies. In the LMC, some objects in the sample by Stasińska et al. (1998) have very low He abundances while the N/O ratio is normal, suggesting that neutral helium may be present in these objects. As pointed out by Maciel et al. (2006a), the N/O $\times$ He/H ratios in the Magellanic Clouds support the correlation observed in the Milky Way, but the N/O ratio is comparatively lower. The O/H ratio corresponding to the SMC is also lower, which can be interpreted as an evidence that the lower metallicity environment in the SMC leads to a smaller fraction of Type I PN, which are formed by the more massive stars in the Intermediate Mass Star bracket (cf. Stanghellini et al. 2003). Finally, Figs. 21 and 22 show the N/O ratios as a function of the O/H abundances. The conversion of oxygen into nitrogen by the ON cycling in the PN progenitor stars has been suggested in the literature as an explanation for the anticorrelation between N/O and O/H in planetary nebulae (cf. Costa et al. 2000, Stasińska et al. 1998, Perinotto et al. 2006). This relation is approximately valid on the basis of PN data in several galaxies of the Local Group, as discussed by Richer & McCall (2006). From Figs. 21 and 22, we conclude that the Magellanic Cloud data support such anticorrelation, particularly in the case of the SMC. As discussed by Maciel et al. (2006a) the Milky Way data define a mild anticorrelation, especially in the case of $\epsilon({\rm O})=\log({\rm O/H})+12>8.0$, which is better defined by the SMC/LMC. Acknowledgements. This work was partly supported by FAPESP and CNPq. ## References * Bernard-Salas et al. (2008) Bernard-Salas, J., Pottasch, S. R., Gutenkunst, S., Morris, P. W., & Houck, J. R. 2008, ApJ, 672, 274 * Buzzoni et al. (2006) Buzzoni, A., Arnaboldi, M., & Corradi, R. L. M. 2006, MNRAS, 368, 877 * Ciardullo (2006) Ciardullo, R. 2006, In: IAU Symposium 234, Eds. M. J. Barlow, R. H. Méndez. (Cambridge: Cambridge University Press), 325 * Costa et al. (2000) Costa, R. D. D., de Freitas Pacheco, J. A., & Idiart, T. E. P. 2000, A&AS, 145, 467 * Costa et al. (2008) Costa, R. D. D., Maciel, W. J., & Escudero, A. V. 2008, Baltic Astron. (in press) * Cuisinier et al. (2000) Cuisinier, F., Maciel, W. J., Köppen, J., Acker, A., & Stenholm, B., 2000, A&A, 353, 543 * Escudero et al. (2004) Escudero, A. V., Costa, R. D. D., & Maciel, W. J., 2004, A&A, 414, 211 * de Freitas Pacheco et al. (1993a) de Freitas Pacheco, J. A., Barbuy, B., Costa, R. D. D., & Idiart, T. E. P. 1993, A&A, 271, 429 * de Freitas Pacheco et al. (1993b) de Freitas Pacheco, J. A., Costa, R. D. D., & Maciel, W. J. 1993, A&A, 279, 567 * Henry et al. (2004) Henry, R. B., Kwitter, K. B., & Balick, B. 2004, AJ, 127, 2284 * Henry et al. (2006) Henry, R. B., Skinner, J. N., Kwitter, K. B., & Milingo, J. B. 2006, In: IAU Symposium 234, Eds. M. J. Barlow, R. H. Méndez. (Cambridge: Cambridge University Press), 417 * Idiart et al. (2007) Idiart, T. P., Maciel, W. J., & Costa, R. D. D. 2007, A&A, 472, 101 * Jacoby (2006) Jacoby, G. H. 2006, In: Planetary nebulae beyond the Milky Way, ed. L. Stanghellini, J. R. Walsh, & N. G. Douglas. (Heidelberg: Springer), 17 * Kwok (2000) Kwok, S. 2000, The origin and evolution of planetary nebulae. (Cambridge: Cambridge University Press) * Leisy & Dennefeld (2006) Leisy, P., & Dennefeld, M. 2006, A&A, 456, 451 * Maciel et al. (2006a) Maciel, W. J., Costa, R. D. D., & Idiart, T. E. P. 2006a, In: Planetary nebulae beyond the Milky Way, ed. L. Stanghellini, J. R. Walsh, & N. G. Douglas. (Heidelberg: Springer), 209 * Maciel et al. (2006b) Maciel, W. J., Lago, L. G., & Costa, R. D. D., 2006b, A&A, 453, 587 * Maciel et al. (2008) Maciel, W. J., Costa, R. D. D., & Idiart, T. E. P. 2008, In: IAU Symp. 256, The Magellanic Clouds: stars, gas, and galaxies, Eds. J. Th. van Loon, J. M. Oliveira, (electronic publication) * Peimbert (2003) Peimbert, A., 2003, ApJ, 584, 735 * Perinotto et al. (2006) Perinotto, M., Magrini, L., Mampaso, A., & Corradi, R. L. M. T. E. P. 2006, In: Planetary nebulae beyond the Milky Way, ed. L. Stanghellini, J. R. Walsh, & N. G. Douglas. (Heidelberg: Springer), 232 * Relaño et al. (2002) Relaño, M., Peimbert, M., & Beckman, J., 2002, ApJ, 564, 704 * Richer (2006) Richer, M. G. 2006, In: IAU Symposium 234, Eds. M. J. Barlow, R. H. Méndez. (Cambridge: Cambridge University Press), 317 * Richer & McCall (2006) Richer, M. G., & McCall, M. 2006, In: Planetary nebulae beyond the Milky Way, ed. L. Stanghellini, J. R. Walsh, & N. G. Douglas. (Heidelberg: Springer), 220 * Shaw (2006) Shaw, R. A. 2006, In: IAU Symposium 234, Eds. M. J. Barlow, R. H. Méndez. (Cambridge: Cambridge University Press), 305 * Stanghellini (2008) Stanghellini, L. 2008, In: IAU Symposium 256, The Magellanic Clouds: stars, gas, and galaxies, ed. J. van Loon, J. M. Oliveira (Cambridge: Cambridge University Press), in press [astro-ph: 0810.4167] * Stanghellini et al. (2003) Stanghellini, L., Shaw, R. A., Balick, B., Mutchler, M., Blades, J. C., & Villaver, E. 2006, ApJ, 596, 1014 * Stasińska (2004) Stasińska, G. 2004, In: Cosmochemistry: The melting pot of the elements, XIII Canary Islands Winter School of Astrophysics, ed. C. Esteban, R. J. García López, A. Herrero, F. Sánchez (Cambridge: Cambridge University Press), 115 * Stasińska et al. (1998) Stasińska, G., Richer, M. G., & McCall, M. 1998, A&A, 336, 667
arxiv-papers
2009-04-16T17:42:07
2024-09-04T02:49:01.915346
{ "license": "Public Domain", "authors": "W. J. Maciel, R. D. D. Costa, T. E. P. Idiart", "submitter": "Walter J. Maciel", "url": "https://arxiv.org/abs/0904.2549" }
0904.2718
11institutetext: Osservatorio Astronomico di Padova, INAF, vicolo dell’Osservatorio 5, I-35122 Padova, Italy 11email: marco.gullieuszik@oapd.inaf.it,enrico.held@oapd.inaf.it 22institutetext: European Southern Observatory, Casilla 19001, Santiago 19, Chile 22email: isaviane@eso.org 33institutetext: Joint Astronomy Centre, 660 N. A’ohoku Place, University Park, Hilo, HI 96720, USA 33email: l.rizzi@jach.hawaii.edu # New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219 M. Gullieuszik 11 E. V. Held 11 I. Saviane 22 L. Rizzi 33 (Received …; accepted …) We present the spectroscopy of red giant stars in the dwarf spheroidal galaxy Leo I, aimed at further constraining its chemical enrichment history. Intermediate-resolution spectroscopy in the Ca ii triplet spectral region was obtained for 54 stars in Leo I using FORS2 at the ESO Very Large Telescope. The equivalent widths of Ca ii triplet lines were used to derive the metallicities of the target stars on the [Fe/H] scale of Carretta & Gratton, as well as on a scale tied to the global metal abundance, [M/H]. The metallicity distribution function for red giant branch (RGB) stars in Leo I is confirmed to be very narrow, with mean value [M/H]$\simeq-1.2$ and dispersion $\sigma_{\rm[M/H]}\simeq 0.2$. By evaluating all contributions to the measurement error, we provide a constraint to the intrinsic metallicity dispersion, $\sigma_{\rm[M/H],0}=0.08$. We find a few metal-poor stars (whose metallicity values depend on the adopted extrapolation of the existing calibrations), but in no case are stars more metal-poor than [Fe/H] $=-2.6$. Our measurements provide a hint of a shallow metallicity gradient of $-0.27$ dex Kpc-1 among Leo I red giants. The gradient disappears if our data are combined with previous spectroscopic datasets in the literature, so that any firm conclusions about its presence must await new data, particularly in the outer regions. By combining the metallicities of the target stars with their photometric data, we provide age estimates and an age-metallicity relation for a subset of red giant stars in Leo I. Our age estimates indicate a rapid initial enrichment, a slowly rising metal abundance –consistent with the narrowness of the metallicity distribution– and an increase of $\sim 0.2$ dex in the last few Gyr. The estimated ages also suggest a radial age gradient in the RGB stellar populations, which agrees with the conclusions of a parallel study of asymptotic giant branch stars in Leo I from near-infrared photometry. Together, these studies provide the first evidence of stellar population gradients in Leo I. ###### Key Words.: Galaxies: dwarf spheroidal – Galaxies: individual (Leo I) – Stars: abundances – Local Group – Galaxies: stellar content ††offprints: M. Gullieuszik Figure 1: Digitized Sky Survey image of the Leo I field, centred at $10^{h}08^{m}28\aas@@fstack{s}1$, $+12\degr 18\arcmin 23\arcsec$ (J2000). Starred symbols mark the 4 metal-poor member stars, the circles are other member stars, squares represent interlopers. ## 1 Introduction A first-order estimate of the distribution of stellar metallicities in resolved galaxies can be obtained from photometry of red giant branch (RGB) stars. However, young metal-rich stars have the same colours as older metal- poor stars, a phenomenon known as “age-metallicity degeneracy”. Although improved photometric metallicity estimates can be obtained by combining optical and near-infrared photometry, with reduced degeneracy effects (Gullieuszik et al. 2007, 2008), the problem is never entirely overcome, and age and metallicity inextricably contribute to the observed colour. More direct measurements of the stellar metallicity distribution function (MDF) are obtained from spectroscopy. The most accurate determinations come from high-resolution abundance analysis which provides information on the relative abundances of chemical elements, and therefore the strongest constraints to the galaxy evolution models (e.g. Tolstoy et al. 2003; Lanfranchi & Matteucci 2007). High-resolution spectroscopy, however, is limited to the brightest stars in nearby dwarf galaxies, and becomes unfeasible for more distant galaxies even within the Local Group and using 10m-class telescopes. A viable alternative for obtaining metallicities for a large number of stars (as needed to derive statistically significant stellar MDFs) is using low- or intermediate-resolution spectroscopy. The infrared Ca triplet (CaT) method, originally devised to measure metallicities of stars in Galactic globular clusters (Armandroff & Zinn 1988; Armandroff & Da Costa 1991; Rutledge et al. 1997b), has now been applied quite extensively to RGB stars in dwarf galaxies. Using this method, values of [Fe/H] for dwarf galaxies have been obtained for Fornax (Tolstoy et al. 2001; Pont et al. 2004; Battaglia et al. 2006), Carina (Koch et al. 2006), Sculptor (Tolstoy et al. 2001), Leo II (Bosler et al. 2007; Koch et al. 2007a), NGC 6822 (Tolstoy et al. 2001) and the LMC (Cole et al. 2005). In this paper we present new CaT spectroscopy for the dwarf spheroidal (dSph) galaxy Leo I. Leo I is known to have formed the bulk of its stars at an intermediate epoch (e.g., Gallart et al. 1999). Along with Leo II, Leo I is one the most distant dSph satellites of the Milky Way, for which the influence of tidal interaction with our Galaxy on evolution must have been more limited than for nearby galaxies such as Carina or Fornax. As such, deriving its chemical enrichment history is of foremost importance for our knowledge of the evolution of dSph galaxies. Gallart et al. (1999) derived the metallicity and reconstructed the star-formation history (SFH) of Leo I from HST/WFPC2 data – they found a metallicity ranging from [Fe/H] $=-1.4$ to [Fe/H] $=-2.3$. Using the same data set, Dolphin (2002) found higher metallicity, ranging from [Fe/H] $=-0.8$ to [Fe/H] $=-1.2$. From the colour of RGB stars, Held et al. (2000) derived a mean metallicity [Fe/H] $\sim-1.6$ on the Zinn & West (1984) scale. The metallicity distribution of RGB stars in Leo I has recently been investigated by Bosler et al. (2007) and Koch et al. (2007b). Bosler et al. (2007) used the CaT method to analyse Keck-LRIS spectra of 102 RGB stars, and found ${\rm[Fe/H]}=-1.34$ on the [Fe/H] scale of Carretta & Gratton (1997) (hereafter, CG97). The authors also proposed a new calibration based on Ca abundance, yielding a mean metallicity $\text{[Ca/H]}=-1.34$ ($\sigma=0.21$). Also using measurements of the Ca ii triplet lines, Koch et al. (2007b) found a mean metallicity [Fe/H] $=-1.31$ on the CG97 scale for 58 red giants. In both studies, the MDF is well described by a Gaussian function with a 1$\sigma$ width of 0.25 dex, and a full range in [Fe/H] of approximately 1 dex. Leo I is an interesting target also because, to date, it is one of the few Local Group dwarf galaxies showing scarce evidence of a population gradient. Held et al. (2000) found that the old horizontal branch stars of Leo I are radially distributed as the intermediate-age helium-burning stars; Koch et al. (2007b) found no significant metallicity radial gradient. Different conclusions were found in our companion paper, based on near-infrared photometry (Held et al. 2009), showing that intermediate-age asymptotic giant branch (AGB) stars are more concentrated in the central region than old RGB stars. A new, independent data set of metallicities for Leo I stars, also based on the CaT method, was obtained by us at the ESO VLT using high signal-to-noise FORS2 spectra. The new sample has negligible overlap with the previous data sets, thus effectively increasing the number of Leo I stars with direct metallicity measurements. Using the new data, this paper provides an independent determination of the MDF of Leo I and further constraints on its evolution, based on an analysis of metallicity and age gradients and the age- metallicity relation. ## 2 Observations and reduction ### 2.1 Target selection Our targets were selected from the colour-magnitude diagram (CMD) of Leo I. For the central region of the galaxy, we relied upon $B$,$V$-band photometry from Held et al. (2000), obtained with the EMMI instrument at the NTT telescope at the ESO La Silla Observatory. For the stars in the outer regions, we used the $BV$ photometry originally obtained for a study of RR Lyrae variable stars in Leo I (Held et al. 2001), based on observations carried out with the Wide Field Imager at the 2.2m ESO-MPI telescope. The spectroscopic targets were selected among the brightest RGB stars of Leo I, down to 1 mag below the RGB tip. We avoided any colour constraints that might bias the age/metallicity distribution. After mask design (for which we were guided only by geometric constraints) we were left with 61 targets in 4 masks. The identifiers, coordinates, and $BV$ photometry of the stars in our final sample (excluding a few targets with too low S/N ratio to allow any measurements) are listed in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219, and the targets are shown in Fig. 1. The location of the target stars in the CMD of Leo I is shown in Fig. 2. Figure 2: Target stars in the colour-magnitude diagram of Leo I. The filled squares represent red giant stars in Leo I, the diamonds are the 4 metal-poor red giant members, while crosses mark non-members. ### 2.2 Observations Table 2: Log of the observations. Field | Night | $t_{\text{exp}}$ (sec) ---|---|--- NGC 4590 | 6 | May | 2002 | $15+60$ NGC 5927 | 6 | May | 2002 | $60+300$ NGC 6171 | 6 | May | 2002 | $10+60$ NCG 5904 | 3 | May | 2003 | $60+300$ NGC 6397 | 5 | May | 2003 | $60+300$ NGC 6528 | 5 | May | 2003 | $60+300$ NGC 4372 | 24 | May | 2003 | $60+300$ NGC 6752 | 24 | May | 2003 | $60+300$ Leo I field U | 4 | May | 2003 | $2\times 2870$ Leo I field R | 20,21 | Dec | 2003 | $2\times 2870$ Leo I field D | 22 | May | 2003 | $2\times 2870$ Leo I field L | 16,25 | Jun | 2003 | $2\times 2870$ The observations were carried out in service mode in two runs between May 2002 and December 2003 using FORS2, the multi-mode optical instrument mounted on the Cassegrain focus of the Yepun (VLT-UT4) 8.2m telescope at the ESO Paranal Observatory. We used FORS2 in MXU mode with the 1028z+29 grism and the OG590+32 order-blocking filter. With this setup, the spectral coverage is approximately 7700 Å to 9500 Å, with a dispersion 0.85 Å pixel-1. The selected targets were observed with 4 masks using $0\aas@@fstack{\prime\prime}80$ slits. For each Leo I mask, two spectra were taken. The observing log and exposure times are given in Table 2. We observed also RGB stars in 8 Galactic globular clusters (GCs) in a wide range of metallicity with the same instrumental setup in order to calibrate our measurements onto a known metallicity scale. Two different exposure times were used (long and short exposure) to prevent saturation of the brightest RGB stars. The photometry of the GC stars was taken from the data compilation of Rutledge et al. (1997b). Figure 3: Examples of normalised, background-subtracted spectra of RGB stars in Leo I (stars #17, #19, #54, from top to bottom). The spectra are shown on a rest-frame wavelength scale and vertically shifted for clarity. ### 2.3 Data Reduction The basic reduction of multi-object spectra was performed using standard procedures in IRAF 111 IRAF is distributed by the National Optical Astronomy Observatory, which is operated by the Association of Universities for Research in Astronomy (AURA) under cooperative agreement with the National Science Foundation.. Bias and flat-field corrections were applied to all images using the ccdproc task. Due to the long exposure times, the scientific frames for Leo I contain a large number of cosmic ray hits. These were effectively cleaned using the IRAF program lacos (van Dokkum 2001) on the bias-subtracted, flat-fielded images. The multi-object spectra were extracted with the apall task and wavelength calibrated using HeNeAr lamp exposures taken at the end of each night. The two spectra taken for each Leo I target were combined to increase the S/N ratio. However, we also retained the two individual spectra to estimate the uncertainties in the wavelength calibration and line strengths. Finally, the continuum was normalised in the region between 8400 Å and 8800 Å, by excluding in the process the Ca ii and other relatively strong absorption lines. Typical sky-subtracted spectra of three Leo I stars with different metallicities are shown in Fig. 3. The average signal-to-noise ratio per pixel was calculated from the rms of the combined spectra in two wavelength windows free from strong spectral features, 8580–8620 Å and 8710–8750 Å. The values were checked against those measured on the raw spectra, and found to be consistent within a few percent. The S/N ratio, listed in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219, is $\gtrsim 20$ for all stars in our sample, with a mean value of $\sim 50$. ## 3 Radial velocities and membership Figure 4: Heliocentric radial velocities of stars in the Leo I field. The distribution is fitted with a Gaussian centred at 271 km s-1and with dispersion 13.7 km s-1. The vertical dashed lines represents the $3\sigma$ limits used to select members of Leo I. Radial velocities were measured for target stars to establish their membership. Only the two reddest lines were used to this purpose, since the bluest line of the Ca triplet is weak and, for the systemic velocity of Leo I, overlapping with a strong sky line. The line wavelengths were obtained from the central values $\lambda_{m}$ of the fitted profile (see Eq. 1 below), and compared with the laboratory air wavelengths 8542.09 Å and 8662.14 Å. A radial velocity was measured for each individual spectrum of each star by combining the measurements of the two lines $\lambda_{8542}$ and $\lambda_{8662}$. Then, the radial velocity was calculated as the mean of the two values independently measured from the single spectra. The results, corrected to heliocentric velocities using the rvcorr task, are given in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219. The distribution of radial velocities, shown in Fig. 4, is well fitted by a Gaussian function centred at 271 km s-1 with a dispersion 13.7 km s-1. All but three stars have heliocentric radial velocities within $3\sigma$ of the peak, and therefore are considered members of Leo I (members have ID $<100$ in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219). Radial velocity errors (given in Col. 7 of Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219) were estimated by calculating the differences between radial velocities measured on the two individual spectra. The distribution of the differences is approximately Gaussian with a mean $-6.4$ km s-1 and dispersion 10.4 km s-1. The mean velocity difference provides a good estimate of the mask-to-mask systematic errors, which include wavelength calibration errors and the centring errors of the targets on the slitlets, while the standard deviation represents a combination of random errors. We assume $\sigma_{v}=\sigma_{v_{1}-v_{2}}/\sqrt{2}=7.4$ km s-1 as a good approximation to the standard error of the radial velocity measured on the combined spectrum. Therefore our systemic radial velocity of Leo I is 271 $\pm\,6.4$ (systematic) $\pm\,7.4$ (random) km s-1. Our error estimates are consistent with the 0.85 Å pixel-1 spectral resolution provided by our instrumental setup, which corresponds to a resolution in radial velocity of $\leavevmode\nobreak\ \sim 30$ km s-1pixel-1 in the CaT wavelength range. Koch et al. (2007b) measured 284.2 km s-1 with a velocity dispersion of 9.9 km s-1, while $282.6\pm 9.8$ km s-1 was the value measured by Bosler et al. (2007). Most recently, Mateo et al. (2008) obtained a mean heliocentric velocity $282.9\pm 0.5$ km s-1 and a dispersion $9.2\pm 0.4$ km s-1 from echelle spectroscopy of 328 Leo I members. The systematic difference of $\sim 10$ km s-1 between our mean velocity estimate and previous results is consistent with pointing errors. In the CaT wavelength range, a velocity of 10 km s-1 corresponds to a shift of $\sim 1/3$ pixel on the detector (see above), or $0\aas@@fstack{\prime\prime}08$ on the sky. ## 4 Equivalent widths and metallicity ### 4.1 Equivalent width measurements Figure 5: Upper panel: correlation between two independent EW measurements on individual spectra of Leo I stars. The dashed lines show the $3\sigma$ interval. Lower panel: histogram of the differences between the two measurements, fitted by a Gaussian profile with $\sigma_{\Delta\Sigma W}=0.44$ Å. We measured the equivalent widths (EWs) of CaT lines in the spectra of target stars in Leo I and the calibrating GCs as follows. We first normalised the spectra over a wavelength interval encompassing, for each line, the side bands defined by Armandroff & Da Costa (1991). Equivalent widths were then measured for the two stronger CaT lines in the co-added spectra by fitting a model profile over the line central bandpasses as defined by the same authors. Following Cole et al. (2004), the fitted model is the sum of a Gaussian and a Lorentzian profiles with a common line centre $\lambda_{m}$, $F(\lambda)=1-A_{G}\exp\left[-\frac{(\lambda-\lambda_{m})^{2}}{2\sigma^{2}}\right]\\\ -A_{L}\left[\frac{(\lambda-\lambda_{m})^{2}}{\Gamma^{2}}+1\right]^{-1}$ (1) with the best-fit parameters determined using a Levenberg-Marquardt least- squares algorithm (coded in an idl procedure by C. Markwardt222 http://cow.physics.wisc.edu/$\sim$craigm/idl/idl.html). The Ca ii line strength was then defined as the unweighted sum of the two equivalent widths, $\Sigma W=EW_{8542}+EW_{8662}$ (2) The sum equivalent widths are given in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219 for the red giants in Leo I and in Table 4 for the RGB stars in the template GCs. To estimate the equivalent width measurement errors, we also measured the CaT line strengths independently on the individual spectra of each star in Leo I. A comparison of the two $\Sigma W$ measurements is shown in Fig. 5, where they appear to be well correlated. The histogram of the differences $\Delta_{\Sigma W}=(\Sigma W_{2}-\Sigma W_{1})$ (shown in Fig. 5, lower panel) is well fitted by a Gaussian function centred at $\langle\Delta_{\Sigma W}\rangle=0.03$ and with a standard deviation $\sigma_{\Delta\Sigma W}=0.44$ Å. Since the two individual spectra have comparable $S/N$ ratio, we adopt $\sigma_{\Sigma W}=\sigma_{\Delta\Sigma W}/\sqrt{2}=0.31$ Å as our error estimate for $\Sigma W$ measured on the combined spectrum. For comparison, the half-range $\epsilon\,_{\Sigma W}=\left|\Delta_{\Sigma W}/2\right|$ is listed for each Leo I star in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219. Table 4: Observed stars in template globular clusters. Cluster | ID | $V$ | $B-V$ | $\Sigma W$(Å) ---|---|---|---|--- M 5 | II-45 | 14.75 | 0.82 | 4.62 | II-50 | 13.92 | 0.96 | 5.12 | II-51 | 14.05 | 0.96 | 4.90 | II-80 | 14.31 | 0.91 | 4.89 | II-74 | 13.82 | 1.01 | 5.05 | I-2 | 13.87 | 1.02 | 5.24 | I-50 | 13.91 | 0.97 | 5.06 | I-61 | 13.37 | 1.17 | 5.40 | I-68 | 12.37 | 1.52 | 6.25 | I-71 | 13.01 | 1.29 | 5.57 NGC 4372 | 20 | 12.88 | 1.57 | 3.78 | 14 | 14.29 | 1.29 | 2.88 | 13 | 12.72 | 1.73 | 4.13 | 10 | 13.82 | 1.29 | 3.00 | 95 | 14.48 | 1.30 | 2.72 | 91 | 14.45 | 1.33 | 2.81 | 89 | 14.49 | 1.29 | 2.83 | 141 | 12.93 | 1.65 | 4.01 | 74 | 14.17 | 1.40 | 3.09 | 76 | 14.18 | 1.30 | 3.16 | 77 | 14.19 | 1.28 | 3.07 NGC 6171 | 62 | 13.97 | 1.62 | 5.83 | 100 | 14.21 | 1.40 | 5.50 | I | 13.89 | 1.46 | 5.66 | F | 13.39 | 1.70 | 6.21 NGC 6397 | 328 | 12.07 | 0.93 | 3.19 | 326 | 12.78 | 0.89 | 2.89 | 337 | 12.58 | 0.90 | 2.83 | 343 | 11.42 | 1.13 | 3.34 | 361 | 11.67 | 1.08 | 3.18 NGC 6528 | R2-8 | 15.79 | 1.89 | 6.80 | R1-42 | 16.46 | 1.62 | 6.34 | R2-41 | 16.30 | 1.64 | 6.44 NGC 6752 | 4 | 13.70 | 0.85 | 3.86 | 8 | 11.96 | 1.05 | 4.99 | 28 | 13.17 | 0.89 | 4.18 | 29 | 11.79 | 1.17 | 4.98 | 30 | 12.15 | 1.12 | 4.83 NGC 5927 | 133 | 14.75 | 1.97 | 6.45 | 372 | 14.66 | 2.11 | 6.28 | 335 | 14.44 | 1.94 | 6.63 | 190 | 14.29 | 2.02 | 6.71 | 65 | 14.64 | 1.92 | 6.58 NGC 4590 | 144 | 12.80 | 1.29 | 3.72 | 239 | 14.19 | 0.87 | 2.88 | II72 | 15.03 | 0.85 | 2.60 | 30 | 14.15 | 0.87 | 2.64 | 74 | 14.59 | 0.84 | 2.36 | 119 | 13.62 | 0.95 | 2.90 Notes. The IDs, magnitudes, and colours of stars are those given in the original photometry papers quoted by Rutledge et al. (1997a). Figure 6: The sum of the equivalent widths of the two most reliable CaT lines plotted as a function of the magnitude difference from the HB level. The calibration globular clusters are represented by open symbols (coded with different colours in the electronic edition of the journal). The metallicity of the clusters increases from the bottom to the top (see Table 5). The straight lines are best fits to the EWs for each cluster, assuming a common best-fit slope. Filled squares refer to Leo I RGB stars. ### 4.2 Reduced EW According to the CaT method (Armandroff & Da Costa 1991), the gravity and $T_{\rm eff}$ dependence of CaT lines is accounted for by introducing a linear correction to the line strengths which depends on the star’s luminosity, that is $W^{\prime}=\Sigma W+\beta(V-V_{\text{HB}})$ (3) where $\beta$ is a constant and $(V-V_{\text{HB}})$ is the difference between the magnitude of the star and the horizontal branch (HB) in the $V$ band. In globular clusters, this reduced equivalent width $W^{\prime}$ was found to be well correlated with metallicity (Armandroff & Zinn 1988; Armandroff & Da Costa 1991; Rutledge et al. 1997b). This provides the empirical basis for the validity of the CaT method. Applied to composite stellar populations, the method is less straightforward and has been widely discussed in the recent literature. We will return to this point later on. In Fig. 6, we plot the sum of equivalent widths $\Sigma W$ versus $V-V_{{\rm HB}}$ for all stars with good S/N spectra, both in Leo I and the template GCs. The magnitude of the HB (of old stars) in Leo I, $V_{{\rm HB}}=22.60$, is from Held et al. (2001), while for the template GCs, $V_{\text{HB}}$ was taken from Rutledge et al. (1997a) (listed in Table 5 together with clusters’ metallicities). For all the globular clusters, our CaT line strengths define clean, well separated linear sequences generally consistent with a constant slope and having different, metallicity-dependent zero points. In this diagram, the Leo I stars show quite a large dispersion, although most of them are located between the sequences of NGC 6397 and M 5. This spread in CaT line strengths is real, being larger than the typical measurement error $\sigma_{\Sigma W}\approx 0.3$ Å. By assuming a common slope and lumping together the data for all globular clusters, we derived a slope $\beta=0.627\pm 0.021$. This value can only be compared with previous results that use the same definition of $\Sigma W$. This is the case for Tolstoy et al. (2001), who found $\beta=0.64\pm 0.02$, in agreement with our result. ### 4.3 Metallicity calibration Table 5: Parameters for the calibration Galactic globular clusters. Cluster | [Fe/H]ZW | [Fe/H]CG | [M/H] | $V_{\text{HB}}$ ---|---|---|---|--- NGC 6528 | $-0.23$ | $-0.10$ | $-0.03$ | 17.10 NGC 5927 | $-0.31$ | $-0.46$ | $-0.37$ | 16.60 NGC 6171 (M107) | $-0.99$ | $-0.87$ | $-0.70$ | 15.70 NGC 5904 (M 5) | $-1.40$ | $-1.11$ | $-0.90$ | 15.06 NGC 6752 | $-1.54$ | $-1.42$ | $-1.21$ | 13.70 NGC 6397 | $-1.91$ | $-1.82$ | $-1.65$ | 12.87 NGC 4372 | $-2.08$ | $-1.94$ | $-1.74$ | 15.30 NGC 4590 (M68) | $-2.09$ | $-1.99$ | $-1.81$ | 15.68 Table 6: Metallicity calibrations. Type | Calibration ---|--- quadratic | [Fe/H]${}^{\text{Z}W}$ = | $0.088\,{W^{\prime}}^{2}$ | $-0.184\,W^{\prime}$ | $-2.079$ | [Fe/H]${}^{\text{C}G}$ = | $0.072\,{W^{\prime}}^{2}$ | $-0.076\,W^{\prime}$ | $-2.122$ | [M/H] = | $0.051\,{W^{\prime}}^{2}$ | $+0.056\,W^{\prime}$ | $-2.125$ linear | [Fe/H]${}^{\text{Z}W}$ = | | $0.359\,W^{\prime}$ | $-2.845$ | [Fe/H]${}^{\text{C}G}$ = | | $0.391\,W^{\prime}$ | $-2.806$ | [M/H] = | | $0.395\,W^{\prime}$ | $-2.628$ Figure 7: The metallicity of the reference globular clusters against the reduced EW of CaT lines, for three adopted metallicity scales. The solid lines are quadratic fits, while the dashed straight lines are linear fits obtained for clusters with [Fe/H]$<-0.6$. Using our reduced CaT equivalent widths $W^{\prime}$ and the published metallicities for the Galactic globular clusters, we re-determined the calibration relations between $W^{\prime}$ and metallicity on 3 different abundance scales: the ${\rm[Fe/H]}$ scales of Zinn & West (1984) and Carretta & Gratton (1997) and the global metallicity ${\rm[M/H]}$, as defined by Salaris et al. (1993). The metallicities of the GCs (Table 5) were taken from Ferraro et al. (1999), except for the metal-rich cluster NGC 6528, for which the more recent results of Zoccali et al. (2004) were adopted (${\rm[Fe/H]}=-0.1$, ${\rm[}\alpha\rm{/Fe]}=0.1$). The global metallicity of NGC 6528 (${\rm[M/H]}=-0.03$) was calculated using the relation from Salaris et al. (1993): $\begin{split}{\rm[M/H]}=&{\rm[Fe/H]}+\log(0.683f_{\alpha}+0.362)\\\ \log f_{\alpha}=&{\rm[}\alpha\rm{/Fe]}\end{split}$ (4) Figure 7 shows the $W^{\prime}$-metallicity relations for the three scales, along with quadratic fits to the whole dataset and linear fits to the metal- poor and intermediate globular clusters. The quadratic relations provide a better fit to the GC metallicities over the whole metallicity range of template GCs. The curvature is driven by the data for two most metal-rich globular clusters, consistently with a fall in sensitivity of the Ca ii index at high metallicity. Previous studies which included metal-rich GCs also found quadratic relations (Armandroff & Da Costa 1991; Da Costa & Armandroff 1995; Carretta et al. 2001; Bosler et al. 2007). Linear relations have been proposed by other studies (most recently, Cole et al. 2004; Koch et al. 2007b; Carrera et al. 2007) using metal-rich open clusters to constrain the metal-rich end of the $W^{\prime}$ – [Fe/H] relation. A full discussion of the behaviour of CaT line strengths against metallicity is beyond the scope of this paper, and will be presented in a future paper along with a large dataset of calibrating globular clusters. For our data, a linear relation indeed provides a good fit for stars less metal-rich than the template cluster NGC 6171 ([M/H] $=-0.70$) (Fig. 7). In the case of a metal-poor system such as Leo I, the linear and quadratic relations give similar results except for the most metal-poor stars. Our calibration is presently quite uncertain near the metal-poor end, being based on one globular cluster (NGC 4590). For this cluster, Pritzl et al. (2005) give a lower metallicity ([Fe/H] $\sim-2.3$) than that adopted in Table 5, yielding a better agreement with our linear calibration. The main source of error on [Fe/H] (or [M/H]) is the uncertainty on the measured equivalent width $\Sigma W$, since other sources of error, such as photometric errors for stars on the upper RGB of Leo I, the error on the HB level, or even the uncertainties associated to the fit parameters of the calibration relations, are negligible compared to the $\Sigma W$ measurement errors. A metallicity uncertainty can be computed for each star by error propagation using the values of $\epsilon\,_{\Sigma W}$ in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219 and the calibrations in Table 6. However, a more meaningful metallicity uncertainty is obtained using $\sigma_{W^{\prime}}$ as our estimate of the measurement error. For the quadratic [M/H] calibration in Table 6, $\sigma_{W^{\prime}}=0.31$ Å implies a [M/H] error $\sigma_{\rm err}\simeq 0.14$ dex for stars with [M/H] $=-1.20$. The sources of uncertainty related to the CaT method itself are more difficult to quantify and predict. All traditional calibrations refer to Galactic globular clusters, which are simple and nearly coeval old stellar populations, and the applicability of these calibrations to complex stellar populations is not obvious. In our case, Leo I stars are on average several Gyr younger than those in GCs. At a given luminosity, a star in Leo I has a different mass from a GC star with the same metallicity and $V-V_{\text{HB}}$. However, recent studies have shown that the CaT method can be used for complex stellar populations younger that those in globular clusters (Cole et al. 2004; Pont et al. 2004; Battaglia et al. 2008). Battaglia et al. (2008) have compared a linear metallicity calibration that uses the CaT of RGB stars in two dSph (Sculptor and Fornax) with spectroscopic [Fe/H] values obtained from their high-resolution studies. The metallicities are in good agreement, although with some residual trends of about 0.1–0.2 dex, in the range $-2.5<\text{[Fe/H]}<-0.8$. These studies conclude that for ages older than 2.5 Gyr, the CaT line strengths are little affected by age, and suggest that the overall uncertainty related to age effects is $<0.2$ dex. ### 4.4 A new metallicity scale? Figure 8: Metallicity distribution of Leo I stars using a linear (left panels) or quadratic (right panels) calibration relation. In the upper panels we plot the MDF obtained with the [M/H] calibration. The metallicity distributions on the [Fe/H] scale of Carretta & Gratton (1997) are shown in the lower panels, together with previous results from Bosler et al. (2007) and Koch et al. (2007b). Most CaT metallicity measurements in nearby galaxies use a [Fe/H] scale based on observations of Galactic globular clusters (e.g. Pont et al. 2004; Cole et al. 2004; Battaglia et al. 2006; Koch et al. 2006). However, the relative abundances of $\alpha$-elements (including Ca) in Local Group dwarfs are on average lower than in the Milky Way halo stars and GCs (Shetrone et al. 2001, 2003; Tolstoy et al. 2003; Geisler et al. 2005; Pritzl et al. 2005). To overcome this problem, Bosler et al. (2007) proposed a new calibration of CaT lines against the [Ca/H] abundance, based on high-resolution spectroscopy of Galactic star clusters. In their hypothesis, the [Ca/H] calibration is less affected by the difference in [Ca/Fe] abundance ratios between red giant stars in globular clusters and dwarf spheroidal galaxies. However, the strength of CaT lines is also determined by other parameters (gravity and $T_{\rm eff}$) in addition to Ca abundance. A comparison of Ca abundances derived from CaT lines with the results of high-resolution abundance measurements for stars in two dSph galaxies (Battaglia et al. 2008) shows that, while the CaT lines trace both Ca and Fe, their dependence on Fe abundance is stronger. Similarly, [Ca/H] ratios derived from CaT lines for stars in Leo II dSph and globular clusters (Shetrone et al. 2009) systematically differ from those obtained from mid-resolution synthetic spectra, with a residual trend that is a function of metallicity. Since the effective temperature of red giants in globular clusters is driven by their global metallicity [M/H] (Salaris et al. 1993), an empirical metallicity ranking based on CaT and a global metallicity [M/H] scale, proposed here for the first time, appears to be the most empirically sound. In fact, [M/H] (or, equivalently, $Z$) takes into account the abundances of both the $\alpha$-elements and Fe. Our data are therefore calibrated using the [M/H] calibration in addition to the common [Fe/H] scales. ### 4.5 A concluding remark We conclude this section with a consideration that ought to be kept in mind throughout all the following discussion. While we give the metallicity of the stars in three flavours ([Fe/H]ZW, [Fe/H]CG, and [M/H]), this does not imply that we are determining the three metallicity parameters at the same time. The only observable quantity is the reduced equivalent width $W^{\prime}$. The calibration of $W^{\prime}$ in terms of metallicity relies on the assumption that $W^{\prime}$ is correlated with metallicity, i.e. a star in Leo I has the same metallicity as a star in a GC with the same $W^{\prime}$. The key questions are: what are the real drivers that determine the strength of the CaT lines? Do two stars with the same iron-to-hydrogen ratio but different $\alpha$-elements composition have the same $W^{\prime}$? Some of these effects have been discussed by Battaglia et al. (2008), and are further addressed by a large observational program by our group whose results will be presented in future papers. ## 5 The metallicity of Leo I stars ### 5.1 The observed metallicity distribution Table 7: Mean metallicity and standard deviation of red giants in Leo I. Scale | fit | mean | $\sigma$ ---|---|---|--- ${\rm[Fe/H]}^{\rm ZW}$ | linear | $-1.53$ | $0.17$ | quadratic | $-1.55$ | $0.21$ ${\rm[Fe/H]}^{\rm CG}$ | linear | $-1.37$ | $0.18$ | quadratic | $-1.41$ | $0.21$ ${\rm[M/H]}$ | linear | $-1.18$ | $0.19$ | quadratic | $-1.22$ | $0.20$ In Fig. 8 we show the metallicity distribution of Leo I red giant stars as derived from our data using both the [Fe/H] metallicity scale of Carretta & Gratton (1997) and the [M/H] scale. The parameters of the distribution (mean and standard deviation, excluding the 4 most metal-poor stars in Fig. 8) are given in Table 7 for both scales, along with the results on the Zinn & West (1984) scale for ease of comparison with previous literature. The metallicities of individual Leo I stars are listed in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219. Using the CG97 scale, the distribution is centred at [Fe/H] $\simeq-1.4$ with a standard deviation $\sigma_{{\rm[Fe/H]}}\simeq 0.2$. For the [M/H] calibration, the average is [M/H] $\simeq-1.2$ with the same scatter. The results obtained from the linear and quadratic calibrations are very similar in all cases, as expected since most of the Leo I stars have metallicities lower than ${\rm[Fe/H]}=-1.0$. The choice of the linear or quadratic relation only affects the metallicity of 4 metal-poor stars, having [M/H]$\lesssim-2$. In this range, the calibration is extrapolated beyond the most metal-poor globular cluster, which makes the metallicity of the 4 stars quite uncertain and dependent on the adopted calibration. In the case of the CG97 calibration, which yields the lowest extrapolated values, the 4 stars have $-2.6<{\rm[Fe/H]}<-2.2$. Visual inspection of the targets on a Leo I image indicates normal star-like profiles (i.e. no blends). We therefore conclude that, while a few stars may have low metallicity, there is so far no evidence of extremely metal-poor stars in Leo I. Spectral synthesis methods (see, e.g., Kirby et al. 2008) will be used in a future paper to obtain more secure metallicity estimates for these metal-poor stars from a different spectral interval. Our determination of the metallicity of Leo I agrees well with the results of Bosler et al. (2007) (${\rm[Fe/H]}=-1.34$) and Koch et al. (2007b) ([Fe/H] $=-1.31$), in particular when a linear calibration is used as in the previous papers. On the other hand, our [M/H] values are in better agreement with the [Ca/H] results of Bosler et al. (2007). Using 9 stars in common with Bosler et al. (2007) and 5 stars in common with Koch et al. (2007b), we compared the metallicities star-by-star. The mean differences are $\Delta{\rm[Fe/H]}^{\rm CG}=-0.04\pm 0.14$ (rms of the sample) and $\Delta{\rm[Fe/H]}^{\rm CG}=-0.17\pm 0.11$, respectively, in agreement with the shifts between the mean values of the MDFs. The rms values are consistent with our measurement error (see next section). ### 5.2 Intrinsic metallicity dispersion and clues on the evolution of Leo I The observed MDF in Fig. 8 is the convolution of the intrinsic metallicity distribution of stars in Leo I and the measurement errors. The real abundance spread can be estimated by adopting a Gaussian model for the intrinsic MDF, which yields $\sigma_{\text{OBS}}^{2}=\sigma_{0}^{2}+\sigma_{\text{err}}^{2}$, where $\sigma_{\text{OBS}}$ is the observed metallicity dispersion, $\sigma_{0}$ is the intrinsic dispersion, and $\sigma_{\text{err}}$ is the measurement error. If we adopt a quadratic [M/H] calibration and a typical measurement error $\sigma_{\rm err}\simeq 0.14$ dex, the measurement scatter largely contributes to the observed metallicity dispersion. The observed scatter implies an intrinsic metallicity dispersion $\sigma_{{\rm[Fe/H]},0}=0.14$ for the CG97 scale and $\sigma_{{\rm[M/H]},0}=0.08$ for [M/H]. The intrinsic abundance dispersion of Leo I stars is therefore very small, even smaller than previously thought, and this happens in spite of the relatively wide range of ages of the stellar populations. This is an important constraint to the chemical evolution across the life of the galaxy. Figure 9: The MDF of Leo I RGB stars on the [M/H] metallicity scale, compared with a simple model with a low effective yield (dashed line) and a model with a prompt initial enrichment (solid line). In order to model the metallicity distribution and the chemical evolution of Leo I, detailed models have to be put forth (such as those of Lanfranchi & Matteucci 2007) properly taking into account the chemical and dynamical evolution of the galaxy. However, some order-of-magnitude physical insight on the evolution of Leo Ican already be obtained using basic considerations. The metallicity distribution of RGB stars in Leo I is compared in Fig. 9 with a simple closed-box model with a low effective yield consistent with a continuous loss of gas (e.g., Pagel 1997). In order to reproduce the peak of the observed MDF, we have to adopt an effective yield $y=0.025Z_{\odot}$, and $y=0.040Z_{\odot}$, for the distributions based on the [Fe/H] and [M/H] metallicity scales, respectively. This is clearly much lower than the value found in the solar vicinity ($y=1.2Z_{\odot}$; e.g. Portinari et al. 2004), in a way consistent with the loss of metals driven by a galactic wind (Hartwick 1976; Pagel 1997). Still, even allowing for a gas outflow, the number of metal-poor stars is largely overestimated by the simple model, as shown in Fig. 9. The fit is considerably improved by assuming a prompt early enrichment with an initial metallicity $Z_{0}=0.02\,Z_{\odot}$ (${\rm[Fe/H]}=-1.7$) (continuous line in Fig. 9). Although very simplistic, this conclusion agrees with the finding that the metal-poor tail of the MDF in 4 Local Group dwarf spheroidal galaxies (Helmi et al. 2006) is significantly different from that of the Galactic halo, lacking stars below [Fe/H] $=-3$. What this “toy model” tells us is that the narrow MDF of the Leo I stars can be understood as a combination of fast enrichment from an initial generation of stars, and subsequent loss of metals through outflows. This situation is common among Local Group dwarfs, but the MDF of Leo I is the narrowest observed to date (cf. Tolstoy et al. 2001; Pont et al. 2004; Koch et al. 2006, 2007a). ### 5.3 Radial metallicity gradients Figure 10: Metallicities of Leo I stars on the [Fe/H] scale of CG97, plotted against the elliptical radius (see text). Filled dots: data in this paper; open squares: data from Bosler et al. (2007); open triangles: Koch et al. (2007b); circles with error bars: our data, binned in 1$\aas@@fstack{\prime}$5 bins. The error bars of the binned data represent the abundance scatter ($1\sigma$) in each bin. The crosses are the 4 metal-poor stars in our sample. The typical errors of each study are shown in the upper right corner of the plot. The solid line is a fit to our (binned) data, while the dashed line represents a fit to all available spectroscopic data. Radial variations in the stellar populations are common in the dwarf spheroidals of the Local Group, where the younger and more metal-rich populations are often concentrated toward the galaxy centre (Harbeck et al. 2001; Saviane et al. 2001; Pont et al. 2004; Tolstoy et al. 2004; Koch et al. 2006). Leo I remains one of the few dSph’s showing little evidence of a population gradient (Held et al. 2000; Koch et al. 2007b). In particular, the spectroscopic investigation of Koch et al. (2007b), extending to quite large radial distances, did not detect a significant metallicity gradient. Our new spectroscopic sample of red giants allows us to further search for radial variations in the metallicity of Leo I stars. As the radial coordinate, we have adopted the semi-major axis $r$ of ellipses passing through the projected sky position of each star. The ellipses have the centre at $10^{h}08^{m}28\aas@@fstack{s}1$, $+12\degr 18\arcmin 23\arcsec$ (J2000) and a fixed position angle and ellipticity ($\text{PA}=79^{\circ}$, $\epsilon=0.21$; Irwin & Hatzidimitriou 1995). In Fig. 10, the metallicities of Leo I stars in our sample (see Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219) are plotted against the distance from the centre. To directly compare our data with results from previous studies, we used the metallicity obtained from the calibration in terms of [Fe/H]${}^{\text{CG}}$. Data from Bosler et al. (2007) and Koch et al. (2007b) were shifted to account for the small differences in mean metallicity (of the order 0.1 dex or less) between the MDF’s (Fig. 8). A linear relation was fitted both to our data alone (solid line) and to all available metallicity measurements in the literature (dashed line), excluding stars with [Fe/H] $<-2$. The fit to our new FORS2 data yields a radial gradient of $-0.02$ dex arcmin-1, or $-0.27$ dex Kpc-1. In our sample, stars more metal-rich than [Fe/H] $=-1.3$ are only found in the central region of Leo I, with $a<5\aas@@fstack{\prime}5$. In contrast, the fit to the merged spectroscopic sample suggests a radially constant metallicity, in agreement with the conclusions of Koch et al. (2007b). To quantify the gradient, we have used a Kolmogorov-Smirnov test to compare the metallicity distributions of stars with $1\aas@@fstack{\prime}2<a<5\arcmin$ (inner sample) and $5\arcmin<a<8\aas@@fstack{\prime}2$ (outer sample), considering only the radial interval covered by our data. The two metallicity distributions are similar in shape, with the MDF in the inner region peaked at higher metallicity. The hypothesis that the inner and outer sample are drawn from the same parent population can be rejected at a 90% level using our data, and only at a non-significant 62% level using all spectroscopic data. We conclude that, while our data provide a hint of a weak radial metallicity gradient in Leo I, the statistical significance of this result is at present low. More stars need to be observed, particularly in the outer region of the galaxy, before definite conclusions can be drawn. ## 6 The age of Leo I stars ### 6.1 The age-metallicity relation Figure 11: The age-metallicity relation of Leo I RGB stars in our sample, on the [M/H] scale. The error bars in age represent the first and third quartile of the confidence intervals obtained through Monte Carlo realisations (see text for details). For the metallicity errors the representative value discussed in Sect. 4.3 is adopted. Also shown are the metallicities from high- resolution spectroscopy of two Leo I RGB stars from Tolstoy et al. (2003) (big filled circles). The side histograms are the marginal distributions in metallicity and age. The solid line in the top panel represents the SFH derived by Dolphin (2002) from HST photometry, normalised to the total number of stars in our sample. With the stellar metallicities of Leo I stars known from spectroscopy, ages could be estimated by comparing stars’ locations in the CMD with a grid of theoretical isochrones (the models of Pietrinferni et al. 2004, were used to this purpose). Absolute magnitudes and dereddened colours were computed adopting a colour excess $E_{B-V}=0.04$, a total-to-differential extinction ratio $R_{V}=A_{V}/E_{B-V}=3.1$, and a true distance modulus $(m-M)_{0}=22.04$ (Held et al. 2009). The stellar ages were interpolated in two steps. First, we used a set of theoretical isochrones of fixed age and different metallicities to find, for a star of given age and luminosity, a metallicity-colour relation and (from the known colour) an interpolated metallicity. This step was repeated for all model ages, yielding for each data point in the CMD a set of theoretical age- metallicity pairs each consistent with the star’s magnitude and colour. This age-metallicity look-up table (spanning the full range from old, metal-poor stars to young, metal-rich stars) allowed us to compute an interpolated age for each star from its spectroscopic metallicity. We chose the [M/H] scale for the input value, as the most directly related to the mass fraction of metals ($Z$) used in stellar models. For a number of stars, ages could not be derived because the observed colour and/or magnitude were outside the range covered by the isochrones. The method was checked against Galactic globular clusters with ages given by the literature. In particular, a small correction was applied to the isochrone colours so as to yield a correct age for NGC 5904 (M 5), assumed to be 12 Gyr (Sandquist et al. 1996) and the closest in metallicity to Leo I among the clusters listed in Table 5. Thus, our ages for Leo I stars are essentially referred to M 5, which is in our view the most correct approach given the considerable uncertainties in the isochrone colours. The resulting ages are listed in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219 along with their uncertainties, estimated as follows. For each star, we performed a set of 100 Monte Carlo experiments by randomly varying the input quantities in intervals consistent with their uncertainties. We adopted a standard error 0.02 mag in the $V$ magnitude, 0.05 mag in $(B-V)$ colour, and 0.15 dex in [M/H]. The latter was chosen conservatively large to account for the inherent uncertainties in the metallicity scale. The median and quartiles of the age distributions of randomly generated “stars” corresponding to each observed stars are listed in Table New constraints on the chemical evolution of the dwarf spheroidal galaxy Leo I from VLT spectroscopy ††thanks: Based on data collected at the European Southern Observatory, Paranal, Chile, Proposals No. 69.D-0455 and 71.D-0219. In general, the uncertainties are of the order 50%, which reasonably reflects the large uncertainties in the process. The age-metallicity relation derived from our data is shown in Fig. 11. The chemical evolution of Leo I seems to be very slow, in accord with the narrowness of the MDF. If the 4 metal-poor stars are excluded, there is a trend for stars younger than 5 Gyr to be on average more metal-rich by about 0.2–0.3 dex. Similar conclusions were drawn, from a different data set, by Bosler et al. (2004). The scatter in the age-metallicity relation appears to be smaller than observed in other galaxies (Battaglia et al. 2006; Tolstoy et al. 2003, and references therein). Our data are in agreement with the results from high-resolution spectroscopy for 2 stars (Tolstoy et al. 2003). We can use our age determinations also to obtain a SFH of Leo I. This can be done since our target selection was designed to avoid any bias in age and/or metallicity (see Sect. 2); the age distribution of our target stars is then proportional to the SFH. Our age measures are in agreement with the SFHs derived by HST photometry. In the upper panel of Fig. 11 our age distribution is compared with the Dolphin (2002) SFH, showing only small differences that can be explained by statistical fluctuations. ### 6.2 Radial distribution of stellar ages To complete our analysis of the population gradients, we investigated the possible presence of a radial variation in the age of Leo I stars. Figure 12 shows the ages plotted against the elliptical distance. While old stars are found at all radii, young stars appear to be concentrated at small distances from the centre. To quantify this finding, we have plotted in Fig. 12 the cumulative distributions of two subsamples of stars in the inner ($r<3\aas@@fstack{\prime}9$) and outer ($r>3\aas@@fstack{\prime}9$) region, respectively. This limit was chosen to have the same number of stars in each subsample. A Kolmogorov-Smirnov test indicates that the null hypothesis that the distributions are drawn from the same parent population can be rejected at $>99.9$% confidence level. Similarly, we have plotted the cumulative distributions of two subsamples of stars with age $<4.6$ Gyr and $>4.6$ Gyr. Also in this case, the probability of the null hypothesis can be rejected at a level $>99.9$%. This suggestion of an age gradient among RGB stars is strengthened by the detection of a radial gradient in the fraction of upper-AGB stars in Leo I, which points to a concentration of intermediate-age populations towards the galaxy centre (Held et al. 2009). Figure 12: Ages of the Leo I stars in our sample as a function of the elliptical radius (central panel). The upper panel shows the cumulative radial distributions of stars with ages smaller and larger (dotted line) than 4.6 Gyr. The cumulative age distributions of stars in the inner ($r<3\aas@@fstack{\prime}9$) and outer ($r>3\aas@@fstack{\prime}9$, dotted line) region are shown in the right panel (the different age and radial intervals are colour-coded in the electronic version of the journal). Younger stars appear to be more concentrated towards the centre of Leo I. ## 7 Summary and conclusions We have presented spectroscopic measurements of RGB stars in the Leo I dSph from observations carried out with the FORS2 spectrograph at the ESO VLT. We derived radial velocities for 57 stars with good S/N ratio, 54 of which have been found to be Leo I members. Among these, 14 stars are in common with previous spectroscopic studies. We measured the metallicities of RGB stars in Leo I from the equivalent widths of Ca ii triplet lines, using the [Fe/H] metallicity scales of Carretta & Gratton (1997) and Zinn & West (1984). In addition, we derived a new calibration tied to the [M/H] ranking of Galactic globular clusters, which accounts for the abundance of both Fe-group and $\alpha$ elements. The metallicity distribution (MDF) of Leo I stars is symmetric and very narrow. If we adopt a quadratic calibration of Ca ii line strengths against [Fe/H], the mean metallicity is ${\rm[Fe/H]}=-1.41$ with a measured dispersion $0.21$ dex on the Carretta & Gratton (1997) scale, in agreement with previous spectroscopic studies. The new [M/H] calibration yields a mean value [M/H] $=-1.22$ with a dispersion $0.20$ dex. By subtracting the measurement errors, we estimated a very low intrinsic metallicity dispersion, $\sigma_{\rm[M/H]}=0.08$, which represents a constraint for modelling the chemical evolution of this isolated dwarf galaxy. As pointed out by previous studies, this narrow MDF is inconsistent with a simple “closed-box” chemical evolution model, even adopting a very low effective yield to account for galactic outflows expelling the metals produced by SNe winds. A prompt initial chemical enrichment may explain the very small number of extremely metal poor stars (we find only 4 stars with [Fe/H] $<-2$). Together, the two effects can explain the small abundance dispersion of Leo I stars, which gives the narrowest observed MDF among Local Group dwarf galaxies. However, detailed chemical evolution models (e.g., Lanfranchi & Matteucci 2007) are needed to gain a complete picture of the evolution of Leo I. Our data for RGB stars also provide an indication of a weak radial metallicity gradient in Leo I, of $-0.27$ dex Kpc-1. In fact, all of our stars with [M/H]$>-1.3$ are found in the inner region ($r\lesssim 5^{\prime}$). However, by combining our observations with previous spectroscopic datasets in the literature, the radial variation becomes insignificant. More observations in the outskirt of Leo I with a quality comparable to those presented here, are required to definitively establish the presence of an abundance gradient. The metallicities of the RGB stars in our Leo I sample have been combined with existing photometric data to yield age estimates and an age-metallicity relation. Our age determinations are consistent with the SFH derived by Gallart et al. (1999) and Dolphin (2002) from HST photometry. The age- metallicity relation of Leo I red giants is quite flat, again suggesting a rapid initial enrichment. An increase in metal abundance by $\sim 0.2-0.3$ dex in the last 5 Gyr is possibly related to the main star-formation episode at intermediate ages. Since Leo I only hosts a minor old ($>10$ Gyr) stellar component, the chemical history of the galaxy is not well constrained at early epochs. Its most metal-poor stars must have formed out of a medium pre- enriched by a lost generation of stars, either before or after the galaxy had started assembling. We have provided the first evidence of a radial variation in the ages of red giants in Leo I. Despite the uncertainties in age determination, our direct measurement of a radial variation of stellar ages seems quite convincing, with a Kormogorov-Smirnov test confirming, at a high level of statistical significance, that stars in the inner part of Leo I are on average younger than those in the outer regions. This result agrees with the conclusions of a parallel study of intermediate-age AGB stars in Leo I from near-infrared photometry (Held et al. 2009). In the emerging scenario, the first generation of Leo I stars uniformly formed throughout this isolated dwarf spheroidal galaxy. The bulk of intermediate-age stars originated from an interstellar medium, poorly enriched by previous stellar generations mainly because of the effects of stellar winds. Younger stellar populations preferentially formed in the central regions, from gas somewhat enriched as seen from the age- metallicity relation in the last few Gyr. In this framework, our results on the radial distribution of Leo I stellar populations are not in contrast with previous results which found no gradients. The lack of detection of an age gradient by Held et al. (2000) can be explained considering that the mean age of the red-clump stars used by Held et al. (2000) as tracers of intermediate- age populations, is $\sim 5$ Gyr, which is older than that of upper AGB stars used by Held et al. (2009). As shown in Fig. 12, there are no clear radial variations in the age distribution of Leo I stars with ages greater than $\sim 5$ Gyr. ###### Acknowledgements. We thank A. Koch for providing us with unpublished data. M.G. wishes to thank the European Southern Observatory at Santiago, Chile for partial funding through DGDF and for hospitality during a visit in which this paper was partially written. This research was partially funded by PRIN MIUR 2007 “Galactic astroarchaeology: the local route to cosmology” (P.I. F. Matteucci). ## References * Armandroff & Da Costa (1991) Armandroff, T. E. & Da Costa, G. S. 1991, AJ, 101, 1329 * Armandroff & Zinn (1988) Armandroff, T. E. & Zinn, R. 1988, AJ, 96, 92 * Battaglia et al. (2008) Battaglia, G., Irwin, M., Tolstoy, E., et al. 2008, MNRAS, 383, 183 * Battaglia et al. (2006) Battaglia, G., Tolstoy, E., Helmi, A., et al. 2006, A&A, 459, 423 * Bosler et al. (2004) Bosler, T. L., Smecker-Hane, T. A., Cole, A., & Stetson, P. B. 2004, in Origin and Evolution of the Elements, Carnegie Observatories Astrophysics Series, Vol. 4, ed. McWilliam,A. and Rauch, M., Pasadena * Bosler et al. (2007) Bosler, T. L., Smecker-Hane, T. A., & Stetson, P. B. 2007, MNRAS, 378, 318 * Carrera et al. (2007) Carrera, R., Gallart, C., Pancino, E., & Zinn, R. 2007, AJ, 134, 1298 * Carretta et al. (2001) Carretta, E., Cohen, J. G., Gratton, R. G., & Behr, B. B. 2001, AJ, 122, 1469 * Carretta & Gratton (1997) Carretta, E. & Gratton, R. G. 1997, A&AS, 121, 95 * Cole et al. (2004) Cole, A. A., Smecker-Hane, T. A., Tolstoy, E., Bosler, T. L., & Gallagher, J. S. 2004, MNRAS, 347, 367 * Cole et al. (2005) Cole, A. A., Tolstoy, E., Gallagher, III, J. S., & Smecker-Hane, T. A. 2005, AJ, 129, 1465 * Da Costa & Armandroff (1995) Da Costa, G. S. & Armandroff, T. E. 1995, AJ, 109, 2533 * Dolphin (2002) Dolphin, A. E. 2002, MNRAS, 332, 91 * Ferraro et al. (1999) Ferraro, F. R., Messineo, M., Fusi Pecci, F., et al. 1999, AJ, 118, 1738 * Gallart et al. (1999) Gallart, C., Freedman, W. L., Aparicio, A., Bertelli, G., & Chiosi, C. 1999, AJ, 118, 2245 * Geisler et al. (2005) Geisler, D., Smith, V. V., Wallerstein, G., Gonzalez, G., & Charbonnel, C. 2005, AJ, 129, 1428 * Gullieuszik et al. (2008) Gullieuszik, M., Held, E. V., Rizzi, L., et al. 2008, MNRAS, 388, 1185 * Gullieuszik et al. (2007) Gullieuszik, M., Held, E. V., Rizzi, L., et al. 2007, A&A, 467, 1025 * Harbeck et al. (2001) Harbeck, D., Grebel, E. K., Holtzman, J., et al. 2001, AJ, 122, 3092 * Hartwick (1976) Hartwick, F. D. A. 1976, ApJ, 209, 418 * Held et al. (2001) Held, E. V., Clementini, G., Rizzi, L., et al. 2001, ApJ, 562, L39 * Held et al. (2009) Held, E. V., Gullieuszik, M., Rizzi, L., et al. 2009, MNRAS, to be submitted * Held et al. (2000) Held, E. V., Saviane, I., Momany, Y., & Carraro, G. 2000, ApJ, 530, L85 * Helmi et al. (2006) Helmi, A., Irwin, M. J., Tolstoy, E., et al. 2006, ApJ, 651, L121 * Irwin & Hatzidimitriou (1995) Irwin, M. & Hatzidimitriou, D. 1995, MNRAS, 277, 1354 * Kirby et al. (2008) Kirby, E. N., Guhathakurta, P., & Sneden, C. 2008, ApJ, 682, 1217 * Koch et al. (2007a) Koch, A., Grebel, E. K., Kleyna, J. T., et al. 2007a, AJ, 133, 270 * Koch et al. (2006) Koch, A., Grebel, E. K., Wyse, R. F. G., et al. 2006, AJ, 131, 895 * Koch et al. (2007b) Koch, A., Wilkinson, M. I., Kleyna, J. T., et al. 2007b, ApJ, 657, 241 * Lanfranchi & Matteucci (2007) Lanfranchi, G. A. & Matteucci, F. 2007, A&A, 468, 927 * Mateo et al. (2008) Mateo, M., Olszewski, E. W., & Walker, M. G. 2008, ApJ, 675, 201 * Pagel (1997) Pagel, B. E. J. 1997, Nucleosynthesis and Chemical Evolution of Galaxies (Nucleosynthesis and Chemical Evolution of Galaxies, by Bernard E. J. Pagel, pp. 392. ISBN 0521550610. Cambridge, UK: Cambridge University Press, October 1997.) * Pietrinferni et al. (2004) Pietrinferni, A., Cassisi, S., Salaris, M., & Castelli, F. 2004, ApJ, 612, 168 * Pont et al. (2004) Pont, F., Zinn, R., Gallart, C., Hardy, E., & Winnick, R. 2004, AJ, 127, 840 * Portinari et al. (2004) Portinari, L., Moretti, A., Chiosi, C., & Sommer-Larsen, J. 2004, ApJ, 604, 579 * Pritzl et al. (2005) Pritzl, B. J., Venn, K. A., & Irwin, M. 2005, AJ, 130, 2140 * Rutledge et al. (1997a) Rutledge, G. A., Hesser, J. E., & Stetson, P. B. 1997a, PASP, 109, 907 * Rutledge et al. (1997b) Rutledge, G. A., Hesser, J. E., Stetson, P. B., et al. 1997b, PASP, 109, 883 * Salaris et al. (1993) Salaris, M., Chieffi, A., & Straniero, O. 1993, ApJ, 414, 580 * Sandquist et al. (1996) Sandquist, E. L., Bolte, M., Stetson, P. B., & Hesser, J. E. 1996, ApJ, 470, 910 * Saviane et al. (2001) Saviane, I., Held, E. V., Momany, Y., & Rizzi, L. 2001, Memorie della Societa Astronomica Italiana, 72, 773 * Shetrone et al. (2003) Shetrone, M., Venn, K. A., Tolstoy, E., et al. 2003, AJ, 125, 684 * Shetrone et al. (2001) Shetrone, M. D., Côté, P., & Sargent, W. L. W. 2001, ApJ, 548, 592 * Shetrone et al. (2009) Shetrone, M. D., Siegel, M. H., Cook, D. O., & Bosler, T. 2009, AJ, 137, 62 * Tolstoy et al. (2001) Tolstoy, E., Irwin, M. J., Cole, A. A., et al. 2001, MNRAS, 327, 918 * Tolstoy et al. (2004) Tolstoy, E., Irwin, M. J., Helmi, A., et al. 2004, ApJ, 617, L119 * Tolstoy et al. (2003) Tolstoy, E., Venn, K. A., Shetrone, M., et al. 2003, AJ, 125, 707 * van Dokkum (2001) van Dokkum, P. G. 2001, PASP, 113, 1420 * Zinn & West (1984) Zinn, R. & West, M. J. 1984, ApJS, 55, 45 * Zoccali et al. (2004) Zoccali, M., Barbuy, B., Hill, V., et al. 2004, A&A, 423, 507 Table 1: Spectroscopic sample in the Leo I field. ID | $\alpha$ (J2000) | $\delta$ (J2000) | $B-V$ | $V$ | $v$ | $\Delta v$ | S/N | other ---|---|---|---|---|---|---|---|--- | | | | | km s-1 | km s-1 | | 1 | 10:08:28.43 | +12:15:54.1 | 1.39 | 19.62 | $268.2$ | 1.5 | 57 | 2 | 10:08:16.47 | +12:15:59.5 | 1.48 | 19.59 | $264.5$ | 3.2 | 46 | 3 | 10:08:36.41 | +12:16:02.2 | 1.46 | 19.89 | $261.9$ | 5.7 | 37 | 4 | 10:08:17.58 | +12:16:15.7 | 1.61 | 19.55 | $267.0$ | 0.9 | 42 | 5 | 10:08:19.45 | +12:16:34.1 | 1.10 | 20.28 | $268.6$ | 3.2 | 32 | B8391 6 | 10:08:40.46 | +12:16:38.0 | 1.35 | 19.78 | $273.5$ | 0.4 | 36 | B25113 7 | 10:08:31.00 | +12:16:40.6 | 1.32 | 19.85 | $282.4$ | 3.1 | 58 | B18214 8 | 10:08:03.62 | +12:16:46.4 | 1.50 | 19.74 | $301.0$ | 7.4 | 59 | 9 | 10:08:32.56 | +12:16:54.9 | 1.19 | 20.45 | $290.7$ | 1.5 | 33 | 10 | 10:08:08.79 | +12:17:05.9 | 1.07 | 20.00 | $304.3$ | 2.2 | 90 | 11 | 10:08:10.61 | +12:17:08.0 | 1.20 | 20.05 | $262.2$ | 6.8 | 62 | B4173 12 | 10:08:49.42 | +12:17:14.8 | 1.18 | 20.44 | $281.2$ | 2.5 | 18 | 13 | 10:08:34.90 | +12:17:17.8 | 1.16 | 20.01 | $287.8$ | 6.8 | 38 | 14 | 10:08:39.66 | +12:17:19.9 | 1.37 | 19.68 | $258.4$ | 3.7 | 44 | K195 15 | 10:08:57.38 | +12:17:20.8 | 1.18 | 20.44 | $280.3$ | 6.6 | 34 | K833 16 | 10:08:55.47 | +12:17:21.9 | 1.26 | 20.14 | $274.2$ | 10.9 | 43 | 17 | 10:08:11.82 | +12:17:29.4 | 1.05 | 20.31 | $260.0$ | 0.6 | 51 | 18 | 10:08:29.89 | +12:17:31.7 | 1.30 | 19.67 | $262.8$ | 4.8 | 43 | 19 | 10:08:07.52 | +12:17:34.6 | 1.25 | 20.16 | $269.6$ | 7.4 | 52 | 20 | 10:08:14.21 | +12:17:36.1 | 1.11 | 19.90 | $247.6$ | 32.2 | 67 | B5496 21 | 10:08:15.40 | +12:17:38.3 | 1.43 | 19.48 | $266.1$ | 3.0 | 37 | 22 | 10:08:46.36 | +12:17:41.3 | 1.33 | 20.32 | $261.9$ | 2.9 | 30 | 23 | 10:08:20.50 | +12:17:45.0 | 1.61 | 19.64 | $263.7$ | 0.3 | 50 | 24 | 10:08:06.29 | +12:17:45.3 | 1.28 | 20.16 | $269.9$ | 7.1 | 49 | B3135 25 | 10:08:50.70 | +12:17:46.9 | 1.15 | 20.31 | $270.5$ | 6.7 | 35 | K677 26 | 10:07:55.77 | +12:17:55.2 | 1.14 | 20.48 | $277.3$ | 6.0 | 47 | 27 | 10:08:01.84 | +12:17:56.6 | 1.43 | 19.82 | $275.4$ | 5.4 | 61 | B2488 28 | 10:08:45.25 | +12:17:57.8 | 1.28 | 20.08 | $248.9$ | 5.5 | 52 | 29 | 10:08:38.58 | +12:18:21.0 | 0.94 | 19.71 | $274.5$ | 8.3 | 41 | 30 | 10:08:56.58 | +12:18:22.4 | 1.13 | 20.22 | $271.1$ | 0.3 | 30 | 31 | 10:08:34.85 | +12:18:22.6 | 1.24 | 19.98 | $256.2$ | 0.1 | 47 | 32 | 10:08:15.96 | +12:18:25.3 | 1.17 | 20.25 | $282.9$ | 3.0 | 34 | 33 | 10:07:57.28 | +12:18:26.1 | 1.40 | 19.74 | $284.3$ | 7.5 | 69 | 34 | 10:08:44.09 | +12:18:29.0 | 1.13 | 19.66 | $278.8$ | 9.5 | 42 | 35 | 10:08:47.87 | +12:18:29.9 | 1.46 | 19.70 | $248.8$ | 8.0 | 39 | 36 | 10:08:36.01 | +12:18:32.6 | 1.30 | 19.58 | $254.0$ | 0.6 | 45 | 37 | 10:07:59.36 | +12:18:35.7 | 1.60 | 19.75 | $273.9$ | 6.3 | 54 | 38 | 10:08:58.70 | +12:18:37.1 | 1.44 | 19.85 | $257.2$ | 8.2 | 46 | 39 | 10:08:41.92 | +12:18:39.7 | 1.16 | 20.22 | $250.4$ | 7.8 | 31 | B25820 40 | 10:08:51.73 | +12:18:45.7 | 1.28 | 20.23 | $278.9$ | 3.0 | 49 | 41 | 10:08:20.21 | +12:18:46.6 | 1.41 | 19.62 | $258.0$ | 0.1 | 27 | 42 | 10:08:33.75 | +12:18:47.0 | 1.26 | 19.23 | $275.4$ | 0.0 | 50 | 43 | 10:08:24.22 | +12:18:53.3 | 1.38 | 19.93 | $259.0$ | 2.4 | 42 | 44 | 10:08:40.60 | +12:19:02.8 | 1.25 | 19.66 | $276.9$ | 2.7 | 48 | 45 | 10:08:30.67 | +12:19:30.0 | 1.00 | 20.34 | $259.4$ | 4.6 | 39 | 46 | 10:08:21.15 | +12:19:43.6 | 1.52 | 19.72 | $270.8$ | 1.0 | 35 | 47 | 10:08:39.42 | +12:20:05.9 | 1.16 | 19.74 | $271.2$ | 3.8 | 51 | 48 | 10:08:37.29 | +12:20:12.2 | 1.24 | 19.88 | $270.7$ | 1.3 | 43 | K351 49 | 10:08:13.35 | +12:20:13.8 | 1.27 | 19.64 | $292.2$ | 2.9 | 55 | 50 | 10:08:22.17 | +12:20:14.9 | 1.38 | 19.15 | $289.8$ | 0.9 | 59 | 51 | 10:08:28.41 | +12:20:29.6 | 1.51 | 19.61 | $267.6$ | 2.1 | 64 | K137 52 | 10:08:14.96 | +12:20:43.9 | 1.47 | 19.58 | $266.6$ | 2.9 | 50 | 53 | 10:08:19.17 | +12:20:48.9 | 1.38 | 19.87 | $255.3$ | 2.0 | 38 | B8203 54 | 10:08:18.24 | +12:20:54.6 | 1.27 | 20.02 | $268.0$ | 0.7 | 31 | 101 | 10:07:51.18 | +12:17:36.6 | 1.52 | 19.56 | $49.6$ | 8.5 | 72 | 102 | 10:08:05.23 | +12:18:13.5 | 1.05 | 19.96 | $-27.9$ | 5.5 | 52 | 103 | 10:08:53.43 | +12:18:27.4 | 1.36 | 19.88 | $90.4$ | 8.7 | 55 | Notes. $v$ is the heliocentric radial velocity and $\Delta v$ the absolute semi-difference in radial velocity of the individual spectra. The last column gives the identification of stars in common with Bosler et al. (2007) and Koch et al. (2007b). Table 3: Measurements of metallicity and age for stars in Leo I. Notes. $\epsilon\,_{\Sigma W}$ is the absolute semi-difference of the equivalent widths measured on the individual spectra. The listed metallicity values were calculated from $W^{\prime}$ using the quadratic calibration. The last two columns give the lower and upper confidence intervals of our age estimates (see text for details).
arxiv-papers
2009-04-17T15:00:10
2024-09-04T02:49:01.928270
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "M. Gullieuszik, E. V. Held, I. Saviane and L. Rizzi", "submitter": "Marco Gullieuszik", "url": "https://arxiv.org/abs/0904.2718" }
0904.2769
†† Copyright ©2009 By Author Non Homogeneous Poisson Process Model based Optimal Modular Software Testing using Fault Tolerance Amit K Awasthi and Sanjay Chaudhary Pranveer Singh Institute of Technology, NH-2, Kanpur-Agra Highway, Kanpur, UP, India ###### Abstract In software development process we come across various modules. Which raise the idea of priority of the different modules of a software so that important modules are tested on preference. This approach is desirable because it is not possible to test each module regressively due to time and cost constraints. This paper discusses on some parameters, required to prioritize several modules of a software and provides measure of optimal time and cost for testing based on non homogeneous Poisson process. Keywords: Non Homogeneous Poisson Process, Optimal Test Policy, Software Life Cycle Length, Testing Time, Module Test Prioritization, Fault Tolerance. ## 1 Introduction Whenever a software is developed a question about its reliability comes in front. We need some tool to be sure that software is working properly. That is, there is a need of software testing, to find out any faults that might exist, before releasing the product. For this purpose, software product is tested carefully but regressive testing is not feasible always, as it can be very expensive in form of cost and time both. That s why, a modular testing is a suggestive approach so that the Testing Authority can test the software’s important modules preferably and may save time and cost. It is impractical to test the software till all the bugs are removed, the tester should also be aware of the optimal testing time and cost required to test the modules. We also allow a bit of faults in the accepted range instead of making it 100% error free. For this reason, this paper attempts to provide an optimal boundary values for time and cost considering the actual percentage of faults obtained in testing. A project manager should be familiar with the points where it should stop testing and go for release or rejection. A lot of work has been done in the area of optimal software testing. McDaid and Wilson (2001) gave three plans to settle on the problem of decision - How long to test software? by introducing the optimal time measure [2]. Musa and Ackerman used the concept of reliability to make the decision [3]. Ehrlich, Prasanna, Stampfel and Wu also tried to find out the cost of a stop test decision [4]. But one of the most suitable models for the problem of determining optimal cost and time is proposed by Goel and Okumoto [5]. They gave a non homogeneous Poisson process based model to determine the optimal cost and time for software [6][7]. Praveen et al. enhanced their work by proposing a cumulative priority based elucidation to find out optimal software testing period [8]. In this paper, we consider the new idea of modular approach to test software. We suggest here to assign a weight on each modules depending on various parameters. Hierarchies of the modules also plays an imporatant role in decision as preceder module will always affact their dependent modules. We enhanced previous ideas by adding this hierachical module concept. The next section briefly explains background and related work. Section 3 provides the module prioritization schema based on various factors and our approach to test the software to determine that the software is OK for release or not. Section 4 brings an example where this approach is applied. Last section concludes finally. ## 2 Background and Related Work ### 2.1 Non homogeneous poisson process A Poisson process is one of the most significant random processes in probability theory. It is widely used to model random points in time and space such as the times of radioactive emissions, the arrival times of customers at a service center and the positions of flaws in a piece of material. Several important probability distributions arise naturally from the Poisson process. The Poisson process is a collection of random variables where $N(t)$ is the number of events that have occurred up to time $t$ (starting from time 0) [8]. The number of events between time $a$ and time $b$ is given as $N(b).N(a)$ and has a Poisson distribution. A Non-Homogeneous process is a process with rate parameter $\lambda(t)$ such that the rate parameter of the process is a function of time e.g. the arrival rate of vehicles in a traffic light signal. ### 2.2 Related work by Goel and Okumoto Faults present in the system causes software failure at random times. Let $N(t)$ (where $t>0$) be the cumulative number of failures at time $t$ (either CPU time or calendar time). According to Goel and Okumoto [5], Let $m(t)$ be the expected number of faults detected by time $t$ can be shown as 1: $m(t)=a(1-e^{-bt})$ (1) where, $m(\infty)=a$ so that a represents the expected number of software failures to be eventually encountered and b is the detection rate for an individual fault. According to Goel and Okumoto, the operational performance of a system is to a large extent dependent on testing time. Longer testing phase leads to enhanced performance. Also, cost of fixing a default during operation is generally much more than during testing. However, the time spent in testing delays the product release, which leads to additional costs. The objective is to determine optimal release time to minimize cost by reducing testing time. Goel and Okumoto gave the parameters $c_{1},c_{2},c_{3},t$ and $T$ which are as follows: $c_{1}$ = cost of fixing a fault during testing $c_{2}$ = cost of fixing a fault during operation $(c_{2}>c_{1})$ $c_{3}$ = cost of testing per unit time $t$ = software life cycle length $T$ = software release time (same as testing time) Since $m(t)$ represents the expected number of faults during $(0,t)$ the expected costs of fixing faults during the testing and operational phases are $c_{1}m(T)$ and $c_{2}(m(t)-m(T))$ respectively. Further, the testing cost during a time period $T$ is $c_{3}(T)$. If there is a cost associated with delay in meeting a delivery plan, such a cost could be included in $c_{3}$. Combining the above costs, the total expected cost is given by (2). $C(T)=c_{1}m(T)+c_{2}[m(t)-m(T)]+c_{3}(T)$ (2) This policy minimizes the average cost and depends on the ratio of $a*b$ and $C_{r}=c_{3}/(c_{2}-c_{1})$ (3) Two cases arise, $ab>C_{r}$ and $ab\leq C_{r}$ Case I : If $ab>C_{r}$, the optimal policy is to take $T^{*}=min(T_{0},t)$ (4) where $T_{0}=1/bln(ab/C_{r})$ Case II : If $ab<=C_{r}$, then $T=0$. If the cost of testing or cost of delay in release are very high, the solution favors no testing at all i.e. $T^{*}=0$. On the other hand, if the cost of fixing a fault after release is very high as compared to the usefulness of the system, the solution will tend to favor not using the system i.e. $T^{*}=t$. ### 2.3 Related work by Praveen et al. This paper suggests prioritizing the software modules into 5 categories namely very high, high, medium, low and very low. Then they calculate optimal cost and time similar to Goal and Okumoto work. To find out maximum allowable cost and time stringency concept is used here. Stringency is the maximum allowable deviation from the optimum which is decided by the organization. Then they advise to start testing the software to calculate the actual time and actual cost for each priority category. The deviation from optimal testing time and optimal cost can be calculated from (5) and (6). $\alpha={(T_{a}-T^{*})\over T^{*}}$ (5) Where, $\alpha$ = deviation from optimal time $T_{a}$ = actual testing time $T^{*}$ = optimal testing time calculated from (4), and $\beta={(C_{a}-C_{0})\over C_{0}}$ (6) Where, $\beta$ = deviation from optimal cost $C_{a}$ = actual testing cost $C_{0}$ = optimal testing cost calculated from (2) Limiting factor $\delta$ is given by (7) $\delta=\alpha+\beta$ (7) Afterwards they cumulatively calculate the limiting factor to determine whether further software testing is required. ### 2.4 Related work by Ohba The above discussed models view the software as single unit, regardless of the structural or functional relationship among software subsystems (modules). Based on the concept of redundancy, recovery block techinique [15] and N-version program techinique [14] s-independently produce multiple versions of the software to perform the same function. Most software reliability models assume s-independence of faults. However, Ohba [16] argues that faults are s-dependent because of the logical or functional dependency within a program. Ohba observed an S-shaped software reliability growth curve, as opposed to the exponential growth curve for the s-independence models. The model is characterized by: $m(t)=n.[1-(1+\phi.t).exp(-\phi.t)]$ (8) Unlike most software reliability models that use execution time, the S-shaped model is generally observed when calendar time is used. ### 2.5 Musa-Okumoto Musa & Okumoto [17] proposed a logarithmic Poisson execution-time model where the observed number of failures by time $t$ is NHPP. This model adds a decay parameter, and is characterized by: $m(t)=(1/\theta).\log(\lambda.\theta.t+1)$ (9) ## 3 Proposed Approach ### 3.1 Components Priority To ensure that the component prioritization is uniform and effective, it is imperative to introduce a schema [13]. The following parameters may be helpful to decide the priority of the components. Production Time This is the amount of work carried out by an employee on the project. This parameter keeps the track of total person hours for a module. Module priority will increase as Production time increases. Decision density High complexity may result in bad understandability and more errors. Complex procedures also need more time to develop and test. Therefore, excessive complexity should be avoided. Too complex procedures should be simplified by rewriting or splitting into several procedures. Complexity is often positively correlated to code size. A big program or function is likely to be complex as well. These are not equal, however. A procedure with relatively few lines of code might be far more complex than a long one. We recommend the combined use of lines of code and complexity metrics to detect complex code. The total cyclomatic complexity for a module is calculated as follows. $TCC=Sum(CC)-Count(CC)+1$ (10) Cyclomatic complexity is usually higher in longer procedures. How much decision is there actually, compared to lines of code? This is where you need decision density (also called cyclomatic density). $DD=CC/LLOC$ (11) where LLOC id logical lines of codes. This parameter shows the average decision density of the code lines within the modules. Programming Path This parameter suggest that what environment for coding is used. Costs associated with technology required for the component. What are the importance of current technology for this component. How much experts are available for such technologies. Size of Components How much code had done? Skill of fault reporters/resolvers Source of origin of fault suggested is how much reliable. Errors are reported technically or just by inexperience of user. Actually in our model, we consider that faults are collected using some bug tracking system which is open to customer too. Weight priority This includes the ranking given by developers, managers and customer based on the requirements and previous experiences. It also includes risk factors. Code reusability If an earlier source code can be used in the current work with little or no modifications then we call it code reusability. This lessens the requirements of testing the code again as it has already been tested earlier. Coupling It is the measure of connectedness of one module to another. It is given as- $C=1-\left(k\over{(d_{i}+ac_{i}+d_{o}+bc_{o}+g_{d}+cg_{c}+w+r)}\right)$ (12) Where $C$ = Coupling $d_{i}$ = number of input data parameters $c_{i}$ = number of input control parameters $d_{o}$ = number of output data parameters $c_{o}$ = number of output control parameters $g_{d}$ = number of global variables used as data $g_{c}$ = number of global variables used as control $w$ = number of modules called (fan-out) $r$ = number of modules calling the module under consideration (fan-in) the values of $k$ and $a,b$ and $c$ may be adjusted as more experimental verification occurs [11]. Layout appropriateness For a specific layout (i.e., a specific GUI design), cost can be assigned to each sequence of actions according to the following relationship: $\textrm{cost}=\Sigma[\textrm{frequency of transition}(k)\times\textrm{cost of transition}(k)]$ (13) where $k$ is a specific transition from one layout entity to the next as a specific task is accomplished. Layout appropriateness is defined as $LA=100\times[(\textrm{cost of LA}-\textrm{optimal layout})/(\textrm{cost of proposed layout})]$ (14) where $LA=100$ for an optimal layout. Maintenance $M_{T}$ = the number of modules in the current release $F_{c}$ = the number of modules in the current release that have been changed $F_{a}$ = the number of modules in the current release that have been added $F_{d}$ = the number of modules from the preceding release that were deleted in the current release The software maturity index is computed in the following manner: $SMI=[M_{T}-(F_{a}+F_{c}+F_{d})]/M_{T}$ (15) As $SMI$ approaches 1.0, the product begins to stabilize. SMI may also be used as parameter for planning software maintenance activities. The parameters are not limited as above. Some other parameters may also be used. Even fuzzy parametes may also included. ### 3.2 Weight Parameter for Each Component In our system these parameters are based on neural networks. Assume that $w_{1,ij},~{}(i=1,2,3,...,p;j=1,2,3,...,q;)$ are the weight between $i$-th unit on sensory layer and $j$-th unit on association layer. And, $w_{2,jk},~{}(j=1,2,3,...,q;k=1,2,3,...,r;)$ are the weight between $j$-th unit on association layer and $k$-th unit on response layer. $x_{i}$ represent the normalized input variables to the $i$-th unit on sensory layer and $y_{k}$ represent the output values. We apply normalized values of fault level, fault reporter, etc to input values $x_{i}$. Cosider the logistic activation function, sigmod function $f(x)={1\over{1+e^{-\theta x}}}$ (16) Then the input-out rules of each unit on each layer are $h_{j}=f(\sum_{i=1}^{p}{w_{1,ij}x_{i}})$ (17) $y_{k}=f(\sum_{j=1}^{q}{w_{2,jk}h_{ji}})$ (18) We apply the multi-layered neural networks by propagation in order to learn the interaction among software components [18]. Now as the error in $y_{k}$ may be given as $\epsilon_{k}=\frac{1}{2}\sum_{k=1}^{r}{(y_{k}-d_{k})^{2}})$ (19) where $d_{k}$ are the target input values for the output values. We consider the estimation and prediction model so that the property of interation among software components accumulates on the connection weight of neural networks. Finally, we may obtain the total weight parameter $p_{k}$ which represents the level of importance for each component $p_{k}=\frac{y_{k}}{\sum_{k=1}^{r}{y_{k}}}$ (20) ### 3.3 Our Extension to Goel and Okumoto Scheme In Goel-Okumoto method, $m(t)$ represents the faults during $(0,t)$, the expected costs of fixing faults during the testing and operational phases are $c_{1}m(T)$ and $c_{2}(m(t)-m(T))$ respectively. Further, the testing cost during a time period $T$ is $c_{3}(T)$. If there is a cost associated with delay in meeting a delivery plan, such a cost could be included in $c_{3}$. Here we assume that software developement is in muti-version environemt. During the developement phase of current version some, fault appears in previous version. It is clear that cost to repair that fault goes to previous version’s cost, which we could not include here. But fault appearing in previous version is nearly equivalent to finding fault is current version. The cost for this could not be same as $c_{1}$. We assume this newly associated cost as $c_{4}$. Now if $n(t)$ represents the faults in previous version during $(0,t)$, the expected costs of fixing faults during the testing and operational phases is $c_{4}n(T)$. Thus, total expected cost is now $C(T)=c_{1}m(T)+c_{2}[m(t)-m(T)-n(T)]+c_{3}(T)+c_{4}n(T)$ (21) ### 3.4 Component Importance basis Testing Now, we decide level of priority on the basis of parameter $p_{k}$. In order to resolve tie cases manual decision may be prefered. If some dependent module should be given much more prefernce if its parent module is not tested. After prioritzing the modules, try to find optimum cost and time parameters in very similar way to Goel’s Model. Let $T$ and $C$ be the total time and cost available to release the software. Our aim is to the test all the modules within $T$ and $C$. But if we are not able to do this then at least the components with very high priority must be tested. We set the fault tolerance = 0 for the first time testing of all the components of a particular category (e.g. Very High) and find out actual time and cost for testing. If optimal cost and time parameters $C^{*}$, $T^{*}$ are determined, then we can compute a expected cost as limiting factor $\delta=f(T,T^{*},C,C^{*})$. i.e. $\delta=p\frac{(C-C^{*})}{C^{*}}+(1-p)\frac{(T-T^{*})}{T^{*}}$ (22) where $p$ is odds in in favour of cost. ## References * [1] Onoma, K., W.T. Tsai, M. Poonawala and H. Suganuma, Regression Testing in an Industrial Environment, Comm. ACM, vol. 41, no. 5, pp. 81-86, May 1988. * [2] McDaid, Kevin and Wilson Simon P., Deciding How Long to Test Software, The Statistician, Royal Statistical Society, Part 2, 50, pp. 117-134, 2001. * [3] Musa, J.D. and Ackerman A.F., Quantifying Software Validation: When to Stop Testing, IEEE Software, vol.6, Issue 3, pp. 19-27, May 1989. * [4] Ehrlich W., Prasanna b., Stampfel J. and Wu J., Determining the Cost of a Stop-Test Decision IEEE Software, vol. 10, Issue 2, pp. 33-42, March 1993. * [5] Goel, A.L. and Okumoto K., When to stop testing and start using software, Proc. of ACM, pp. 131-137, 1981. * [6] Goel, A.L. and Okumoto K., A Time Dependent Error Detection Rate Model for Software Performance Assessment with Applications, Proc. National Computer Conference, RADC-TR-80-179, May 1980. * [7] Goel A.L. and Okumoto K., A Time Dependent Error Detection Rate Model for Software Reliability and Other Performance Measures, IEEE Transactions on Reliability, vol. R-28, no. 3, pp. 206-211, August 1979. * [8] Praveen R Srivastava, Deepak Pareek, Kailash Sati, Dinesh C Pujari and G Raghurama, Non Homogenous Poisson Process Based Cumulative Priority Model for Determining Optimal Software Testing Period, ACM SIGSOFT Software Engineering Notes, vol. 33, no. 2, March 2008. * [9] Jones Capers, Applied Software Measurement, McGraw-Hill, New Your, NY, 1991. * [10] Praveen R Srivastava, Krishan Kumar and G. Raghurama, Test Case Prioritization Based on Requirements and Risk Factors, ACM SIGSOFT Software Engineering Notes, vol. 33, no. 4, July 2008. * [11] R. S. pressman, Software Engineering: A Practitioner s Ap-proach, McGraw hill, 6th Edition. 2005. * [12] Praveen R Srivastava, Model for Optimizing Software Testing Period using Non Homogenous Poisson Process based on Cumulative Test Case Prioritization, IEEE TENCON, Hyderabad, India, 18-21 Nov., 2008. * [13] Praveen R Srivastava, Deepak Pareek, Component Prioritization Schema for Achieving Maximum Time and Cost Benefits from Software Testing, IEEE Region 10 Colloquium and the Third ICIIS, Kharagpur, INDIA December 8-10 2008. * [14] A. Avizienis, ”The N-Vesrsion approach to fault tolerant software”, IEEE Tran. Software Engineering, Vol SE-11, pp 1411-1423, 1985. * [15] H. Hecht, ”Fault tolerance software”, IEEE Trans. Reliability, Vol. R-28, pp. 227-232, 1979. * [16] M. Ohba, Software reliability analysis models , ZBM J. Research and Development, vol 28, num 4, pp 428-443, 1984. * [17] J.D. Musa, A. Iannino, K. Okumoto, Software Reliability: Measurement, Prediction, Application, 1987; McGraw-Hill. * [18] E. D., Karnin, A simple procedure for pruning back propagation trained neural networks, IEEE Trans. Neural Networks, 1, pp. 239–242, 1990.
arxiv-papers
2009-04-17T19:40:05
2024-09-04T02:49:01.938932
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Amit K Awasthi and Sanjay Chaudhary", "submitter": "Amit K Awasthi", "url": "https://arxiv.org/abs/0904.2769" }
0904.2770
ITM Probe: analyzing information flow in protein networks Aleksandar Stojmirović and Yi-Kuo Yu***to whom correspondence should be addressed National Center for Biotechnology Information National Library of Medicine National Institutes of Health Bethesda, MD 20894 United States #### Summary: Founded upon diffusion with damping, ITM Probe is an application for modelling information flow in protein interaction networks without prior restriction to the sub-network of interest. Given a context consisting of desired origins and destinations of information, ITM Probe returns the set of most relevant proteins with weights and a graphical representation of the corresponding sub- network. With a click, the user may send the resulting protein list for enrichment analysis to facilitate hypothesis formation or confirmation. #### Availability: ITM Probe web service and documentation can be found at www.ncbi.nlm.nih.gov/CBBresearch/qmbp/mn/itm_probe #### Contact: yyu@ncbi.nlm.nih.gov ## 1 Introduction Protein interaction networks are presently under intensive research (Bader et al., 2008). Recently, a number of authors have applied the concept of random walk (with truncation) to extract biologically relevant information from protein interaction networks (Nabieva et al., 2005; Tu et al., 2006; Suthram et al., 2008). These approaches, however, do not model information loss/leakage that naturally occurs in all networks. For example, in cellular networks, proteases constantly degrade proteins, diminishing the strength of information propagation. We have recently developed a mathematical framework to model information flow in interaction networks with a novel ingredient, damping/aging of information (Stojmirović and Yu, 2007). Implementing the theory, we have constructed a web application ITM Probe, which also contains a new model of information propagation: information channel. ITM Probe models information flow in a protein interaction network through discrete random walks. Unlike classical random walks, our model allows the walker a certain probability to _dissipate_ or _damp_ (that is, to leave the network) at each step. Each walk, simulating a possible information path, terminates either by dissipation or by reaching a boundary node. We distinguish two types of boundary nodes: _sources_ (emitting information) and _sinks_ (absorbing information). ITM Probe offers three models: absorbing, emitting and channel. For any network node, the corresponding weight returned by the emitting model is the expected number of visits to that node by a random walk originating at given source(s). The absorbing model, on the other hand, returns the likelihood of a random walk starting at that node to terminate at sink(s). The channel model combines the emitting and absorbing models: it contains both sources and sinks as boundary and reports the expected numbers of visits to any network node from random walks originating at sources and terminating at sinks. Each selection of boundary nodes and dissipation rates provides the biological _context_ for the information transmission modelled. Small dissipation allows random walks to explore the nodes farther away from their origin while large dissipation evaporates quickly most walks. For the channel model, dissipation controls how much a random walk can deviate from the shortest path from sources to sinks. We call the set of most significant nodes, in terms of the weights returned, an _Information Transduction Module_ (ITM). ## 2 Usage Both the absorbing and emitting models navigate neighborhoods of selected nodes and illuminate the protein complexes associated with them. However, the absorbing model can reveal relatively distant ‘leaf’ nodes linked to a sink by a nearly unique path, while the emitting model favors highly connected clusters. The channel model is suited for discovery of potential pathways linking proteins of interest or biological functions associated with them. Using multiple sources may reveal the potential points of crosstalk between information channels, while a solution of multiple sinks chosen according to a set of competing hypotheses may suggest the most biologically plausible pathways among many possible ones. Every model of ITM Probe requires an interaction graph, the boundary nodes (sources and/or sinks) and the damping factors as input. The damping factors may be specified directly or by setting the desired average path-length (emitting/channel model) or the average likelihood of absorption at sinks (absorbing model). Although our mathematical framework can be applied to any directed graph, our web service presently supports only the yeast (Saccharomyces cerevisiae) physical interaction networks derived from the BioGRID (Stark et al., 2006) database. We offer three yeast networks: Full, Reduced and Directed. The Full network consists of all interactions from the BioGRID as an undirected graph, while the Reduced consists only of those interactions that are from low- throughput experiments (that is, from publications reporting less than $300$ interactions) or are reported by at least two independent publications. The Directed network is derived from Reduced by turning all interactions labelled as ‘Biochemical activity’ into directed links (bait $\to$ prey). To assist in silico investigations on the impact of knocking out certain genes, ITM Probe allows users to specify nodes to exclude from the network. Furthermore, it is known (Steffen et al., 2002) that proteins with a large number of non-specific interaction partners might overtake the true signaling proteins in the information flow modeling. Therefore, ITM Probe by default excludes from the yeast networks the proteins that may provide undesirable shortcuts, such as cytoskeleton proteins, histones and chaperones. The user may choose to lengthen or shorten this list. ### Output and analysis ITM Probe outputs a list of the top ranking nodes together with an image of the sub-network consisting of these nodes (Fig. 1). Images are produced using the Graphviz suite (Gansner and North, 2000). Each protein listed is linked to its full description in several external databases. The number of nodes to be listed can be specified directly by the user or determined automatically from the model results through a criterion such as participation ratio (Stojmirović and Yu, 2007) or the cutoff value. The resulting weights for all nodes can be downloaded in the CSV format for further analysis. Figure 1: An example ITM from running the ITM Probe channel model. Each ITM image can be rendered and saved in multiple formats (SVG, PNG, JPEG, EPS and PDF). For each rendering, the users can choose which aspects of results to display, the color map and the scale for presentation (linear or logarithmic). When multiple boundary points are specified, it is possible to obtain an overview of all of their contributions simultaneously by selecting the color mixture scheme (Fig. 1). In this case, each source (channel/emitting model) or sink (absorbing model) is assigned a basic CMY (cyan, magenta or yellow) color and the coloring of each displayed node is a result of mixing the colors corresponding to its source- or sink- specific values for each of the boundary points. While it is possible to specify any proteins in the network as sources and sinks, not every context produces biologically meaningful results. To facilitate biological interpretation of the users’ results, we have locally implemented a Gene Ontology (GO) (Ashburner et al., 2000) enrichment tool based on GO::TermFinder of Boyle et al. (2004). It compares a given input list of proteins to the lists annotated with GO terms and finds those GO terms that statistically best explain the input list. Every ITM Probe results page contains a query form allowing the user to specify the number of the top ranking proteins to consider for GO term enrichment analysis. ### Example Histone acetyltransferases remodel chromatin by acetylating histone octamers and hence may play an important role in transcription activation (Sterner and Berger, 2000). To explore the interface between them and the RNA Polymerase II core in yeast, we choose three histone acetyltransferases (Hat1p, Gcn5p, Elp3p) as sources and a catalytic subunit Rpo21p of RNA Polymerase II as a sink for the channel model (Fig. 1). From the color mixing image it appears that Elp3p and Gcn5p interact with Rpo21p through a wide channel of proteins, while Hat1p seems to be remote from Rpo21p. This prompts the hypothesis that Hat1p is not directly involved in transcription activation. Enrichment analysis, using the 16 nodes (shown in magenta color in Fig. 1) mostly visited from Hat1p, shows that Hat1p and these nodes participate mainly in DNA replication and only indirectly in transcription regulation, thus reinforcing the hypothesis. Similar analysis on the nodes associated with Elp3p indicates the interaction is almost exclusively through the elongator complex. The nodes associated with Gcn5p are less specific, indicating a more generic interface, but are all involved mRNA transcription. ## 3 Outlook We plan to include interaction networks from additional organisms, once their coverage/quality becomes comparable to those from yeast. In principle, the analysis from ITM Probe can be integrated with existing partial knowledge to form a broad picture of possible communication paths in cellular processes. The concept of context-specific analysis may find applications beyond biological networks. ## Acknowledgments This work was supported by the Intramural Research Program of the National Library of Medicine at National Institutes of Health. ITM Probe implementation relies on a variety of open source projects, which we acknowledge on our website. ## References * Ashburner et al. (2000) Ashburner, M. et al. (2000). Gene ontology: tool for the unification of biology. the gene ontology consortium. Nat Genet, 25, 25–29. * Bader et al. (2008) Bader, S. et al. (2008). Interaction networks for systems biology. FEBS Lett, 582(8), 1220–4. * Boyle et al. (2004) Boyle, E. I. et al. (2004). GO::TermFinder–open source software for accessing gene ontology information and finding significantly enriched gene ontology terms associated with a list of genes. Bioinformatics, 20, 3710–3715. * Gansner and North (2000) Gansner, E. R. and North, S. C. (2000). An open graph visualization system and its applications to software engineering. Software — Practice and Experience, 30(11), 1203–1233. * Nabieva et al. (2005) Nabieva, E. et al. (2005). Whole-proteome prediction of protein function via graph-theoretic analysis of interaction maps. Bioinformatics, 21 Suppl 1, 302–310. * Stark et al. (2006) Stark, C. et al. (2006). BioGRID: a general repository for interaction datasets. Nucleic Acids Res, 34(Database issue), D535–9. * Steffen et al. (2002) Steffen, M. et al. (2002). Automated modelling of signal transduction networks. BMC Bioinformatics, 3, 34. * Sterner and Berger (2000) Sterner, D. E. and Berger, S. L. (2000). Acetylation of histones and transcription-related factors. Microbiol Mol Biol Rev, 64(2), 435–459. * Stojmirović and Yu (2007) Stojmirović, A. and Yu, Y.-K. (2007). Information flow in interaction networks. J Comput Biol, 14(8), 1115–43. * Suthram et al. (2008) Suthram, S. et al. (2008). eQED: an efficient method for interpreting eQTL associations using protein networks. Mol. Syst. Biol., 4, 162. * Tu et al. (2006) Tu, Z. et al. (2006). An integrative approach for causal gene identification and gene regulatory pathway inference. Bioinformatics, 22, e489–496.
arxiv-papers
2009-04-17T19:52:32
2024-09-04T02:49:01.948573
{ "license": "Public Domain", "authors": "Aleksandar Stojmirovi\\'c and Yi-Kuo Yu", "submitter": "Aleksandar Stojmirovi\\'c", "url": "https://arxiv.org/abs/0904.2770" }
0904.2809
# Bound of Entanglement of Assistance and Monogamy Constraints Zong-Guo Li Beijing National Laboratory for Condensed Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100080, China Shao-Ming Fei Department of Mathematics, Capital Normal University, Beijing 100037, China Institut für Angewandte Mathematik, Universität Bonn, 53115, Germany Sergio Albeverio Institut für Angewandte Mathematik, Universität Bonn, 53115, Germany W. M. Liu Beijing National Laboratory for Condensed Matter Physics, Institute of Physics, Chinese Academy of Sciences, Beijing 100080, China ###### Abstract We investigate the entanglement of assistance which quantifies capabilities of producing pure bipartite entangled states from a pure tripartite state. The lower bound and upper bound of entanglement of assistance are obtained. In the light of the upper bound, monogamy constraints are proved for arbitrary n-qubit states. ###### pacs: 03.67.Mn, 03.65.Ud, 03.65.Yz ## I Introduction In quantum information theory, entanglement is a vital resource for some practical applications such as quantum cryptography, quantum teleportation and quantum computation bennett ; nielsen . During the last decade, this inspired a great deal of effort for detecting and quantifying the entanglement wootters ; chen ; mintert0 ; mintert1 ; gao ; li1 ; ou ; mintert2 ; li2 . On the other hand, the creation and distribution of entanglement is also of central interest in quantum information processing. More specially the distribution of bipartite entanglement is a key ingredient for performing certain quantum- information processing tasks such as teleportation. One of the methods for generating bipartite entanglement is the entanglement of assistance that is defined in Refs. cohen ; dp . It quantifies the entanglement which could be created by reducing a multipartite entangled state to an entangled state with fewer parties (e.g. bipartite) via measurements. Such producing of entanglement, also called “assisted entanglement”, is a special case of the _localizable entanglement_ localizable , which is especially important for quantum communication, where quantum repeaters are needed to establish bipartite entanglement over a long length scale hj1 . For a pure $2\otimes 2\otimes n$ state, the analytical formula of entanglement of assistance has been derived by Laustsen _et al._ laustsen , whereas the calculation of entanglement of assistance is not easy for a general pure tripartite state gour . In this paper, we explore the entanglement of assistance for a general pure tripartite state in terms of I-concurrence rungta . We obtain a lower bound of entanglement of assistance, which is also the lower bound of a tripartite entanglement measure, the entanglement of collaboration. This may help to characterize the localizable entanglement. Furthermore, an upper bound is also obtained. Deducing from the upper bound of entanglement of assistance, we find a proper form of entanglement monogamy inequality for arbitrary N-qubit states, which is analogous to the monogamy constraints for concurrence proposed by Coffman _et al._ coffman and proven by Osborne _et al._ tobias for the general case. The paper is organized as follows: In Sec. II, we derive a lower bound and upper bound of entanglement of assistance for pure tripartite states. In Sec. III, monogamy constraints are proved in terms of this upper bound. Finally in Sec. IV we conclude with a discussion of our results. ## II Bound of entanglement of Assistance We consider a pure ($d_{1}\times d_{2}\times N$) tripartite state shared by three parties referred to as Alice, Bob and Charlie, who performs a measurement on his party to yield a known bipartite entangled state shared by Alice and Bob. Charlie’s aim is to maximize the entanglement of the state between Alice and Bob. This maximum average entanglement that he can create is called entanglement of assistance, which was originally defined in terms of entropy of entanglement dp ; cohen . In this paper, we define entanglement of assistance in terms of the entanglement measure I-concurrence: $\displaystyle E_{a}(|\psi\rangle_{ABC})\\!\equiv\\!E_{a}(\rho_{AB})\\!\equiv\\!\textrm{max}\sum_{i}p_{i}C(|\phi_{i}\rangle_{AB}),$ which is maximized over all possible pure-state decompositions of $\rho_{AB}=\textrm{Tr}_{C}[|\psi\rangle_{ABC}\langle\psi|]=\sum_{i}p_{i}|\phi_{i}\rangle_{AB}\langle\phi_{i}|$. By applying the method in Ref. mintert0 , we can obtain the lower bound of entanglement of assistance for pure tripartite states. For any given pure-state decomposition of $\rho_{AB}$, $\rho_{AB}=\sum_{i}p_{i}|\phi_{i}\rangle_{AB}\langle\phi_{i}|$, we have $\displaystyle E_{a}(|\psi\rangle_{ABC})\\!$ $\displaystyle=$ $\displaystyle\\!\textrm{max}\sum_{i}p_{i}C(|\phi_{i}\rangle_{AB})$ (1) $\displaystyle=$ $\displaystyle\\!\textrm{max}\sum_{i}p_{i}\sqrt{\sum_{mn}|\langle\phi_{i}|S_{mn}|\phi_{i}^{*}\rangle|^{2}}$ $\displaystyle\geq$ $\displaystyle\\!\textrm{max}\sqrt{\sum_{mn}(\sum_{i}p_{i}|\langle\phi_{i}|S_{mn}|\phi_{i}^{*}\rangle|)^{2}},$ where $S_{mn}=L_{m}\otimes L_{n}$, $L_{m},m=1,...,d_{1}(d_{1}-1)/2$, $L_{n},n=1,...,d_{2}(d_{2}-1)/2$ are the generators of group $SO(d_{1})$ and $SO(d_{2})$ respectively. The inequality holds according to the Minkowski inequality $[\sum\limits_{i=1}(\sum\limits_{k}x_{i}^{k})^{p}]^{1/p}\leq\sum_{k}[\sum\limits_{i=1}(x_{i}^{k})^{p}]^{1/p},\text{ }p>1$. Consider the eigenvalue decomposition of $\rho_{AB}$, $\rho_{AB}=\Psi M\Psi^{\dagger}$, where $M$ is a diagonal matrix whose diagonal elements are the eigenvalues of $\rho$, and $\Psi$ is a unitary matrix whose columns are the eigenvectors of $\rho$. Taking into account the relation $\Phi W^{1/2}=\Psi M^{1/2}U$, where $U$ is a right-unitary matrix, we can rewrite inequality (1) as $\displaystyle\\!\\!E_{a}(\rho_{AB})\\!$ $\displaystyle\geq$ $\displaystyle\\!\textrm{max}\sqrt{\sum_{mn}(\sum_{i}|\Phi^{T}W^{\frac{1}{2}}S_{mn}W^{\frac{1}{2}}\Phi|_{ii})^{2}}$ $\displaystyle=$ $\displaystyle\\!\textrm{max}\sqrt{\sum_{mn}(\sum_{i}|U^{T}M^{\frac{1}{2}}\Psi^{T}S_{mn}\Psi M^{\frac{1}{2}}U|_{ii})^{2}}.$ In terms of the Cauchy-Schwarz inequality $(\sum_{i}x_{i}^{2})^{\frac{1}{2}}(\sum_{i}y_{i}^{2})^{\frac{1}{2}}\geq\sum_{i}x_{i}y_{i}$, the inequality $\displaystyle E_{a}(\rho_{AB})\\!\geq\\!\textrm{max}\sum_{i}\left|U^{T}\left(\sum_{mn}z_{mn}A_{mn}\right)U\right|_{ii}$ (2) is implied for any $z_{mn}=y_{mn}exp(i\theta_{mn})$ with $y_{mn}\geq 0$ and $\sum_{mn}y_{mn}^{2}=1$, where $A_{mn}=M^{\frac{1}{2}}\Psi^{T}S_{mn}\Psi M^{\frac{1}{2}}$. Since $\sum_{mn}z_{mn}A^{mn}$ is a symmetric matrix, we can always find a unitary matrix $U$ such that $\sum_{i}|U^{T}(\sum_{mn}z_{mn}A_{mn})U|_{ii}=\|\sum_{mn}z_{mn}A^{mn}\|$ as shown in Ref. horn , where $\|\cdot\|$ stands for the trace norm defined by $\|G\|=\textrm{Tr}(GG^{\dagger})^{1/2}$. For an arbitrary unitary matrix $V$, we have $\displaystyle\sum_{i}|V^{T}(\sum_{mn}z_{mn}A_{mn})V|_{ii}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\sum_{i}|V^{T}(U^{-1})^{T}U^{T}(\sum_{mn}z_{mn}A_{mn})UU^{-1}V|_{ii}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\sum_{i}|V^{T}(U^{-1})^{T}Diag(\lambda_{1},\lambda_{2}\cdots)U^{-1}V|_{ii}$ $\displaystyle\\!\\!\leq\\!\\!$ $\displaystyle\sum_{ij}|(U^{-1}V)_{ij}|^{2}\lambda_{i}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\sum_{i}\lambda_{i},$ where $\lambda_{i}(z)$s, dependent on the choice of the $y$ and $\theta$, are the singular values of the matrix $\mathcal{T}=\sum_{mn}z_{mn}A^{mn}$, i.e., the square roots of the eigenvalues of the positive Hermitian matrix $\mathcal{T}\mathcal{T}^{\dagger}$. Therefore the maximum of Eq. (2) is given by $\underset{z\in\mathbf{C}}{max}\left(\sum_{i}\lambda_{i}(z)\right)=\underset{z\in\mathbf{C}}{max}\|\sum_{mn}z_{mn}A^{mn}\|$. Hence, we arrive at the lower bound of entanglement of assistance for a pure tripartite state as following: $\displaystyle E_{a}(\rho_{AB})\\!\geq\\!\underset{z\in\mathbf{C}}{\textrm{max}}\|\sum_{mn}z_{mn}A^{mn}\|.$ (3) Furthermore the entanglement of collaboration gour2 ; gour3 quantifies the maximum amount of entanglement that can be generated between two parties from a tripartite state with collaborations composed of local operations and classical communication among the three parties. It has been shown by Gour _et. al._ gour2 that, for tripartite states, the entanglement of collaboration is greater than or equal to entanglement of assistance in terms of a given entanglement measure. Therefore our lower bound is also the one for entanglement of collaboration, which can be tightened by numerical optimization. Our bound may help to characterize localizable entanglement. For a pure $2\times 2\times N$ state, this lower bound is consistent with the result of Ref. laustsen . We can also obtain the upper bound of entanglement of assistance. From the definition of entanglement of assistance, we have $\displaystyle[E_{a}(\rho_{AB})]^{2}$ $\displaystyle=$ $\displaystyle[\textrm{max}\sum_{i}p_{i}C(|\phi_{i}\rangle_{AB})]^{2}$ $\displaystyle\\!\leq\\!$ $\displaystyle\textrm{max}\sum_{i}[\sqrt{p_{i}}C(|\phi_{i}\rangle_{AB})]^{2}\sum_{i}(\sqrt{p_{i}})^{2}$ $\displaystyle\\!=\\!$ $\displaystyle\textrm{max}\sum_{i}2p_{i}[1-\textrm{Tr}(\rho_{i}^{A})^{2}]$ $\displaystyle\\!\leq\\!$ $\displaystyle 2(1-\textrm{Tr}\rho_{A}^{2}),$ where $\rho_{i}^{A}=\textrm{Tr}_{B}|\phi_{i}\rangle_{AB}\langle\phi_{i}|$. The first inequality holds according to the Cauchy-Schwarz inequality tj ; the last one, which has also been proved in Ref. vicente , holds due to the convex property of $\textrm{Tr}\rho_{A}^{2}$. Define the upper bound as the tangle of assistance $\tau_{a}(\rho_{AB})\equiv\textrm{max}\sum_{i}p_{i}[C(|\phi_{i}\rangle_{AB})]^{2}$. Similar to the entanglement of assistance that satisfies the monogamy constraints for n-qubit pure state gour1 ; monogamy , we show below that the tangle of assistance also exhibits monogamy constraints for arbitrary n-qubit states. ## III Monogamy inequality Consider a pure tripartite state $|\Psi\rangle_{ABC}$. The tangle of assistance is defined by $\displaystyle\tau_{a}(|\Psi\rangle_{ABC})$ $\displaystyle=$ $\displaystyle\underset{\\{p_{x},|\psi_{x}\rangle\\}}{\textrm{max}}\sum_{x}p_{x}[C(|\psi_{x}\rangle)]^{2}$ $\displaystyle=$ $\displaystyle\underset{\\{p_{x},|\psi_{x}\rangle\\}}{\textrm{max}}\sum_{x}p_{x}S_{2}[\textrm{Tr}_{B}(|\psi_{x}\rangle\langle\psi_{x}|)],$ where the linear entropy $S_{2}[\rho]=2[1-\textrm{Tr}(\rho)^{2}]$, and the maximum runs over all pure-state decompositions $\\{p_{x},|\psi_{x}\rangle\\}$ of $\rho_{AB}=\textrm{Tr}_{C}(|\Psi\rangle_{ABC}\langle\Psi|)=\sum_{x}p_{x}|\psi_{x}\rangle\langle\psi_{x}|$. In the case of pure state $\rho_{AB}$, the tangle of assistance is the square of concurrence of this state. ###### Theorem 1 For an arbitrary n-qubit state, the tangle of assistance satisfies, $\displaystyle\tau_{a}(\rho_{A_{1}A_{2}})+\tau_{a}(\rho_{A_{1}A_{3}})+\cdots+\tau_{a}(\rho_{A_{1}A_{n}})$ (4) $\displaystyle\geq$ $\displaystyle\tau_{a}(\rho_{A_{1}(A_{2}A_{3}\cdots A_{n})}),$ where $\tau_{a}(\rho_{A_{1}(A_{2}A_{3}\cdots A_{n})})$ denotes the tangle of assistance in the bipartite partition $A_{1}|A_{2}A_{3}\cdots A_{n}$. Proof: First of all, we prove the following inequality $\tau_{a}(\rho_{AB})+\tau_{a}(\rho_{AC})\geq\tau_{a}(\rho_{A(BC)}),$ (5) for arbitrary tripartite states $\rho_{ABC}$ in $2\times 2\times 2^{n-2}$ system. We first prove Eq. (5) for pure states. In this case, due to the local-unitary invariance of $\tau_{a}(\rho_{AC})$, we can rotate the basis of subsystem $C$ into the local Schmidt basis $|V_{k}\rangle$, $k=1,\cdots,4$, given by the eigenvectors of $\rho_{C}=Tr_{AB}(\rho_{ABC})$. In this way we can regard the $2^{n-2}$-dimensional qudit $C$ as an effective four-dimensional qudit. Therefore, we simply need to prove Eq. (5) for a $2\times 2\times 4$ pure state $ABC$. For pure states of a tripartite system $ABC$ of two qubits $A$ and $B$ and a four-level system $C$, we have $\displaystyle\tau_{a}(\rho_{A(BC)})-\tau_{a}(\rho_{AC})$ $\displaystyle=$ $\displaystyle S_{2}(\rho_{A})-\underset{\\{p_{j},|\phi_{j}\rangle\\}}{\textrm{max}}\sum_{j}p_{j}S_{2}[\textrm{Tr}_{C}(|\phi_{j}\rangle\langle\phi_{j}|)],$ where $\sum_{j}p_{j}|\phi_{j}\rangle\langle\phi_{j}|=\rho_{AC}$. It can be shown that any pure-state decomposition of $\rho_{AC}$ can be realized by positive-operator-valued measures (POVMs) $\\{M_{x}\\}$ performed by Bob, the rank of which is 1 (for more details see gour ; lp ). Therefore, we get the the following expression $\displaystyle\tau_{a}(\rho_{AC})=\underset{\\{M_{x}\\}}{\textrm{max}}\sum_{x}p_{x}S_{2}(\rho_{x}),$ (6) where the maximum runs over all rank-1 POVMs on Bob’s system, $p_{x}=\textrm{Tr}(I_{A}\otimes M_{x}\rho_{AB})$ is the probability of outcome $x$, and $\rho_{x}=\textrm{Tr}_{B}(I_{A}\otimes M_{x}\rho_{AB})/p_{x}$ is the posterior state in Alice’s subsystem. For convenience, we take the definition $\displaystyle I(\rho_{AB}):=S_{2}(\rho_{A})-\underset{\\{M_{x}\\}}{\textrm{max}}\sum_{x}p_{x}S_{2}(\rho_{x}).$ By comparing $I(\rho_{AB})$ with Eq. (5) for pure tripartite states, we see that it is sufficient to prove the inequality $\displaystyle I(\rho_{AB})\leq\tau_{a}(\rho_{AB}),$ for all two-qubit states $\rho_{AB}$. We first derive a computable formula for $I(\rho_{AB})$. Any bipartite quantum state $\rho_{AB}$ may be written as $\displaystyle\rho_{AB}=\Lambda\otimes I_{B}(|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|),$ (7) where $V_{B^{\prime}B}$ is the symmetric two-qubit purification of the reduced density operator $\rho_{B}$ on an auxiliary qubit system $B^{\prime}$ and $\Lambda$ is a qubit channel from $B^{\prime}$ to $A$. Deducing from Eq. (6) we have $\displaystyle\rho_{x}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\textrm{Tr}_{B}(I_{A}\otimes M_{x}\rho_{AB})/p_{x}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\textrm{Tr}_{B}[(I_{A}\otimes M_{x})(\Lambda\otimes I_{B})|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|)]/p_{x}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\Lambda[\textrm{Tr}_{B}(I_{A}\otimes M_{x}|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|)]/p_{x}.$ Since the rank of $M_{x}$ is 1, $\textrm{Tr}_{B}(I_{A}\otimes M_{x}|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|)]$ is a pure state. Moreover, all pure-state decompositons of $\rho_{B}^{\prime}=\textrm{Tr}_{B}(|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|)=\rho_{B}$ can be realized by the rank-1 POVM measurements $\\{M_{x}\\}$ operating on subsystem $B$ of $|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|$. Hence $I(\rho_{AB})$ satisfies $I(\rho_{AB})=S_{2}[\Lambda(\rho_{B})]-\underset{\\{p_{x},|\psi_{x}\rangle\\}}{\textrm{max}}\sum_{x}p_{x}S_{2}[\Lambda(|\psi_{x}\rangle)],$ (8) where the maximum runs over all pure-state decompositions $\\{p_{x},|\psi_{x}\rangle\\}$ of $\rho_{B}$ such that $\sum_{x}p_{x}|\psi_{x}\rangle\langle\psi_{x}|=\rho_{B}$. The action of a qubit channel $\Lambda$ on a single-qubit state $\rho=(I+\mathbf{r}\cdot\boldsymbol{\upsigma})/2$, where $\boldsymbol{\upsigma}$ is the vector of Pauli operators, may be written as $\Lambda(\rho)=[I+(\mathbf{L}\mathbf{r}+\mathbf{l})\cdot\boldsymbol{\upsigma}]/2$, where $\mathbf{L}$ is a $3\times 3$ real matrix and $\mathbf{l}$ is a three- dimensional vector. In this Pauli basis, the possible pure-state decompositions of $\rho_{B}$ are represented by all possible sets of probabilities $\\{p_{j}\\}$ and unit vectors $\\{\mathbf{r}_{j}\\}$ such that $\sum_{j}p_{j}\mathbf{r}_{j}=\mathbf{r}_{B}$, where $(I+\mathbf{r}_{B}\cdot\boldsymbol{\upsigma})/2=\rho_{B}$. In terms of the Block representation of one-qubit states, the linear entropy $S_{2}$ is given by $S_{2}[(I+\mathbf{r}\cdot\boldsymbol{\upsigma})/2]=1-|\mathbf{r}|^{2}$. In this way we get the following equation $S_{2}[\Lambda(I+\mathbf{r}\cdot\boldsymbol{\upsigma})/2]=1-(\mathbf{L}\mathbf{r}+\mathbf{l})^{T}(\mathbf{L}\mathbf{r}+\mathbf{l})$. Substituting $\mathbf{r}_{j}=\mathbf{r}_{B}+\mathbf{x}_{j}$, one can easily check that Eq. (8) reduces to the following one whose value is determined by $\\{p_{j},\mathbf{x}_{j}\\}$ subject to the conditions $\sum_{j}p_{j}\mathbf{x}_{j}=0$ and $|\mathbf{r}_{B}+\mathbf{x}_{j}|=1$, $\displaystyle I(\rho_{AB})$ (9) $\displaystyle\\!=\\!$ $\displaystyle S_{2}[\Lambda(\rho_{B})]-\underset{\\{p_{j},\mathbf{x}_{j}\\}}{\textrm{max}}\sum_{j}p_{j}S_{2}[\Lambda(\frac{I+(\mathbf{r}_{B}+\mathbf{x}_{j})\cdot\boldsymbol{\upsigma}}{2})]$ $\displaystyle\\!=\\!$ $\displaystyle 1-(\mathbf{L}\mathbf{r}_{B}+\mathbf{l})^{T}(\mathbf{L}\mathbf{r}_{B}+\mathbf{l})$ $\displaystyle\\!-\\!$ $\displaystyle\underset{\\{p_{j},\mathbf{x}_{j}\\}}{\textrm{max}}\sum_{j}p_{j}\Big{\\{}1-[\mathbf{L}(\mathbf{r}_{B}+\mathbf{x}_{j})+\mathbf{l}]^{T}[\mathbf{L}(\mathbf{r}_{B}+\mathbf{x}_{j})+\mathbf{l}]\Big{\\}}$ $\displaystyle=$ $\displaystyle\underset{\\{p_{j},\mathbf{x}_{j}\\}}{\textrm{min}}\sum_{j}p_{j}(\mathbf{x}^{T}_{j}\mathbf{L}^{T}\mathbf{L}\mathbf{x}_{j}).$ Without loss of generality, we assume that $\mathbf{L}^{T}\mathbf{L}$ is diagonal with diagonal elements $\lambda_{x}\leq\lambda_{y}\leq\lambda_{z}$. The constrains $|\mathbf{r}_{B}+\mathbf{x}_{j}|=1$ lead to the identities $(\mathbf{x}^{x}_{j})^{2}=1-|\mathbf{r}_{B}|^{2}-2\mathbf{r}_{B}^{T}\mathbf{x}_{j}-(\mathbf{x}^{y}_{j})^{2}-(\mathbf{x}^{z}_{j})^{2}$. Substituting this into Eq. (9), we get $I(\rho_{AB})=\lambda_{x}(1-|\mathbf{r}_{B}|^{2})+\underset{\\{p_{j},\mathbf{x}_{j}\\}}{\textrm{min}}\sum_{j}p_{j}[(\lambda_{y}-\lambda_{x})(\mathbf{x}^{y}_{j})^{2}+(\lambda_{z}-\lambda_{x})(\mathbf{x}^{z}_{j})^{2}]$. This expression is obviously minimized by choosing $\mathbf{x}^{z}_{j}=\mathbf{x}^{y}_{j}=0$ for all $j$. Then from the condition $|\mathbf{r}_{B}+\mathbf{x}_{j}|=1$, $\mathbf{x}^{x}_{j}$ have two solutions. The ensemble of two states corresponding to such two solutions can reach the minimum $\lambda_{x}(1-|\mathbf{r}_{B}|^{2})$. As $S_{2}(\rho_{B})=(1-|\mathbf{r}_{B}|^{2})$, we obtain the following computable expression: $I(\rho_{AB})=\lambda_{min}S_{2}(\rho_{B})$. Note that a local filtering operation of the form $\rho^{\prime}_{AB}=\frac{(I\otimes B)\rho_{AB}(I\otimes B^{\dagger})}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]}$ leaves $\mathbf{L}$ invariant and transforms $S_{2}(\rho_{B^{\prime}})=\frac{\textrm{det}(B)^{2}}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]^{2}}S_{2}(\rho_{B})$ frank . If the local filtering operator $B$ is invertible, we can get the conclusion that there does not exist a pure-state decomposition $\\{q_{j},|\psi_{j}\rangle\\}$ of $\rho^{\prime}_{AB}$ such that $\tau_{a}(\rho^{\prime}_{AB})>\frac{\textrm{det}(B)^{2}}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]}\tau_{a}(\rho_{AB})$ by the contradiction. For the case that the operator $B$ is not invertible, such pure-state decomposition also doesn’t exist. Furthermore, there exists exactly an optimal pure-state decomposition $\\{p_{i},|\phi_{i}\rangle\\}$ of the state $\rho_{AB}$ for $\tau_{a}(\rho_{AB})$ such that $\sum_{i}p_{i}C[\frac{(I\otimes B)(|\phi_{i}\rangle\langle\phi_{i}|I\otimes B^{\dagger})}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]}]^{2}=\frac{\textrm{det}(B)^{2}}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]^{2}}\tau_{a}(\rho_{AB})$. Therefore, the tangle of assistance $\tau_{a}(\rho^{\prime}_{AB})=\frac{\textrm{det}(B)^{2}}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]^{2}}\tau_{a}(\rho_{AB})$. Since $I(\rho^{\prime}_{AB})=\frac{\textrm{det}(B)^{2}}{\textrm{Tr}[(I\otimes B^{\dagger}B)\rho_{AB}]^{2}}\lambda_{min}S_{2}(\rho_{B})$, it transforms exactly in the same way as the tangle of assistance $\tau_{a}(\rho^{\prime}_{AB})$ does. As there always exists a filtering operation for which $\rho_{B}^{\prime}\propto I$, we can assume, without loss of generality, that $S_{2}(\rho_{B})=1$. So let us consider $\rho_{AB}$ with $\rho_{B}=\textrm{Tr}_{A}(\rho_{AB})=\frac{1}{2}I$. In terms of Pauli operators, we can rewrite the pure state as follows: $\displaystyle\frac{(I\otimes B)|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|(I\otimes B^{\dagger})}{\textrm{Tr}[(I\otimes B^{\dagger}B)|V_{B^{\prime}B}\rangle\langle V_{B^{\prime}B}|]}$ $\displaystyle\\!\\!=\\!\\!$ $\displaystyle\frac{1}{4}[I+\sum_{i}m_{i}I\otimes\sigma_{i}+\sum_{i}n_{i}\sigma_{i}\otimes I+\sum_{ij}O_{ij}\sigma_{i}\otimes\sigma_{j}],$ where $\sigma_{1}$, $\sigma_{2}$ and $\sigma_{3}$ are $\sigma_{x}$, $\sigma_{y}$ and $\sigma_{z}$ respectively. Then we get the conclusion from its purity and unity reduced density, that $m_{i}=n_{i}=0$ for all i and the $3\times 3$ real matrix $O$ is orthogonal. Thus we have $\rho_{AB}=\frac{1}{4}\Lambda\otimes I_{B}[I+\sum_{ij}O_{ij}\sigma_{i}\otimes\sigma_{j}]=\frac{1}{4}[I+\sum_{i}l_{i}\sigma_{i}\otimes I+\sum_{ij}(LO)_{ij}\sigma_{i}\otimes\sigma_{j}]$. As unitary operator $U_{1}$ satisfies the equation $U_{1}\sigma_{i}U_{1}^{\dagger}=\sum_{j}P_{ij}\sigma_{j}$, where $P$ is a real orthogonal $3\times 3$ matrix, we can always find local unitary operators, in terms of the theorem of singular value decomposition, so that $U_{1}\otimes U_{2}\rho_{AB}U_{1}^{\dagger}\otimes U_{2}^{\dagger}=\frac{1}{4}[I+\sum_{i}(lP)_{i}\sigma_{i}\otimes I+\sum_{ij}(QLOP)_{ij}\sigma_{i}\otimes\sigma_{j}]=\frac{1}{4}[I+\sum_{i}l^{\prime}_{i}\sigma_{i}\otimes I+\sum_{i}(L^{\prime})_{ii}\sigma_{i}\otimes\sigma_{i}]$, where $Q$ and $P$ are real orthogonal matrix and $L^{\prime}$ is a diagonal matrix with its diagonal elements the singular values of $L$. Because of the local-unitary invariance of $\tau_{a}(\rho_{AB})$ and $I(\rho_{AB})$, without loss of generality, we assume that $\rho_{AB}=\frac{1}{4}[I+\sum_{i}t_{i}\sigma_{i}\otimes I+\sum_{i}(R)_{ii}\sigma_{i}\otimes\sigma_{i}]$, where $R$ is a diagonal matrix with its diagonal elements the singular values of $L$. Due to the positivity of $\displaystyle\rho_{AB}=\\!\\!\\!\frac{1}{4}\left(\\!\\!\\!\begin{array}[]{cccc}1+R_{3}+t_{3}\\!\\!\\!&\\!\\!\\!0\\!\\!\\!&\\!\\!\\!t_{1}-it_{2}\\!\\!\\!&\\!\\!\\!R_{1}-R_{2}\\\ 0\\!\\!\\!&\\!\\!\\!1-R_{3}+t_{3}\\!\\!\\!&\\!\\!\\!R_{1}+R_{2}\\!\\!\\!&\\!\\!\\!t_{1}-it_{2}\\\ t_{1}+it_{2}\\!\\!\\!&\\!\\!\\!R_{1}+R_{2}\\!\\!\\!&\\!\\!\\!1-R_{3}-t_{3}\\!\\!\\!&\\!\\!\\!0\\\ R_{1}-R_{2}\\!\\!\\!&\\!\\!\\!t_{1}+it_{2}\\!\\!\\!&\\!\\!\\!0\\!\\!\\!&\\!\\!\\!1+R_{3}-t_{3}\\\ \end{array}\\!\\!\right)\\!\\!,$ the inequality $1-t_{1}^{2}-t_{2}^{2}-t_{3}^{2}\geq R_{3}^{2}$ must hold. Therefore we obtain $\displaystyle\\!\\!\\!\tau_{a}(\rho_{AB})\geq[C_{a}(\rho_{AB})]^{2}$ $\displaystyle\geq$ $\displaystyle\\!\\!\\!\textrm{Tr}[\sigma_{y}\otimes\sigma_{y}\rho^{*}_{AB}\sigma_{y}\otimes\sigma_{y}\rho_{AB}]$ $\displaystyle=$ $\displaystyle\\!\\!\\!\frac{1}{16}\left[4+4(R_{1}^{2}+R_{2}^{2}+R_{3}^{2})-4(t_{1}^{2}+t_{2}^{2}+t_{3}^{2})\right]$ $\displaystyle\geq$ $\displaystyle\\!\\!\\!\frac{1}{4}[R_{1}^{2}+R_{2}^{2}+2R_{3}^{2}]$ $\displaystyle\geq$ $\displaystyle\\!\\!\\!\lambda_{min}(\mathbf{L}^{T}\mathbf{L}).$ This inequalities imply that $I(\rho_{AB})\leq\tau_{a}(\rho_{AB})$ for all two-qubit states $\rho_{AB}$, which then proves Eq. (5) for pure states. Now we extend Eq. (5) to mixed state case. Consider the maximizing pure-state decomposition $\\{p_{x},|\psi_{x}\rangle\\}$ for $\tau_{a}(\rho_{A(BC)})$. By applying the inequality Eq. (5) and taking into account the concavity of $\tau_{a}$, we have $\displaystyle\tau_{a}(\rho_{A(BC)})$ $\displaystyle=$ $\displaystyle\sum_{x}p_{x}\tau_{a}(\rho^{x}_{A(BC)})$ $\displaystyle\leq$ $\displaystyle\sum_{x}p_{x}[\tau_{a}(\rho^{x}_{AB})+\tau_{a}(\rho^{x}_{AC})]$ $\displaystyle\leq$ $\displaystyle\tau_{a}(\rho_{AB})+\tau_{a}(\rho_{AC}),$ where $\rho^{x}_{A(BC)}=|\psi_{x}\rangle\langle\psi_{x}|$. Let $C=C_{1}C_{2}$ be a $2\times 2^{n-3}$ system and apply Eq. (5), then we get $\displaystyle\tau_{a}(\rho_{A(BC)})\\!\\!\\!$ $\displaystyle\\!\\!\\!\leq\tau_{a}(\rho_{AB})+\tau_{a}(\rho_{AC})$ $\displaystyle\\!\\!\\!\leq\tau_{a}(\rho_{AB})+\tau_{a}(\rho_{AC_{1}})+\tau_{a}(\rho_{AC_{2}}).$ Successively applying Eq. (5) to partitions of $C$, we obtain the inequality Eq. (4) by induction. $\blacksquare$ In fact, Eq. (4) turns out to be an equality for product states under partition $A|BC_{1}\cdots C_{n}$. For the generalized GHZ states, Eq. (4) is a strictly inequality. ## IV Discussion In summary, as an important quantity in quantum computation, the entanglement of assistance has been investigated in terms of I-concurrence for pure tripartite states. We have obtained a lower bound of entanglement of assistance, which is also the lower bound of the tripartite entanglement measure, the entanglement of collaboration. In stead of great difficulty involved in computing the entanglement of collaboration, the lower bound Eq. (3) can be calculated in a numerical optimization to make a good estimation of entanglement of collaboration. Moreover, an upper bound is also obtained. In the light of the upper bound of entanglement of assistance, we find a proper form of entanglement monogamy inequality for arbitrary N-qubit states. This work was supported by NSFC under grants Nos. 60525417, 10740420252, 10874235, 10875081, 10675086, the NKBRSFC under grants Nos. 2006CB921400, 2009CB930704, KZ200810028013 and NKBRPC(2004CB318000). ## References * (1) C. H. Bennett and D. P. DiVincenzo, Nature (London) 404, 247 (2000). * (2) M. A. Nielsen and I. L. Chuang, _Quantum Computation and Quantum Information_ (Cambridge University Press, Cambridge, 2000). * (3) W. K. Wootters, Phys. Rev. Lett. 80, 2245 (1998). * (4) F. Mintert, M. Kuś, and A. Buchleitner, Phys. Rev. Lett. 92, 167902 (2004). * (5) F. Mintert, M. Kuś, and A. Buchleitner, Phys. Rev. Lett. 95, 260502 (2005). * (6) K. Chen, S. Albeverio, and S. M. Fei, Phys. Rev. Lett. 95, 040504 (2005). * (7) X. H. Gao, S. M. Fei, and K. Wu, Phys. Rev. A 74, 050303(R) (2006). * (8) Z. G. li, F. S. Fei, Z. X. Wang and K. Wu, Phys. Rev. A 75, 012311 (2007) * (9) Y. C. Ou, H. Fan, and S. M. Fei, Phys. Rev. A 78, 012311 (2008). * (10) L. Aolita, A. Buchleitner, and F. Mintert, Phys. Rev. A 78, 022308 (2008). * (11) Z. G. li, F. S. Fei, Z. D. Wang and W. M. Liu, Phys. Rev. A 79, 024303 (2009) * (12) D. P. DiVincenzo, C. A. Fuchs, H. Mabuchi, J. A. Smolin, A. Thapliyal, and A. Uhlmann, _The Entanglement of assistance_ , Lecture Notes in Computer Science Vol. 1509 (Springer-Verlag, Berlin, 1999), pp. 247-257 * (13) O. Cohen, Phys. Rev. Lett. 80, 2493 (1998). * (14) F. Verstraete, M. Popp, and J. I. Cirac, Phys. Rev. Lett. 92, 027901 (2004); M. Popp, F. Verstraete, M. A. Martin-Delgado, and J. I. Cirac, Phys. Rev. A 71, 042306 (2005). * (15) H. J. Briegel, W. Dür, J. I. Cirac, and P. Zoller, Phys. Rev. Lett. 81, 5932 (1998). * (16) T. laustsen, F.Berstraete, and S. J. van Enk, Quantum Inf. Comput. 3, 64 (2003). * (17) G. Gour, Phys. Rev. A 72, 042318 (2005). * (18) P. Rungta, V. Bužek, C. M. Caves, M. Hillery, and G. J. Milburn, Phys. Rev. A 64, 042315 (2001). * (19) V. Coffman, J. Kundu, and W. K. Wootters, Phys. Rev. A 61, 052306 (2000). * (20) T. J. Osborne and F. Verstraete, Phys. Rev. Lett. 96, 220503 (2006). * (21) R. A. Horn and C. R. Johnson, _Matrix Analysis_ (Cambridge University Press, New York, 1985), p. 205. * (22) G. Gour and R. W. Spekkens, Phys. Rev. A 73, 062331 (2006). * (23) G. Gour, Phys. Rev. A 74, 052307 (2006). * (24) T. J. Osborne, Phys. Rev. A 72, 022309 (2005). * (25) J. I. de Vicente, J. Phys. A: Math. Theor. 41, 065309 (2008). * (26) G. Gour, D. A. Meyer, and B. C. Sanders, Phys. Rev. A 72, 042329 (2005). * (27) G. Gour, S. Bandyopadhyay, and B. C. Sanders, J. Math. Phys. 48, 012108 (2007). * (28) L. P. Hughston, R. Jozsa, and W. K. Wootters, Phys. Lett. A 183, 14 (1993). * (29) F. Verstraete, J. Dehaene, and B. DeMoor, Phys. Rev. A 64, 010101(R) (2001).
arxiv-papers
2009-04-18T02:44:46
2024-09-04T02:49:01.970436
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zong-Guo Li, Shao-Ming Fei, Sergio Albeverio and W. M. Liu", "submitter": "ZongGuo Li", "url": "https://arxiv.org/abs/0904.2809" }
0904.2824
# On the Grothendieck groups of toric stacks Zheng Hua ## 1 Introduction In this note, we prove that the Grothendieck group of a smooth complete toric Deligne-Mumford stack is torsion free. This statement holds when the generic point is stacky. We also construct an example of open toric stack with torsion in K-theory. This is a part of the author’s Ph.D thesis. A similar result has been proved by Goldin, Harada, Holm, Kimura and Knutson in [GHHKK] using symplectic methods. ## 2 Grothendieck groups of reduced stacks Let $N$ be a free abelian group of rank $d$ and $N_{\mathbb{R}}=N\otimes{\mathbb{R}}$. Given a complete simplicial fan $\Sigma$ in $N_{\mathbb{R}}$, one chooses an integral element $v_{i}$ in each of the one-dimensional cones of $\Sigma$. This defines a stacky fan $\bf{\Sigma}$ in the sense of [BCS]. We denote the corresponding toric Deligne-Mumford stack by ${\mathcal{X}}_{\bf\Sigma}$. Recall the Grothendieck group $K_{0}({\mathcal{X}}_{\bf\Sigma})$ is defined to be the free abelian group generated by all formal combinations of coherent sheaves on ${\mathcal{X}}_{\bf\Sigma}$ modding out by the short exact sequences. Each element $v_{i}$ corresponds to a toric invariant divisor $E_{i}$. This divisor $E_{i}$ determines an invertible sheaf ${\mathcal{O}}(E_{i})$. We denote its equivalent class in $K_{0}({\mathcal{X}}_{\bf\Sigma})$ by $R_{i}$. The ring structure of $K_{0}({\mathcal{X}}_{\bf\Sigma})$ is given by tensor product of coherent sheaves. K-theory of smooth toric stacks has been studied in [BH]. In particular they computed $K_{0}({\mathcal{X}}_{\bf\Sigma})$ explicitly by writing out its generators and relations. ###### Theorem 2.1. [BH] Let $B$ be the quotient of the Laurent polynomial ring ${\mathbb{Z}}[x_{1},x_{1}^{-1},\ldots,x_{n},x_{n}^{-1}]$ by the ideal generated by the relations * • $\prod_{i=1}^{n}x_{i}^{\langle m,v_{i}\rangle}=1$ for any dual vector $m\in M=Hom(N,{\mathbb{Z}})$, * • $\prod_{i\in S}(1-x_{i})=0$ for any set $S\subseteq[1,\ldots,n]$ such that $\\{v_{i}|i\in S\\}$ are not contained in any cone of $\Sigma$. Then the map from $B$ to $K_{0}({\mathcal{X}}_{\bf\Sigma})$ which sends $x_{i}$ to $R_{i}$ is an isomorphism of rings. Our main result is the following. ###### Theorem 2.2. The Grothendieck group $K_{0}({\mathcal{X}}_{\bf\Sigma})$ of a complete smooth toric Deligne-Mumford stack ${\mathcal{X}}_{\bf\Sigma}$ is a free ${\mathbb{Z}}$ module. ###### Proof. We denote the Laurent polynomial ring ${\mathbb{Z}}[x_{1},x_{1}^{-1},\ldots,x_{n},x_{n}^{-1}]$ by $R$. Let $A=R/I$, where $I$ is generated by $\prod_{i\in S}(1-x_{i})=0$ for any set $S\subseteq[1,\ldots,n]$ such that $\\{v_{i}|i\in S\\}$ are not contained in any cone of $\Sigma$. And $B=A/J$, where $J$ is generated by $n$ Laurent polynomials ${h_{j}=\prod_{i=1}^{n}x_{i}^{\langle m_{j},v_{i}\rangle}-1}$ where $m_{j}$ is an integral basis of $M$. First we want to replace $h_{j}$ by $g_{j}=\prod_{<m_{j},v_{i}>>0}x_{i}^{<m_{j},v_{i}>}-\prod_{<m_{j},v_{i}><0}x_{i}^{-<m_{j},v_{i}>}$. They generate the same ideal $J$ but this collection avoids negative powers. To prove $B$ is a free ${\mathbb{Z}}$ module we need to show that the multiplication map $B\rightarrow pB$ is an injection for any prime $p$. Let $K(g_{1},\ldots,g_{d})$ and $K(g_{1},\ldots,g_{d},p)$ be the Koszul complexes for sequences ${g_{1},\ldots,g_{d}}$ and ${g_{1},\ldots,g_{d},p}$ of elements of the ring $A$. These two Koszul complexes are related by the following lemma. ###### Lemma 2.3. [E] Let $\phi:K(g_{1},\ldots,g_{d})\rightarrow K(g_{1},\ldots,g_{d})$ be the map of multiplication by $p$. Then $K(g_{1},\ldots,g_{d},p)$ equals $Cone(\phi)[-1]$. Here Cone means mapping cone of complexes. ###### Proof. See corollary 17.11. of [E]. ∎ According to this lemma, we get a long exact sequence of cohomology groups: $\begin{CD}\ldots @>{}>{}>H^{i}(K(g_{1},\ldots,g_{d},p))@>{}>{}>H^{i}(K(g_{1},\ldots,g_{d}))\\\ @>{\phi}>{}>H^{i}(K(g_{1},\ldots,g_{d}))@>{}>{}>H^{i+1}(K(g_{1},\ldots,g_{d},p))@>{}>{}>\ldots\end{CD}$ (2.1) We will show that all the cohomology groups of $K(g_{1},\ldots,g_{d})$ and $K(g_{1},\ldots,g_{d},p)$ vanish except at one position. More precisely, the only non vanishing piece of (2.1) is: $\begin{CD}0@>{}>{}>H^{n}(K(g_{1},\ldots,g_{d},p))\cong B@>{p}>{}>H^{n}(K(g_{1},\ldots,g_{d}))\cong B\\\ @>{}>{}>H^{n+1}(K(g_{1},\ldots,g_{d},p))\cong B/pB@>{}>{}>0\end{CD}$ To prove this we need a result about Cohen-Macaulay properties of Stanley- Reisner rings. ###### Theorem 2.4. Let $A^{\prime}={\mathbb{Z}}[x_{1},\ldots,x_{n}]/I$. Ring $A^{\prime}$ is Cohen-Macaulay. ###### Proof. If we make a change of variables $x_{i}$ to $1-x_{i}$, then we see that $A^{\prime}$ is nothing but the Stanley-Reisner ring associated to supporting polytope of $\Sigma$. It is a general fact that the Stanley-Reisner ring of polytopes are CM over any field(See Chapter 5 of [BrHe]). Furthermore one can show it is actually CM over ${\mathbb{Z}}$(See Exercise 5.1.25 of [BrHe]). We will sketch the solution of this exercise in the following remark. ∎ ###### Remark 2.5. Consider the flat morphism ${\mathbb{Z}}\to A^{\prime}$. For any maximal ideal $\mathfrak{q}\subset A^{\prime}$, we have $\mathfrak{q}\cap{\mathbb{Z}}=(p)$. In order to show $A^{\prime}$ is CM it suffices to check it for each fiber, i.e. $A^{\prime}_{\mathfrak{q}}/pA^{\prime}_{\mathfrak{q}}$ is CM for all the maximal ideal $\mathfrak{q}$. If $(p)$ is not $(0)$ then $A^{\prime}_{\mathfrak{q}}/pA^{\prime}_{\mathfrak{q}}=(A^{\prime}\otimes{\mathbb{Z}}/p{\mathbb{Z}})_{\mathfrak{q}}$. It is CM because Stanley-Reisner ring over the field is CM. So we just need to show that for any maximal ideal $\mathfrak{q}$, the restriction $\mathfrak{q}\cap{\mathbb{Z}}$ is not $(0)$. Suppose this is the case, we will have an inclusion ${\mathbb{Z}}\to A^{\prime}/\mathfrak{q}$. However, since we assume $\mathfrak{q}\cap{\mathbb{Z}}=(0)$, the field $A^{\prime}/\mathfrak{q}$ must have characteristic zero. But this contradicts the fact that $A^{\prime}$ is finitely generated over ${\mathbb{Z}}$ because ${\mathbb{Q}}$ is not finitely generated over ${\mathbb{Z}}$. ###### Corollary 2.6. The ring $A$ is Cohen-Macaulay. ###### Proof. Because $A$ is a localization of $A^{\prime}$ and being CM ring is a local property, $A$ is CM by Theorem 2.4. ∎ ###### Remark 2.7. It follows from the general theory of Stanley Reisner ring (Theorem $5.1.16$ of [BrHe]) that $A^{\prime}$ has Krull dimension $d+1$. ###### Lemma 2.8. [E] Suppose $M$ is a finitely generated module over ring $A$ and $I=(x_{1},\ldots,x_{n})\subset A$ is a proper ideal. If $depth(I)=r$ then $H^{i}(M\bigotimes K(x_{1},\ldots,x_{n}))=0$ for $i<r$, while $H^{r}(M\bigotimes K(x_{1},\ldots,x_{n}))=M/IM$. ###### Lemma 2.9. The quotient $A/J$ is a finitely generated abelian group. ###### Proof. Let ${\bf k}$ be any field and $f$ be an arbitrary map from $A/J$ to ${\bf k}$. Maximal ideals of $A/J$ are in one to one correspondence with such map $f$. We want to solve for $(x_{1},\ldots,x_{n})$ that satisfy equations in ideal $I$ and $J$ in the field ${\bf k}$. Recall elements of ideal $I$ are in form of $\prod_{i\in S}(1-x_{i})$ for any subset $S\subseteq[1,\ldots,n]$ such that one dimensional rays $v_{i},i\in S$ are not contained in any cone of $\Sigma$. So $x_{i}$ equals 1 outside some cone $\sigma$. Then equations in $J$ reduce to $\prod_{v_{i}\in\sigma}x_{i}^{\langle m,v_{i}\rangle}$=1. We can choose the dual vector $m$ such that $\langle m,v_{i}\rangle=0$ for all but one $i$. Say $\langle m,v_{i}\rangle=d_{i}$. The number $d_{i}$ only depends on the fan but not on the field ${\bf k}$. This implies that $1-x_{i}^{d_{i}}$ maps to 0 for any map $f$ from $A/J$ to ${\bf k}$, i.e. $1-x_{i}^{d_{i}}$ is contained in any maximal ideal of $A/J$. Because $A/J$ is a finitely generated ${\mathbb{Z}}$ algebra the Jacobson radical coincides with nilradical. So $(1-x_{i}^{d_{i}})^{N}$=0 for any $i$. We can pick a large enough integer $N$ uniformly for any $x_{i}$ such that there exists a ${\mathbb{Z}}$ basis consisting of monomials with powers of each $x_{i}$ between 0 and $Nd_{i}$. This proves the statement of the lemma. ∎ By theorem 2.4, remark 2.7 and lemma 2.9 we can prove: ###### Corollary 2.10. The ideal $J=(g_{1},\ldots,g_{d})$ has depth $d$. ###### Proof. Because $A$ is CM, by the definition of CM rings $depth(J)=codim(J)$. The quotient $A/J$ is finitely generated over ${\mathbb{Z}}$, therefore, of Krull dimension one. By remark 2.7 $codim(J)=d$ and $depth(J)=d$. ∎ This corollary above together with lemma 2.8 imply the Koszul complex $K(g_{1},\ldots,g_{d})$ has only one nonzero cohomology $H^{d}(K(g_{1},\ldots,g_{d}))=B=A/J$. On the other hand, the lemma 2.9 imples $B/pB$ is a finite dimensional vector space over ${\mathbb{Z}}/p$. By similar argument with the corollary above we get $depth(J,p)=d+1$. Then $H^{i}(K(g_{1},\ldots,g_{d},p))=B/pB$ when $i=d+1$ and zero otherwise. Now by applying the long exact sequence (2.1) we prove the multiplication map by $p$ is an injection. This finish the proof of theorem 2.2. ∎ ###### Remark 2.11. The proof of theorem 2.2 can be generalized to the non complete toric stacks satsifying a condition called “shellability”. This is a combinatorial condition on the underlying simplicial complex of the toric stack(See [BrHe] for details of this definition). It is proved in [BrHe] that Stanley-Reisner rings of shellable simplicial complexes are Cohen-Macaulay. However, we will see in Chapter 4 that Grothendieck groups of open toric stacks are not necessarily free. ## 3 Grothendieck groups of non-reduced stacks Now we remove the assumption that $N$ is a free abelian group. Then the corresponding toric stack will have nontrivial stabilizer at the generic point. We will generalize theorem 2.2 to this setting. Recall the derived Gale dual of the homomorphism $\beta:{\mathbb{Z}}^{n}\to N$ is the homomorphism $\beta^{\vee}:({\mathbb{Z}}^{n})^{\vee}\to DG(\beta)$. When $N$ is torsion free, $DG(\beta)$ is the Picard group. The general definition of $DG(\beta)$ involves a projective resolution of $N$. We refer to [BCS] for details. Theorem 2.1 can be generalized to the case when $N$ has torsion. Notice the ring ${\mathbb{Z}}[x_{1},x_{1}^{-1},\ldots,x_{n},x_{n}^{-1}]/J$ is the representation ring of the algebraic group $Hom(DG(\beta),{\mathbb{C}}^{*})$ when $N$ is torsion free. If $N$ has torsion then $Hom(DG(\beta),{\mathbb{C}}^{*})$ maps to $({\mathbb{C}}^{*})^{n}$ with finite kernel. After replacing ${\mathbb{Z}}[x_{1},x_{1}^{-1},\ldots,x_{n},x_{n}^{-1}]/J$ by the representation ring of $Hom(DG(\beta),{\mathbb{C}}^{*})$ we can generalize Theorem 2.1 to non reduced case(See section $6$ of [BH] for more details). ###### Theorem 3.1. Let $N$ be a finitely generated abelian group and $\bf\Sigma$ is a stacky fan in $N$. The Grothendieck Group $K_{0}({\mathcal{X}}_{\bf\Sigma})$ is a free ${\mathbb{Z}}$ module. ###### Proof. Let’s denote the $N_{free}$ for the quotient $N/torsion(N)$ and ${\mathcal{X}}_{red}$ for the reduced stack associated to $N_{free}$. Recall the Grothendieck group $K_{0}({\mathcal{X}}_{\bf\Sigma})$ is the quotient of representation ring of $Hom(DG(\beta),{\mathbb{C}}^{*})$ by the ideal $I$ generated by Stanley-Reisner relations. Let’s denote the Gale dual group of the reduced stack ${\mathcal{X}}_{red}$ by $DG(\beta_{red})$. The quotient map $N\to N_{free}$ induces an inclusion on Gale dual groups $DG(\beta_{red})\to DG(\beta)$, whose cokernel is isomorphic to $torsion(N)$. Now we see the Grothendieck groups $K_{0}({\mathcal{X}}_{\bf\Sigma})$ and $K_{0}({\mathcal{X}}_{red})$ are isomorphic to the group rings ${\mathbb{Z}}[DG(\beta)]$ and ${\mathbb{Z}}[DG(\beta_{red})]$. If we fix a lifting from $torsion(N)$ to $DG(\beta)$, then we get a coset decomposition $DG(\beta)=\sqcup_{y\in torsion(N)}(yDG(\beta_{red}))$. This induce a coset decomposition of the group ring ${\mathbb{Z}}[DG(\beta)]$ such that each coset is isomorphic with ${\mathbb{Z}}[DG(\beta_{red})]$. Since ${\mathbb{Z}}[DG(\beta_{red})]$ is torsion free by theorem 2.2, we prove the theorem. ∎ ## 4 Grothendieck groups of non complete stacks Theorem 2.1 holds for non complete toric stacks too. But our proof for freeness of K-theory relies on the shellability of the underlying simplicial complex of the toric stack. There are many non complete toric stacks whose underlying simplicial complexes are _not_ shellable. For example, we can take ${\mathbb{P}}^{1}\times{\mathbb{P}}^{1}$. Denote its four toric invariant divisors by $E_{1},E_{2},E_{3}$ and $E_{4}$. Let point $P$(resp. $Q$) be the intersection of $E_{1}$ and $E_{2}$(resp. $E_{3}$ and $E_{4}$). Simplicial complex of ${\mathbb{P}}^{1}\times{\mathbb{P}}^{1}\backslash\\{P,Q\\}$ is not shellable. Actually, there are examples of non complete toric stacks such that their Grothendieck groups have torsions. The following example is due to Lev Borisov. ###### Example 4.1. Let’s take a dimension five weighted projective stack ${\mathbb{P}}(1,1,1,1,2,2)$. Denote its toric invariant divisors by $E_{1},E_{2},\ldots,E_{6}$, where $E_{1},\ldots,E_{4}$ have weights one and $E_{5},E_{6}$ have weights two. Let ${\mathcal{X}}$ be the substack ${\mathbb{P}}(1,1,1,1,2,2)\backslash\\{(E_{1}\cap E_{2}\cap E_{3}\cap E_{4})\cup(E_{5}\cap E_{6})\\}$. By theorem 2.1 $K_{0}({\mathcal{X}})=\frac{{\mathbb{Z}}[t,t^{-1}]}{\langle(1-t)^{4},(1-t^{2})^{2}\rangle}$ It is easy to check that $t(1-t)^{2}$ is a torsion element. ## References * [BCS] L.A. Borisov, L. Chen, G.G. Smith, _The orbifold Chow ring of toric Deligne-Mumford stacks._ J. Amer. Math. Soc. 18 (2005), no. 1, 193–215. * [BH] L.A. Borisov, R.P. Horja, _On the $K$-theory of smooth toric DM stacks._ Snowbird lectures on string geometry, 21–42, Contemp. Math., 401, Amer. Math. Soc., Providence, RI, 2006. * [BrHe] W. Bruns, J. Herzog, _Cohen-Macaulay rings_. Cambridge Studies in advanced mathematics 39. Cambridge Univ. Press, Cambridge, 1993. * [E] D. Eisenbud, _Commutative Algebra with a View Toward Algebraic Geometry_ , GTM 150. * [GHHKK] R. Goldin, M. Harada, T. Holm, T. Kimura, A. Knutson. _MSRI talk on workshop in Combinatorial, Enumerative and Toric Geometry by Tara Holm_. Department of Mathematics, University of Wisconsin-Madison, Madison, WI, 53706, U.S. hua@math.wisc.edu
arxiv-papers
2009-04-18T06:34:00
2024-09-04T02:49:01.976660
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zheng Hua", "submitter": "Zheng Hua", "url": "https://arxiv.org/abs/0904.2824" }
0904.2837
# ASYMPTOTIC PROPERTIES OF RANDOM MATRICES OF LONG-RANGE PERCOLATION MODEL S.Ayadi LMV - Laboratoire de Mathématiques de Versailles, Université de Versailles Saint-Quentin-en-Yvelines, 78035 Versailles (FRANCE). E-mail: ayadi@math.uvsq.fr Abstract: We study the spectral properties of matrices of long-range percolation model. These are $N\times N$ random real symmetric matrices $H=\\{H(i,j)\\}_{i,j}$ whose elements are independent random variables taking zero value with probability $1-\psi\left((i-j)/b\right)$, $b\in\mathbb{R}^{+}$, where $\psi$ is an even positive function with $\psi(t)\leq{1}$ and vanishing at infinity. We study the resolvent $G(z)=(H-z)^{-1},\ Imz\neq{0}$ in the limit $N,b\rightarrow\infty$, $b=O(N^{\alpha}),\ 1/3<\alpha<1$ and obtain the explicit expression $T(z_{1},z_{2})$ for the leading term of the correlation function of the normalized trace of resolvent $g_{N,b}(z)=N^{-1}TrG(z)$. We show that in the scaling limit of local correlations, this term leads to the expression $(Nb)^{-1}T(\lambda+r_{1}/N+i0,\lambda+r_{2}/N-i0)=b^{-1}\sqrt{N}|r_{1}-r_{2}|^{-3/2}(1+o(1))$ found earlier by other authors for band random matrix ensembles. This shows that the ratio $b^{2}/N$ is the correct scale for the eigenvalue density correlation function and that the ensemble we study and that of band random matrices belong to the same class of spectral universality. AMS Subject Classifications: 15A52, 45B85, 60F99. Key Words: random matrices, asymptotic properties, percolation model. running title: Asymptotic properties for percolation model. ## 1 Introduction Random matrices play an important role in various fields of mathemathics and physics. The eigenvalue distribution of large matrices was initially considered by E.Wigner to model the statistical properties of the energy spectrum of heavy nuclei (see e.g. the collection of early papers [27]). Further investigations have led to numerous applications of random matrices of infinite dimensions in such branches of theoretical physics as statistical mechanics of disordered spin systems, solid state physics, quantum chaos theory, quantum field theory and others (see monographs and reviews [3, 9, 12, 14]). In mathematics, the spectral theory of random matrices has revealed deep links with the orthogonal polynomials theory, integrable systems, representation theory, combinatorics, free probability theory, and others [4, 11, 28, 30]. The first result of the spectral theory of large random matrices concerns the eigenvalue distribution of the Wigner ensemble $A_{N}$ of $N\times N$ real symmetric matrices of the form $A_{N}(i,j)=\frac{1}{\sqrt{N}}a(i,j),\quad|i|,|j|\leq{n},$ (1.1) where $N=2n+1$ and $\\{a(i,j);\ -n\leq{i}\leq{j}\leq{n}\\}$ are independent and identically distributed random variables defined on the same probability space $(\Omega,\mathfrak{F},{\bf P})$ such that ${\bf E}\\{a(i,j)\\}=0,\quad{\bf E}\\{a(i,j)^{2}\\}=v^{2}(1+\delta_{ij}),$ (1.2) where $\delta_{ij}=\left\\{\begin{array}[]{lll}0&\textrm{if}&i\neq{j},\\\ 1&\textrm{if}&i=j\end{array}\right.$ is the Kronecker symbol and ${\bf E}\\{\cdot\\}$ is the mathematical expectation with respect to ${\bf P}$. Denoting by $\lambda^{(n)}_{-n}\leq{\ldots}\leq{\lambda^{(n)}_{n}}$ the eigenvalues of $A_{N}$, the normalized eigenvalue counting function is defined by $\sigma_{n}(\lambda,A_{N})=N^{-1}\sharp\\{\lambda^{(n)}_{j}\leq{\lambda}\\}.$ (1.3) E.Wigner [31] proved that if $a(i,j)$ has all order finite moments, the eigenvalue counting measure $d\sigma_{n}(\lambda,A_{N})$ converges weakly in average as $n\rightarrow\infty$ to a distribution $d\sigma_{sc}(\lambda)$, where the nondecreasing function $\sigma_{sc}(\lambda)$ is differentiable and its derivative $\rho_{sc}$ is given by $\rho_{sc}{(\lambda)}=\sigma_{sc}^{{}^{\prime}}(\lambda)=\frac{1}{2\pi v^{2}}\left\\{\begin{array}[]{lll}\sqrt{4v^{2}-\lambda^{2}}&\textrm{if}&|\lambda|\leq{2\sqrt{v^{2}}},\\\ 0&\textrm{if}&|\lambda|>2v.\end{array}\right.$ (1.4) This limiting distribution (1.4) is known as the Wigner distribution, or the semicircle law. A proof of the Wigner’s result based on the resolvent technique is given in [26, 22, 23]. Important generalizations of the Wigner’s ensemble are given by the band and dilute random matrix ensembles [20]. In the band random matrices model, the matrix elements take zero value outside the band of width $b_{n}$ along the principal diagonal, for some positive sequence $(b_{n})_{n\geq{0}}$ of real numbers. This ensemble can be obtained from $A_{N}$ (1.1) by multiplying each $a(i,j)$ by $I_{(-1/2,1/2)}\left((i-j)/b_{n}\right)$, where $I_{B}(t)=\left\\{\begin{array}[]{lll}1&\textrm{if}&t\in{B},\\\ 0&\textrm{if}&t\in\mathbb{R}\setminus B\end{array}\right.$ is the indicator function of the interval $B$. The ensemble of dilute random matrices can be obtained from $A_{N}$ (1.1) by multiplying $a(i,j)$ by independent Bernoulli random variables of parameter $p_{n}/N$. Assuming that $b(n)=o(n)$ for large $n$, the semicircle law is observed for both ensembles, in the limit $b_{n}\rightarrow\infty$ (see [25]) and $p_{n}\rightarrow\infty$ as $n\rightarrow\infty$ (see [20]). The crucial observation made numerically [7] and then supported in the theoretical physics (see [13, 29]) is that the ratio $b^{2}/n$ is the critical one for the corresponding transition in spectral properties of band random matrices. In [16], it was proved that the ratio $\tilde{\alpha}=\lim_{n\rightarrow\infty}b^{2}/n$ naturally arises when one considers the leading term of this correlation function on the local scale. This can be regarded as the support of the conjecture that the local properties of spectra of band random matrices depend on $\tilde{\alpha}$. Let us describe our results in more details. We are interested in a generalization of the both ensembles mentioned above. Roughly speaking, we consider the band random matrices with a random width. To proceed, we consider the ensemble $\\{H_{n,b}\\}$ of random $N\times N$ matrices, $N=2n+1$ whose entries $H_{n,b}$ is obtained as follows: we multiply each matrix element $a(i,j)$ by some Bernoulli random variable $d_{b}(i,j)$ with parameter $\psi\left((i-j)/b\right)$. The family $\\{d_{b}(i,j);\ |i|,|j|\leq{n}\\}$ can be regarded as the adjacency matrix of the family of random graphs $\\{\Gamma_{n}\\}$ with $N=2n+1$ vertices $(i,j)$ such that the average number of edges attached to one vertex is $b_{n}$. Hence, each edge $e(i,j)$ of the graph is present with probability $\psi\left((i-j)/b\right)$ and not present with probability $1-\psi\left((i-j)/b\right)$. Below are some well known examples: 1. $-$ In theoretical physics, the ensemble $\\{\Gamma_{n}\\}$ with $\psi(t)=e^{-|t|^{s}}$ is referred to as the Long-Range Percolation Model (see for example [8] and references therein). Our ensemble can be regarded as a modification of the adjacency matrices of $\\{\Gamma_{n}\\}$. To our best knowledge, the spectral properties of this model has not been studied yet. 2. $-$ It is easy to see that if one takes $b_{n}=N$ and $\psi\equiv 1$, then one recovers the Wigner ensemble $(1.1)$. 3. $-$ If one considers $\psi(t)=I_{(-1/2,1/2)}(t)$, one gets the band random matrix ensemble [25]. In present paper, we consider the resolvent $G_{n,b}=\left(H_{n,b}-zI\right)^{-1}$ and study the asymptotic expansion of the correlation function $C_{n}(z_{1},z_{2})={\bf E}\\{g_{n,b}(z_{1})g_{n,b}(z_{2})\\}-{\bf E}\\{g_{n,b}(z_{1})\\}{\bf E}\\{g_{n,b}(z_{2})\\},$ where we denoted $g_{n,b}=N^{-1}\mathrm{Tr}G_{n,b}(z)$. Keeping $z_{l}$ far from the real axis, we consider the leading term $T(z_{1},z_{2})$ of this expansion and find explicit expression for it. This term $T(r_{1}+i0,r_{2}-i0)$ regarded on the local scale $r_{1}-r_{2}=r/N$ exhibits different behavior depending on the rate of decay of the profile function $\psi(t)$. Our main conclusion is that if $\psi(t)\sim|t|^{-1-\nu}$ as $t\rightarrow\infty$, then the value $\nu=2$ separates two major cases. If $\nu\in(1,2)$, then the limit of $T(r)$ depend on $\nu$. If $\nu\in(2,+\infty)$, then $\frac{1}{Nb}T(r)=-const\cdot\frac{\sqrt{N}}{b}\cdot\frac{1}{|r|^{3/2}}(1+o(1)).$ This asymptotic expression coincides with the result obtained in [16] for band random matrices. Then one can conclude that the ensemble under consideration and the band random matrix ensemble belong to the same universality class. The outline of this paper is as follows. In section 2, we define the random matrix ensemble $H_{n,b}$ of long-range percolation model, we state our main results and describe the scheme of their proofs. In section 3, we study the correlation function $C_{n,b}(z_{1},z_{2})$ and obtain the main relation for it. In section 4, we show that ${\bf Var}\\{g_{n,b}(z)\\}$ is bounded by $(Nb)^{-1}$ and find the leading term $T(z_{1},z_{2})$ of the correlation function under the moment condition that $\sup_{i,j}{\bf E}|a(i,j)|^{14}<\infty$. In section 5, we prove the auxiliary facts used in section 4. Expressions derived in section 4 are analyzed in section 6, where the asymptotic behavior of $T(z_{1},z_{2})$ is studied and the issue of the universal bihaviour is discussed. ## 2 The ensemble, main results and technical tools ### 2.1 The ensemble and main results Let us consider a family of independent real random variables ${\cal A}_{n}=\\{a(i,j);\ |i|,|j|\leq{n}\\}$ satisfying (1.1). Let $\psi(t)$, $t\in\mathbf{R}$, be a real continuous even function such that: $0\leq{\psi{(t)}}\leq{1},\quad\int_{\mathbb{R}}\psi{(t)}dt=1.$ (2.1) Given real $b>0$, we introduce a family of independent Bernoulli random variables ${\cal D}_{b}=\\{d_{b}(i,j);\ |i|,|j|\leq{n}\\}$ with the law $d_{b}(i,j)=\left\\{\begin{array}[]{lll}1&\textrm{with probability}&\psi\left((i-j)/b\right)\\\ 0&\textrm{with probability}&1-\psi\left((i-j)/b\right).\end{array}\right.$ (2.2) This family is independent of the family ${\cal A}_{n}$. We assume that ${\cal A}_{n}$ and ${\cal D}_{n}$ are defined on the same probability space $(\Omega,\mathfrak{F},{\bf P})$ and we denote by ${\bf E}\\{\cdot\\}$ the mathematical expectation with respect to ${\bf P}$. We define a real symmetric $N\times N$ random matrix $H_{n,b}$ by equality: $H_{n,b}(i,j)=\frac{1}{\sqrt{b}}a(i,j)d_{b}(i,j),\quad i\leq{j},\quad|i|,|j|\leq{n},$ (2.3) where $b\leq{N}$, $N=2n+1$. Here and below the family $\\{H_{n,b}\\}$ is referred to as the ensemble of random matrices of long-range percolation model. In what follows, we will need the existence of several absolute moments of $a(i,j)$ that we denote by $\mu_{l}=\sup_{|i|,|j|\leq{n}}{\bf E}\\{|a(i,j)|^{l}\\},$ (2.4) where the upper bound for $l$ will be specified later. We consider the resolvent $G_{n,b}(z)=(H_{n,b}-z)^{-1},\quad\mathrm{Im}z\neq{0}.$ Its normalized trace $g_{n,b}(z)$ coincides with the Stieltjes transform of the normalized eigenvalue counting function $\sigma_{n,b}(\lambda;H_{n,b})$ (1.3): $g_{n,b}(z)=\frac{1}{N}\mathrm{Tr}G_{n,b}(z)=\int(\lambda-z)^{-1}d\sigma_{n,b}(\lambda,H_{n,b}),\ \mathrm{Im}z\neq{0}.$ (2.5) In [1], we have proved that if $\mu_{3}<\infty$ (2.4) and $1\ll b\ll N$, then $\lim_{n,b\rightarrow\infty}{\bf E}\\{g_{n,b}(z)\\}=w(z)$ for $z\in\Lambda_{\eta}$, where $\Lambda_{\eta}=\\{z\in\mathbf{C}:\ \eta\leq{|\mathrm{Im}z|}\\},\quad\eta=2v+1$ (2.6) and the limiting function $w(z)$ verifies equation $w(z)=\frac{1}{-z-v^{2}w(z)}$ (2.7) with $v$ is determined by (1.2). Equation (2.7) has a unique solution in the class of functions such that $\mathrm{Im}w(z)\mathrm{Im}z>0$, $\mathrm{Im}z\neq{0}$. This solution $w(z)$ is the Stieltjes transform of the semi-circle distribution (1.4). This result shows that the semi-circle law is valid for random matrices of long-range percolation model. As a by-product of proof, we have shown that ${\bf Var}\\{g_{n,b}(z)\\}=o(1),\ \quad z\in\Lambda_{\eta},\quad\hbox{ as }\quad n,b\rightarrow\infty$ (2.8) and that the convergence $g_{n,b}(z)\rightarrow{w(z)}$ holds in probability. In this paper, we improve the result (2.8) in two stages. On the first one we show that ${\bf Var}\\{g_{n,b}(z)\\}=O\left((Nb)^{-1}\right)$ in the limit $n,b\rightarrow\infty$ such that $b=O\left(n^{\alpha}\right),\quad 1/3<\alpha<1$ (2.9) and this gives the convergence $g_{n,b}(z)\rightarrow{w(z)}$ with probability 1. Next, we find the explicit form of the leading term of the correlation function $C_{n,b}(z_{1},z_{2})={\bf E}\\{g_{n,b}(z_{1})g_{n,b}(z_{2})\\}-{\bf E}\\{g_{n,b}(z_{1})\\}{\bf E}\\{g_{n,b}(z_{2})\\}.$ We now formulate the main result of the paper, where we denote $w_{1}=w(z_{1})$ and $w_{2}=w(z_{2})$ are given by (2.7). ###### Theorem 2.1. Let ${\cal A}_{n}$ be such that, in addition to (1.2), the following properties are verified : ${\bf E}\\{a(i,j)^{3}\\}={\bf E}\\{a(i,j)^{5}\\}=0,\quad{\bf E}\\{a(i,j)^{2m}\\}=V_{2m}(1+\delta_{ij})^{m},\quad m=2,3$ (2.10) for all $i\leq{j}$, $\mu_{14}<\infty$ (2.4) and $\int_{\mathbb{R}}\sqrt{\psi(t)}dt<\infty.$ Then in the limit $n,b\rightarrow\infty$ (2.9) and for $z_{l}\in\Lambda_{\eta}$ (2.6), $l=1,2$, equality $C_{n,b}(z_{1},z_{2})=\frac{1}{Nb}T(z_{1},z_{2})+o\left(\frac{1}{Nb}\right)$ (2.11) holds with $T$ is given by the formula $T(z_{1},z_{2})=Q(z_{1},z_{2})+\frac{2\Delta w_{1}^{3}w_{2}^{3}}{(1-v^{2}w_{1}^{2})(1-v^{2}w_{2}^{2})}$ (2.12) with $Q(z_{1},z_{2})=\frac{v^{2}w_{2}^{2}w_{1}^{2}}{\pi(1-v^{2}w_{1}^{2})(1-v^{2}w_{2}^{2})}\int_{\mathbb{R}}\frac{\tilde{\psi}(p)}{[1-v^{2}w_{1}w_{2}\tilde{\psi}(p)]^{2}}dp,$ (2.13) where $\tilde{\psi}(p)$ is the Fourier transform of $\psi$ $\tilde{\psi}(p)=\int_{\mathbb{R}}\psi(t)e^{ipt}dt$ and $\Delta=V_{4}\int_{\mathbb{R}}\psi(t)dt-3v^{4}\int_{\mathbb{R}}\psi^{2}(t)dt.$ (2.14) Under this conditions, Theorem 2.1 and relation (2.12) remain true with $\Delta$ replaced by $\lim_{n,b\rightarrow\infty}\sup_{|i|\leq{n}}\left(b\sum_{|j|\leq{n}}{\bf E}\\{H(i,j)^{4}\\}-3{\bf E}\\{H(i,j)^{2}\\}^{2}\right)$ $=\lim_{n,b\rightarrow\infty}\sup_{|i|\leq{n}}\left(\frac{1}{b}\sum_{|j|\leq{n}}(1+\delta_{ij})^{2}\left[V_{4}\psi(\frac{i-j}{b})-3v^{4}\psi(\frac{i-j}{b})^{2}\right]\right).$ We would like to note that the form of (2.12) generalizes the expressions obtained in [16] and [19]. Namely, the term $Q(z_{1},z_{2})$ is derived for the case when the entries of random matrices $H$ are gaussian random variables. The ensemble we consider is very similar to the band random matrices, but it represents a different model. The form of the last term is exactly the same as the one obtained in [19] for the Wigner random matrices. This shows that this term " forgets " the band-like structure of our matrices. All our computations and formulas are valid in the case of band random matrices $H_{n,b}(i,j)=b^{-1/2}a(i,j)[\psi\left((i-j)/b\right)]^{1/2}$ with not necessarily gaussian $a(i,j)$. Therefore Theorem 2.1 generalizes the results of paper [16]. In the case of band random matrices, one obtains the same expressions (2.11) and (2.12) with $\Delta$ (2.14) replaced by $\Delta_{band}=(V_{4}-3v^{4})\int\psi^{2}(t)dt$, provided $a(i,j)$ are the same as in Theorem 2.1. The results of Theorem 2.1 are used to study the universality properties of eigenvalue distribution. We do this in Section 6. ### 2.2 Cumulant expansions and resolvent identities We prove Theorem 2.1 and Theorem 2.2 by using the method proposed in papers [19, 20] and further developed in a series of works [1, 16]. The basic tools of this method are given by the resolvent identities combined with the cumulant expansions technique. #### 2.2.1 The cumulant expansions formula Let us consider a family $\\{X_{t}:\ t=1,\ldots,m\\}$ of independent real random variables defined on the same probability space such that ${\bf E}\\{|X_{t}|^{q+2}\\}<\infty$ for some $q\in\mathbb{N}$ and $t=1,\ldots,m$. Then for any complex-valued function $F(u_{1},\ldots,u_{m})$ of the class $\mathcal{C}_{\infty}(\mathbb{R}^{m})$ and for all $j$, one has ${\bf E}\\{X_{t}F(X_{1},\ldots,X_{m})\\}=\sum_{r=0}^{q}\frac{K_{r+1}}{r!}{\bf E}\left\\{\frac{\partial^{r}F(X_{1},\ldots,X_{m})}{(\partial{X_{t}})^{r}}\right\\}+\epsilon_{q}(X_{t}),$ (2.15) where $K_{r}=Cum_{r}(X_{t})$ is the r-th cumulant of $X_{t}$ and the remainder $\epsilon_{q}(X_{t})$ can be estimated by inequality $|\epsilon_{q}(X_{t})|\leq{C_{q}\sup_{U\in\mathbb{R}^{m}}\left|\frac{\partial^{q+1}F(U)}{\partial{u_{t}^{q+1}}}\right|{\bf E}\\{|X_{t}|^{q+2}\\}},$ (2.16) where $C_{q}$ is a constant. Relations (2.15) and (2.16) can be proved by multiple using of the Taylor’s formula (see [1, 19] for the proofs). ###### Remark 2.1. The cumulants $K_{r}$ can be expressed in terms of the moments $\breve{\mu}_{r}={\bf E}(X_{t}^{r})$ of $X_{t}$. Indeed, let $f_{t}$ be a complex-valued function of one real variable such that $f_{t}(x)=F(X_{1},\ldots,X_{t-1},x,X_{t+1},\ldots,X_{n})$ and $f_{t}^{(r)}$ is its r-th derivative. * $\bullet$ If $q=1$ and ${\bf E}\\{X_{t}\\}=0$, then $K_{1}=\breve{\mu}_{1}=0,\quad K_{2}=\breve{\mu}_{2}$ (2.17) and the remainder $\epsilon_{1}(X_{t})$ is given by: $\epsilon_{1}(X_{t})=\frac{1}{2}{\bf E}\left\\{X_{t}^{3}f_{t}^{(2)}(x_{0})\right\\}-K_{2}{\bf E}\left\\{X_{t}f_{t}^{(2)}(x_{1})\right\\}.$ (2.18) * $\bullet$ If $q=3$ and ${\bf E}\\{X_{t}\\}={\bf E}\\{X_{t}^{3}\\}=0$, then $K_{1}=K_{3}=0,\quad K_{2}=\breve{\mu}_{2},\quad K_{4}=\breve{\mu}_{4}-3\breve{\mu}^{2}_{2}$ (2.19) and the remainder $\epsilon_{3}(X_{t})$ is given by: $\displaystyle\epsilon_{3}(X_{t})=$ $\displaystyle\frac{1}{4!}{\bf E}\left\\{X_{t}^{5}f_{t}^{(4)}(x_{0})\right\\}-\frac{K_{2}}{3!}{\bf E}\left\\{X_{t}^{3}f_{t}^{(4)}(x_{1})\right\\}$ $\displaystyle-\frac{K_{4}}{3!}{\bf E}\left\\{X_{t}f_{t}^{(4)}(x_{2})\right\\}.$ (2.20) * $\bullet$ If $q=5$ and ${\bf E}\\{X_{t}\\}={\bf E}\\{X_{t}^{3}\\}={\bf E}\\{X_{t}^{5}\\}=0$, then the cumulants $K_{r}$, $r=1,\ldots,4$ are given by (2.19), $K_{5}=0,\quad K_{6}=\breve{\mu}_{6}-15\breve{\mu}_{4}\breve{\mu}_{2}+30\breve{\mu}^{3}_{2}$ (2.21) and the remainder $\epsilon_{5}(X_{t})$ is given by: $\displaystyle\epsilon_{5}(X_{t})=$ $\displaystyle\frac{1}{6!}{\bf E}\left\\{X_{t}^{7}f_{t}^{(6)}(x_{0})\right\\}-\frac{K_{2}}{5!}{\bf E}\left\\{X_{t}^{5}f_{t}^{(6)}(x_{1})\right\\}$ $\displaystyle-\frac{K_{4}}{(3!)^{2}}{\bf E}\left\\{X_{t}^{3}f_{t}^{(6)}(x_{2})\right\\}-\frac{K_{6}}{5!}{\bf E}\left\\{X_{t}f_{t}^{(6)}(x_{3})\right\\},$ (2.22) where for each $\nu=0,\ldots,3$, $x_{\nu}$ is a real random variable that depends on $X_{t}$ and such that $|x_{\nu}|\leq{|X_{t}|}$. In what follows, we denote $f_{t}^{(r)}(x_{\nu})=[\partial^{r}{F}/\partial{X_{t}^{r}}]^{(\nu)}$. #### 2.2.2 Resolvent identities For any two real symmetric $n\times n$ matrices $h$ and $\tilde{h}$ and any non-real $z$ the resolvent identity $(h-zI)^{-1}=(\tilde{h}-zI)^{-1}-(h-zI)^{-1}(h-\tilde{h})(\tilde{h}-zI)^{-1}$ (2.23) is valid. Regarding (2.23) with, $\tilde{h}=0$ and denoting $G=\left(h-zI\right)^{-1}$, we get equality $G(i,j)=\zeta\delta_{ij}-\zeta\sum_{s=1}^{n}G(i,s)h(s,j),\quad\zeta={-z^{-1}},$ (2.24) where $h(i,j),\ i,j=1,\ldots,n$ are the entries of the matrix $h$, $G(i,j)$ are the entries of the resolvent $G$ and $\delta$ denotes the Kronecker symbol. Using (2.23) we derive for $G=\left(h-zI\right)^{-1}$, $|\mathrm{Im}z|\neq{0}$ equality $\frac{\partial{G(s,t)}}{\partial{h(j,k)}}=-\frac{1}{1+\delta_{jk}}\left[G(s,j)G(k,t)+G(s,k)G(j,t)\right].$ (2.25) We will also need two more formulas based on (2.25); these are expressions for $\partial^{2}{G(i,j)}/\partial{h(j,i)^{2}}$ and $\partial^{3}{G(i,j)}/\partial^{3}{h(j,i)}$. We present them later. #### 2.2.3 The scheme of the proof of Theorem 2.1 In this subsection we present a schema of computation of the leading terms of $C_{n,b}(z_{1},z_{2})$ (cf. (2.11)). Let us denote $g_{l}=g_{n,b}(z_{l})$, $l=1,2$ (everywhere below, we omit the subscripts $n$,$b$ when no confusion can arise). For a given a random variable, we denote $\xi^{0}=\xi-{\bf E}\xi$. Then using identity ${\bf E}\\{\xi^{0}g^{0}\\}={\bf E}\\{\xi^{0}g\\},$ (2.26) we rewrite $C_{12}=C_{n,b}(z_{1},z_{2})$ as $C_{12}={\bf E}\\{g^{0}_{1}g_{2}\\}=\frac{1}{N}\sum_{|i|\leq{n}}R_{12}(i)$ with $R_{12}(i)={\bf E}\\{g^{0}_{1}G_{2}(i,i)\\}$. Applying the resolvent identity (2.23) to $G_{2}(i,i)$, we obtain equality $R_{12}(i)=-\zeta_{2}\sum_{|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}.$ (2.27) To compute ${\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}$, we use the cumulants expansion method (2.15), and get $\displaystyle{\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}=$ $\displaystyle K_{2}{\bf E}\left\\{\frac{\partial\left(g^{0}_{1}G_{2}(i,p)\right)}{\partial{H(p,i)}}\right\\}$ $\displaystyle+\frac{K_{4}}{6}{\bf E}\left\\{\frac{\partial^{3}\left(g^{0}_{1}G_{2}(i,p)\right)}{\partial{H(p,i)^{3}}}\right\\}+\tau_{ip},$ (2.28) where $K_{r}$ is the r-th cumulant of $H(p,i)$ and $\tau_{ip}$ vanishes. Substituting this equality in (2.27) and using (2.25), we obtain that $\displaystyle\frac{\partial\\{g^{0}_{1}G_{2}(i,p)\\}}{\partial{H(p,i)}}=$ $\displaystyle g^{0}_{1}\frac{\partial G_{2}(i,p)}{\partial{H(p,i)}}+G_{2}(i,p)\frac{1}{N}\sum_{|s|\leq{n}}\frac{\partial G_{1}(s,s)}{\partial{H(p,i)}}$ $\displaystyle=$ $\displaystyle-\frac{1}{1+\delta_{pi}}g^{0}_{1}[G_{2}(i,p)^{2}+G_{2}(i,i)G_{2}(p,p)]$ $\displaystyle-\frac{1}{1+\delta_{pi}}\left\\{\frac{2}{N}G^{2}_{1}(i,p)G_{2}(i,p)\right\\},$ (2.29) where we used (2.25) in the form $\frac{\partial\\{g^{0}_{1}G_{2}(i,p)\\}}{\partial{H(p,i)}}=\left\\{\frac{\partial\left(g^{0}_{1}G_{2}(i,p)\right)}{\partial{h(p,i)}}|_{h=H}\right\\}.$ We get relation $\displaystyle R_{12}(i)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\left\\{g^{0}_{1}G_{2}(i,i)\sum_{|p|\leq{n}}G_{2}(p,p)\frac{1}{b}\psi\left(\frac{p-i}{b}\right)\right\\}$ $\displaystyle+\frac{\zeta_{2}v^{2}}{b}\sum_{|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,p)^{2}\\}\psi\left(\frac{p-i}{b}\right)$ $\displaystyle+\frac{2\zeta_{2}v^{2}}{Nb}\sum_{|p|\leq{n}}{\bf E}\\{G_{1}^{2}(i,p)G_{2}(i,p)\\}\psi\left(\frac{p-i}{b}\right)$ $\displaystyle-\frac{\zeta_{2}}{6}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{\frac{\partial^{3}(g^{0}_{1}G_{2}(i,p))}{\partial{H(p,i)^{3}}}\right\\}+\Phi_{n,b}(i),$ (2.30) where $\sup_{|i|\leq{n}}|\Phi_{n,b}(i)|$ vanishes as $n,b\rightarrow\infty$ (2.9) (see subsection 3.2 for more details). Also we have taken into account that (cf. (2.19)) $K_{2}(p,i)=K_{2}\left(H_{n,b}(p,i)\right)=\frac{1}{b}{\bf E}\\{a(p,i)^{2}d_{n,b}(p,i)^{2}\\}=\frac{v^{2}}{b}\psi\left(\frac{p-i}{b}\right)(1+\delta_{pi}).$ Let us return to relation (2.30). We observe that the first term of the right- hand side (RHS) can be expressed in terms of $R_{12}$. This gives the possibility to obtain an equation of $R_{12}$. The second term vanishes in the limit $n,b\rightarrow\infty$ (we give later the explicit formulation). The third term represents the leading term of the correlations function (which provides the first expression of (2.12)). The fourth term gives the contribution of the order $O((Nb)^{-1})$ to (2.11) (which provides the second expression of the leading term (2.12)). The last term $\Phi_{n,b}(i)$ gives the contribution of the order $o((Nb)^{-1})$ to (2.11) (see Lemma 3.2). ## 3 Correlation function of the resolvent In this section we give the main relation of the correlation function $C_{n,b}(z_{1},z_{2})$. In what follows, we will need two elementary inequalities $|G(i,p)|\leq{||G||}\leq{\frac{1}{|\mathrm{Im}z|}},$ (3.1) and $\sum_{|p|\leq{n}}|G(i,p)|^{2}=||G\vec{e}_{i}||^{2}\leq{\frac{1}{|\mathrm{Im}z|^{2}}},\quad|i|\leq{n}$ (3.2) that hold for the resolvent of any real symmetric matrix. Here and below we consider $||e||_{2}^{2}=\sum_{i}|e(i)|^{2}$ and denote by $||G||=\sup_{||e||_{2}=1}||Ge||_{2}$ the corresponding operator norm. ### 3.1 Derivation of relations for $R_{12}(i)$ Let us consider the average ${\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}$. For each pair $(i,p)$, $g^{0}_{1}G_{2}(i,p)$ is a smooth function of $H(p,i)$. Its derivatives are bounded because of equation (2.25) and (3.1). In particular $|D^{6}_{pi}\\{\hat{g}^{0}_{1}\hat{G}_{2}(i,p)\\}|\leq{C\left(|\mathrm{Im}z_{1}|^{-1}+|\mathrm{Im}z_{2}|^{-1}\right)^{8}},$ where $C$ is an absolute constant. Here and thereafter we use the notation $D_{pi}$ for $\partial/\partial{H(p,i)}$. According to the definition of $H$ and the condition $\mu_{7}<\infty$ (2.4), the seven absolute moment of $H(p,i)$ is of order $1/(b^{7/2})$. Then we can apply (2.15) with $q=5$ to ${\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}$ and using (2.23), we get relation * $\bullet$ if $p<i$ $\displaystyle{\bf E}\\{g^{0}_{1}G_{2}(i,p)H(p,i)\\}=$ $\displaystyle K_{2}\left(H(p,i)\right){\bf E}\left\\{D^{1}_{pi}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}$ $\displaystyle+\frac{K_{4}\left(H(p,i)\right)}{6}{\bf E}\left\\{D^{3}_{pi}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}$ $\displaystyle+\frac{K_{6}\left(H(p,i)\right)}{120}{\bf E}\left\\{D^{5}_{pi}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}+\tilde{\epsilon}_{pi}$ (3.3) with $\displaystyle\tilde{\epsilon}_{pi}=$ $\displaystyle\frac{1}{6!}{\bf E}\left\\{H(p,i)^{7}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(0)}\right\\}$ $\displaystyle-\frac{K_{2}\left(H(p,i)\right)}{5!}{\bf E}\left\\{H(p,i)^{5}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(1)}\right\\}$ $\displaystyle-\frac{K_{4}\left(H(p,i)\right)}{(3!)^{2}}{\bf E}\left\\{H(p,i)^{3}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(2)}\right\\}$ $\displaystyle-\frac{K_{6}\left(H(p,i)\right)}{5!}{\bf E}\left\\{H(p,i)[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(3)}\right\\},$ (3.4) where the cumulants are given by (cf. (2.19)-(2.21)) $K_{2}\left(H(p,i)\right)=\frac{v^{2}}{b}\psi(\frac{p-i}{b})(1+\delta_{pi}),\quad K_{4}\left(H(p,i)\right)=\frac{\Delta_{pi}}{b^{2}}(1+\delta_{pi})^{2}$ (3.5) with $\Delta_{pi}=V_{4}\psi\left((p-i)/b\right)-3v^{4}\psi\left((p-i)/b\right)^{2}$ and $K_{6}\left(H(p,i)\right)=\frac{\theta_{pi}}{b^{3}}(1+\delta_{pi})^{3},$ (3.6) with $\theta_{pi}=V_{6}\psi\left((p-i)/b\right)-15V_{4}v^{2}\psi\left((p-i)/b\right)^{2}+30v^{6}\psi\left((p-i)/b\right)^{3}$. In (3.4), we have denoted for each pair $(p,i)$ $[g^{0}_{1}G_{2}(i,p)]^{(\nu)}=\\{g^{(\nu)}\\}^{0}_{pi}(z_{1})G^{(\nu)}_{pi}(i,p;z_{2}),\quad\nu=0,\ldots,3$ and $G^{(\nu)}_{pi}(z_{l})=(H^{(\nu)}_{pi}-z_{l})^{-1}$, $l=1,2$ with real symmetric $H^{(\nu)}_{pi}(r,s)=\left\\{\begin{array}[]{lll}H(r,s)&\textrm{if}&(r,s)\neq(p,i);\\\ H^{(\nu)}(p,i)&\textrm{if}&(r,s)=(p,i),\end{array}\right.$ where $|H^{(\nu)}(p,i)|\leq{|H(p,i)|}$, $\nu=0,\ldots,3$ (see subsection 2.2.1 for more detail). * $\bullet$ If $i<p$, then using equality $H(p,i)=H(i,p)$, we get $\displaystyle{\bf E}\\{g^{0}_{1}G_{2}(i,p)H(i,p)\\}=$ $\displaystyle K_{2}\left(H(i,p)\right){\bf E}\left\\{D^{1}_{ip}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}$ $\displaystyle+\frac{K_{4}\left(H(i,p)\right)}{6}{\bf E}\left\\{D^{3}_{ip}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}$ $\displaystyle+\frac{K_{6}\left(H(i,p)\right)}{120}{\bf E}\left\\{D^{5}_{ip}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}+\tilde{\tilde{\epsilon}}_{ip},$ (3.7) where $\tilde{\tilde{\epsilon}}_{ip}$ is given by (3.4) with replaced $D_{pi}$ by $D_{ip}$ and $K_{r}$ are the cumulants of $H(i,p)$ as in (3.5)-(3.6). * $\bullet$ If $p=i$, then $\displaystyle{\bf E}\\{g^{0}_{1}G_{2}(i,i)H(i,i)\\}=$ $\displaystyle K_{2}\left(H(i,i)\right){\bf E}\left\\{D^{1}_{ii}\left(g^{0}_{1}G_{2}(i,i)\right)\right\\}$ $\displaystyle+\frac{K_{4}\left(H(i,i)\right)}{6}{\bf E}\left\\{D^{3}_{ii}\left(g^{0}_{1}G_{2}(i,i)\right)\right\\}$ $\displaystyle+\frac{K_{6}\left(H(i,i)\right)}{120}{\bf E}\left\\{D^{5}_{ii}\left(g^{0}_{1}G_{2}(i,i)\right)\right\\}+\tilde{\tilde{\tilde{\epsilon}}}_{ii},$ (3.8) where $\tilde{\tilde{\tilde{\epsilon}}}_{ii}$ is given by (3.4) with replaced $D_{pi}$ by $D_{ii}$ and $K_{r}$ are the cumulants of $H(i,i)$ as in (3.5)-(3.6). Substituting (3.3), (3.7) and (3.8) into (2.27) and using (2.29), we obtain equality $\displaystyle R_{12}(i)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\left\\{g^{0}_{1}G_{2}(i,i)\sum_{|p|\leq{n}}G_{2}(p,p)\frac{1}{b}\psi\left(\frac{p-i}{b}\right)\right\\}$ $\displaystyle+\frac{\zeta_{2}v^{2}}{b}\sum_{|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,p)^{2}\\}\psi\left(\frac{p-i}{b}\right)$ $\displaystyle+\frac{2\zeta_{2}v^{2}}{Nb}\sum_{|p|\leq{n}}{\bf E}\\{G_{1}^{2}(i,p)G_{2}(i,p)\\}\psi\left(\frac{p-i}{b}\right)$ $\displaystyle-\frac{\zeta_{2}}{6}\sum_{|p|\leq{n}}\frac{\Delta_{pi}}{b^{2}}{\bf E}\left\\{D^{3}_{pi}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}-\frac{\zeta_{2}\Delta_{ii}}{2b^{2}}{\bf E}\left\\{D^{3}_{ii}\left(g^{0}_{1}G_{2}(i,i)\right)\right\\}$ $\displaystyle-\frac{\zeta_{2}}{120}\sum_{|p|\leq{n}}\frac{\theta_{pi}}{b^{3}}(1+\delta_{pi})^{3}{\bf E}\left\\{D^{5}_{pi}\left(g^{0}_{1}G_{2}(i,p)\right)\right\\}+\epsilon_{i}$ (3.9) with $\displaystyle\epsilon_{i}=$ $\displaystyle-\zeta_{2}\sum_{|p|\leq{n}}\frac{1}{6!}{\bf E}\left\\{H(p,i)^{7}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(0)}\right\\}$ $\displaystyle+\zeta_{2}\sum_{|p|\leq{n}}\frac{K_{2}}{5!}{\bf E}\left\\{H(p,i)^{5}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(1)}\right\\}$ $\displaystyle+\zeta_{2}\sum_{|p|\leq{n}}\frac{K_{4}}{(3!)^{2}}{\bf E}\left\\{H(p,i)^{3}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(2)}\right\\}$ $\displaystyle+\zeta_{2}\sum_{|p|\leq{n}}\frac{K_{6}}{5!}{\bf E}\left\\{H(p,i)[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(3)}\right\\},$ (3.10) where $K_{r}$ are the cumulants of $H(p,i)$ as in (3.5)-(3.6). ### 3.2 Main relation for $R_{12}(i)$ To give the complete description of $R_{12}$, we use the notation $U(p,i)=\frac{1}{b}\psi\left(\frac{p-i}{b}\right),\quad U_{G}(i)=\sum_{|p|\leq{n}}G(p,p)U(p,i)$ and introduce the identity ${\bf E}\\{\xi g\\}={\bf E}\\{\xi\\}{\bf E}\\{g\\}+{\bf E}\\{\xi g^{0}\\}.$ (3.11) Then, we rewrite the first term of the RHS of (3.9) in the form $\displaystyle\zeta_{2}v^{2}{\bf E}$ $\displaystyle\left\\{g^{0}_{1}G_{2}(i,i)\sum_{|p|\leq{n}}G_{2}(p,p)U(p,i)\right\\}$ $\displaystyle=\zeta_{2}v^{2}R_{12}(i){\bf E}\\{U_{G_{2}}(i)\\}+\zeta_{2}v^{2}{\bf E}\\{g^{0}_{1}G_{2}(i,i)U^{0}_{G_{2}}(i)\\}.$ Now computing the partial derivatives with the help of (2.25), we obtain the following relation for $R_{12}$ $\displaystyle R_{12}(i)=$ $\displaystyle\zeta_{2}v^{2}R_{12}(i){\bf E}\\{U_{G_{2}}(i)\\}+\zeta_{2}v^{2}{\bf E}\\{g^{0}_{1}G_{2}(i,i)U^{0}_{G_{2}}(i)\\}$ $\displaystyle+\frac{2\zeta_{2}v^{2}}{N}\sum_{|p|\leq{n}}F_{12}(i,p)U(p,i)+\frac{1}{Nb}\Upsilon_{12}(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i}$ (3.12) with $F_{12}(i,p)={\bf E}\\{G_{1}^{2}(i,p)G_{2}(i,p)\\}$, $\Upsilon_{12}(i)=\frac{\zeta_{2}}{b}\sum_{|p|\leq{n}}\Delta_{pi}{\bf E}\left\\{[G_{1}^{2}(i,i)G_{1}(p,p)+G_{1}^{2}(p,p)G_{1}(i,i)]G_{2}(i,i)G_{2}(p,p)\right\\},$ (3.13) the terms $Y_{r}(i)$, $r=1,\ldots,7$ are given by relations $\displaystyle Y_{1}(i)=$ $\displaystyle\frac{\zeta_{2}}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,i)^{2}G_{2}(p,p)^{2}\\}\Delta_{pi},$ $\displaystyle Y_{2}(i)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\left\\{g^{0}_{1}\sum_{|p|\leq{n}}G_{2}(i,p)^{2}U(p,i)\right\\},$ $\displaystyle Y_{3}(i)=$ $\displaystyle\frac{\zeta_{2}}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{g^{0}_{1}G_{2}(i,p)^{4}+6g^{0}_{1}G_{2}(i,p)^{2}G_{2}(i,i)G_{2}(p,p)\right\\}\Delta_{pi},$ $\displaystyle Y_{4}(i)=$ $\displaystyle\frac{2\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(i,p)G_{2}(i,p)^{3}+3G_{1}^{2}(i,p)G_{2}(i,p)G_{2}(i,i)G_{2}(p,p)\right\\}\Delta_{pi},$ $\displaystyle Y_{5}(i)=$ $\displaystyle\frac{2\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(i,p)G_{1}(i,p)G_{2}(i,p)^{2}+G_{1}^{2}(i,p)G_{1}(i,p)G_{2}(i,i)G_{2}(p,p)\right\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(i,i)G_{1}(p,p)G_{2}(i,p)^{2}+G_{1}^{2}(p,p)G_{1}(i,i)G_{2}(i,p)^{2}\right\\}\Delta_{pi}$ $\displaystyle+\frac{2\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(i,p)G_{1}(i,p)^{2}G_{2}(i,p)+G_{1}^{2}(i,i)G_{1}(p,p)G_{1}(i,p)G_{2}(i,p)\right\\}\Delta_{pi}$ $\displaystyle+\frac{2\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(i,p)G_{1}(p,p)G_{1}(i,i)G_{2}(i,p)\right\\}\Delta_{pi}$ $\displaystyle+\frac{2\zeta_{2}}{Nb^{2}}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}^{2}(p,p)G_{1}(i,i)G_{1}(i,p)G_{2}(i,p)\right\\}\Delta_{pi},$ $\displaystyle Y_{6}(i)=$ $\displaystyle-\frac{3\zeta_{2}}{b^{2}}\left({\bf E}\\{g_{1}^{0}G_{2}(i,i)^{4}\\}+\frac{1}{N}{\bf E}\\{G^{2}_{1}(i,i)G_{2}(i,i)^{3}\\}\right)\Delta_{ii}$ $\displaystyle-\frac{3\zeta_{2}}{Nb^{2}}{\bf E}\left\\{G^{2}_{1}(i,i)G_{1}(i,i)G_{2}(i,i)[G_{1}(i,i)+G_{2}(i,i)]\right\\}\Delta_{ii},$ $\displaystyle Y_{7}(i)=$ $\displaystyle-\frac{\zeta_{2}}{120}\sum_{|p|\leq{n}}\frac{\theta_{pi}}{b^{3}}(1+\delta_{pi})^{3}{\bf E}\left\\{D^{5}_{pi}(g^{0}_{1}G_{2}(i,p))\right\\}$ and $\epsilon_{i}$ given by (3.10). The first and the second terms of the RHS of (3.12) is expressed in terms of $R_{12}$ and this finally gives a closed relation for $R_{12}$. The third and forth terms of the RHS of (3.12) give a non-zero contribution to $R_{12}$ that provide the expression of the leading term $T(z_{1},z_{2})$ (2.12). We will compute this contribution later (see subsection 4.3). The two last terms of (3.12) contributes with $o((Nb)^{-1})$ to (2.11). We formalize this proposition in the following two statements. ###### Lemma 3.1. Under conditions of Theorem 2.1, the estimate $\max_{r=1,2}\left\\{\sup_{|i|\leq{n}}|Y_{r}(i)|\right\\}=O\left(b^{-2}n^{-1}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right).$ (3.14) is true in the limit $n,b\rightarrow\infty$ (2.9). We postpone the proof of Lemma 3.1 to the next section. ###### Lemma 3.2. Under conditions of Theorem 2.1, the estimate $\max_{r=3,4,5,6,7}\left\\{\sup_{|i|\leq{n}}|Y_{r}(i)|\right\\}=O\left(b^{-2}n^{-1}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right)$ (3.15) and $\sup_{|i|\leq{n}}|\epsilon_{i}|=O\left(b^{-2}n^{-1}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right)$ (3.16) are true in the limit $n,b\rightarrow\infty$ (2.9). Proof of Lemma 3.2. We start with (3.15). Inequality (3.1) and (3.2) implies that if $z_{l}\in\Lambda_{\eta}$, then $|Y_{3}(i)|\leq{\frac{7[V_{4}+3v^{4}]}{\eta^{3}b^{2}}\sum_{|p|\leq{n}}{\bf E}|g_{1}^{0}G_{2}(i,p)^{2}|}=O\left(\frac{1}{b^{2}}\\{{\bf Var}\\{g_{1}\\}\\}^{1/2}\right).$ To estimate $Y_{r}$, $r=4,5$, we use (3.1), (3.2) and inequality $\displaystyle\sum_{|i|\leq{n}}{\bf E}|G^{m}_{1}(i,p)G_{2}(i,p)|$ $\displaystyle\leq{{\bf E}\left(\sum_{|i|\leq{n}}|G^{m}_{1}(i,p)|^{2}\right)^{1/2}\left(\sum_{|i|\leq{n}}|G_{2}(i,p)|^{2}\right)^{1/2}}$ $\displaystyle\leq{\frac{1}{\eta^{m+1}}}$ (3.17) with $m=1,2$. Then we get that $|Y_{4}(i)|\leq{8[V_{4}+v^{4}]/(\eta^{6}Nb^{2})}$. Using (3.1), (3.2) and (3.17) with $m=1,2$, we obtain that the terms $\sup_{i}|Y_{r}(i)|$, $r=5,6$ are all of the order indicated in (3.15). Let us estimate $Y_{7}$. Let us accept for the moment that ${\bf E}|D^{5}_{pi}\\{g^{0}_{1}G_{2}(i,p)\\}|=O\left(N^{-1}+[{\bf Var}\\{g_{1}\\}]^{1/2}\right),\ \hbox{ as }\quad n,p\rightarrow\infty$ (3.18) holds. Using this estimate and relation (2.1), we obtain that $\sum_{|p|\leq{n}}\left|\frac{\theta_{pi}}{b}\right|\leq{c\sum_{|p|\leq{n}}\frac{1}{b}\psi\left(\frac{p-i}{b}\right)}=O(1)$ and that $\sup_{|i|\leq{n}}|Y_{7}(i)|=O\left(b^{-2}n^{-1}+b^{-2}\\{{\bf Var}\\{g_{1}\\}\\}^{1/2}\right)$ where $c$ is a constant. Now let use prove (3.18). Using (2.25) and (3.1), we get for $z_{1}\in\Lambda_{\eta}$ $D_{pi}\\{g^{0}_{1}\\}=\frac{1}{N}\sum_{|t|\leq{n}}D_{pi}\\{G_{1}(t,t)\\}=-\frac{2}{N}G^{2}_{1}(i,p)=O\left(\frac{1}{N}\right).$ It is easy to show that $D^{r}_{pi}\\{g^{0}_{1}\\}=O\left(\frac{1}{N}\right),\quad r=1,2,\ldots,\ z\in\Lambda_{\eta}.$ (3.19) Then (3.18) follows from (3.19) and (3.1). Estimate (3.15) is proved. To proceed with estimates of $\epsilon_{i}$ (3.16), we use the following simple statement, proved in the previous work [1]. ###### Lemma 3.3. (see [1]) If $z_{l}\in\Lambda_{\eta},\ l=1,2$, under conditions of Theorem 2.1, the estimates ${\bf Var}([g_{n,b}(z_{l})]^{(\nu)})=O\left({\bf Var}\\{g_{n,b}(z_{l})\\}+b^{-1}N^{-2}\right),\quad\nu=0,\ldots,3$ (3.20) and $D^{6}_{pi}\left\\{g^{0}_{1}G_{2}(i,p)\right\\}=O\left(N^{-1}+|g_{1}^{0}|\right)$ (3.21) are true in the limit $n,b\longrightarrow\infty$ (2.9). Now regarding the first term of (3.10) and using (3.20) and (3.21), we obtain inequality $\displaystyle\sum_{|p|\leq{n}}{\bf E}|H(p,i)^{7}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(0)}|\leq{c_{1}\sum_{|p|\leq{n}}{\bf E}\left\\{\frac{|H(p,i)|^{7}}{N}+|H(p,i)|^{7}|[g^{0}_{1}]^{(0)}|\right\\}}$ $\displaystyle\leq{c_{1}\sum_{|p|\leq{n}}\frac{\hat{\mu}_{7}}{Nb^{7/2}}\psi\left(\frac{p-i}{b}\right)+c_{1}\sum_{|p|\leq{n}}\frac{(\hat{\mu}_{14})^{1/2}}{b^{7/2}}\left(\psi\left(\frac{p-i}{b}\right)\right)^{1/2}\left({\bf Var}\\{[g_{1}]^{(0)}\\}\right)^{1/2}}$ $\displaystyle=O\left(N^{-1}b^{-2}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right),$ (3.22) where $c$ is a constant. Regarding the last term of the right-hand side of (3.10) and using (3.20) and (3.21), we obtain inequality $\displaystyle\sum_{|p|\leq{n}}K_{6}{\bf E}|H(p,i)[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(3)}|$ $\displaystyle\leq{\frac{c_{2}}{b^{2}}\left(\frac{1}{b}\sum_{|p|\leq{n}}\psi\left(\frac{p-i}{b}\right)\right)\left(\frac{\hat{\mu}_{1}\psi(\frac{p-i}{b})}{Nb^{1/2}}+\frac{\hat{\mu}^{1/2}_{2}\left(\psi(\frac{p-i}{b})\right)^{1/2}}{b^{1/2}}\left({\bf Var}\\{[g_{1}]^{(3)}\\}\right)^{1/2}\right)}$ $\displaystyle=O\left(N^{-1}b^{-2}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right),$ (3.23) where $c_{2}$ is a constant. Repeating previous computations of (3.23), we obtain that $\displaystyle\sum_{|p|\leq{n}}K_{4}{\bf E}|H(p,i)^{3}[D^{6}_{pi}(g^{0}_{1}G_{2}(i,p))]^{(2)}|+\sum_{|p|\leq{n}}K_{2}{\bf E}|H(p,i)^{5}D^{6}_{pi}[g^{0}_{1}G_{2}(i,p)]^{(1)}|$ $\displaystyle=O\left(N^{-1}b^{-2}+b^{-2}[{\bf Var}\\{g_{1}\\}]^{1/2}\right).$ (3.24) Then (3.16) follows from the estimates given by relations (3.22), (3.23) and (3.24). Lemma 3.2 is proved. $\hfill\blacksquare$ Let us come back to relation (3.12). Using equality $\sum_{|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,i)G^{0}_{2}(p,p)\\}U(p,i)={\bf E}\\{g^{0}_{1}U_{G_{2}}^{0}(i)G_{2}^{0}(i,i)\\}+U_{R_{12}}(i){\bf E}\\{G_{2}(i,i)\\},$ we obtain the following relation $\displaystyle R_{12}(i)=$ $\displaystyle\zeta_{2}v^{2}R_{12}(i)U_{{\bf E}(G_{2})}(i)+\zeta_{2}v^{2}U_{R_{12}}(i){\bf E}\\{G_{2}(i,i)\\}$ $\displaystyle+\frac{2\zeta_{2}v^{2}}{N}\sum_{|p|\leq{n}}F_{12}(i,p)U(p,i)+\frac{1}{Nb}\Upsilon_{12}(i)$ $\displaystyle+\tau(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i},$ (3.25) where $F_{12}(i,p)$ is the same as in (3.12), $\Upsilon_{12}$ is given by (3.13) and $\tau(i)=\zeta_{2}v^{2}{\bf E}\\{g^{0}_{1}U_{G_{2}}^{0}(i)G_{2}^{0}(i,i)\\}.$ (3.26) Relation (3.25) is the main equality used for the proof of Theorem 2.1. We use (3.25) twice : at the first stage we estimate the variance ${\bf Var}\\{g_{n,b}(z)\\}$ and at the second one we obtain explicit expressions for the leading term of $C_{n,b}(z_{1},z_{2})$. This will be done this in the next section. ## 4 Variance and leading term of $C_{n,b}(z_{1},z_{2})$ In this section we give the estimate of the variance and the proof of Theorem 2.1, postponing some technical results to the next section. ### 4.1 Estimate of the variance Let us define an auxiliary variable $q_{2}(i)=\frac{\zeta_{2}}{1-\zeta_{2}v^{2}U_{g_{2}}(i)},$ (4.1) where $g_{2}(i)={\bf E}G_{2}(i,i)$. Then we can rewrite (3.25) in the form $\displaystyle R_{12}(i)=$ $\displaystyle v^{2}q_{2}(i)U_{R_{12}}(i)g_{2}(i)+\frac{1}{Nb}\left(2v^{2}q_{2}(i)b[F_{12}U](i,i)+q_{2}(i)\zeta^{-1}_{2}\Upsilon_{12}(i)\right)$ $\displaystyle+q_{2}(i)\zeta^{-1}_{2}\left(\tau(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i}\right)$ (4.2) with $[F_{12}U](i,i)=\sum_{|p|\leq{n}}F_{12}(i,p)U(p,i),$ where $F_{12}(i,p)$ is the same as in (3.12) and $\Upsilon_{12}$ is given by (3.13). Now let us estimate the terms of the RHS of (4.2).Taking into account that $U(p,i)\leq{b^{-1}}$ and using inequalities (3.17) with $m=2$, it is easy to see that if $z_{l}\in\Lambda_{\eta}$, then $\frac{1}{N}|[F_{12}U](i,i)|\leq{\frac{1}{\eta^{3}Nb}}=O(\frac{1}{Nb}).$ (4.3) Let us estimate $\Upsilon_{12}$ (3.13). Using (3.1) and inequality $|\Delta_{pi}|\leq{[V_{4}+3v^{4}]\psi((p-i)/b)}$, we obtain that $|q_{2}(i)|\leq{\frac{1}{|\mathrm{Im}z_{2}|}},\quad z_{2}\in\Lambda_{\eta}$ (4.4) and that $|q_{2}(i)\zeta^{-1}_{2}\Upsilon_{12}(i)|\leq{\frac{2[V_{4}+3v^{4}]}{\eta^{6}}\sum_{|p|\leq{n}}\frac{1}{b}\psi\left(\frac{p-i}{b}\right)}=O(1).$ (4.5) To estimate the term $\tau$ (3.26), we use the following statement. ###### Lemma 4.1. Under the conditions of Theorem 2.1, the estimate $\sup_{|i|,|s|\leq{n}}|{\bf E}g^{0}(z)G^{0}(i,i)U^{0}_{G}(s)|=O\left(n^{-1}b^{-2}+b^{-2}[{\bf Var}\\{g(z)\\}]^{1/2}\right)$ (4.6) is true in the limit $n,b\rightarrow\infty$ (2.9). We prove Lemma 4.1 in section 5. It follows from results of Lemmas 3.1, 3.2 and relation (4.6), that if $z_{j}\in\Lambda_{\eta}$, then $\sup_{|i|\leq{n}}\left|q_{2}(i)\zeta^{-1}_{2}\left(\tau(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i}\right)\right|=O\left(N^{-1}b^{-2}+b^{-2}\\{{\bf Var}\\{g_{1}\\}\\}^{1/2}\right).$ (4.7) Let us denote $r_{12}=\sup_{i}|R_{12}(i)|$. Regarding estimates (4.3), (4.5) and (4.7), we derive from (4.2) inequality $r_{12}\leq{\frac{v^{2}}{\eta^{2}}r_{12}+\frac{A}{bN}+\frac{1}{b^{2}}\sqrt{r_{12}}}$ for some constant A. Since $r_{12}$ is bounded for all $z_{l}\in\Lambda_{\eta}$, then $r_{12}=O((Nb)^{-1}+b^{-4})$. Using condition (2.9) and taking $z=z_{1}=\overline{z_{2}}$, one obtains that ${\bf Var}\\{g_{n,b}(z)\\}=O\left(\frac{1}{Nb}\right).$ (4.8) Substituting (4.8) into (4.7), we obtain that $\sup_{|i|\leq{n}}\left|q_{2}(i)\zeta^{-1}_{2}\left(\tau(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i}\right)\right|=o\left(\frac{1}{Nb}\right)$ (4.9) in the limit $n,b\rightarrow\infty$ (2.9) and for all $z_{l}\in\Lambda_{\eta}$, $l=1,2$. This proves (2.11). ### 4.2 Leading term of the correlation function Assuming that (4.9) is true, we rewrite (4.2) in the form $R_{12}(i)=v^{2}q_{2}(i)g_{2}(i)U_{R_{12}}(i)+\frac{1}{Nb}f_{12}(i)+\Gamma(i)$ (4.10) with $f_{12}(i)=2v^{2}q_{2}(i)b[F_{12}U](i,i)+q_{2}(i)\zeta^{-1}_{2}\Upsilon_{12}(i),$ (4.11) where $F_{12}(i,p)$ is the same as in (3.25) and $\Upsilon_{12}$ is given by (3.13). We have denoted the vanishing terms by $\Gamma(i)=q_{2}(i)\zeta^{-1}_{2}\left(\tau(i)+\sum_{r=1}^{7}Y_{r}(i)+\epsilon_{i}\right).$ (4.12) To obtain an explicit expression for the leading term of $C_{n,b}(z_{1},z_{2})$, it is necessary to study in detail the variables $F_{12}$ and $\Upsilon_{12}$. Let us formulate the corresponding statements and the auxiliary relations needed. Given a positive integer $L$, set $B_{L}\equiv B_{L}(n,b)=\left\\{i\in\mathbb{Z};\ |i|\leq{n-bL}\right\\}.$ (4.13) ###### Lemma 4.2. If $z\in\Lambda_{\eta}$, then for arbitrary positive $\epsilon$ and large enough values of $n$ and $b$ (2.9) there exists a positive integer $L=L(\epsilon)$ such that relations $\sup_{i\in{B_{L}}}\left|b[F_{12}U](i,i)-\frac{w_{2}w_{1}^{2}}{2\pi(1-v^{2}w_{1}^{2})}\int_{\mathbb{R}}\frac{\tilde{\psi}(p)}{[1-v^{2}w_{1}w_{2}\tilde{\psi}(p)]^{2}}dp\right|\leq{\epsilon}$ (4.14) and $\sup_{i\in{B_{L}}}\left|q_{2}(i)\zeta^{-1}_{2}\Upsilon_{12}(i)-\frac{2\Delta w^{3}_{1}w^{3}_{2}}{1-v^{2}w^{2}_{1}}\right|\leq{\epsilon}$ (4.15) hold for enough $n$ and $b$ satisfying (2.9) with $\Delta$ is given by (2.14). The proof of Lemma 4.2 is based on the following statement formulated for the product $G_{1}G_{2}$. ###### Lemma 4.3. Given positive $\epsilon$, there exists a positive integer $L=L(\epsilon)$ such that relations $\sup_{i\in{B_{L}}}\left|{\bf E}\\{G^{2}_{1}(i,i)\\}-\frac{w^{2}_{1}}{1-v^{2}w^{2}_{1}}\right|\leq{\epsilon},$ (4.16) $\sup_{i\in{B_{L}}}\left|b\sum_{|s|\leq{n}}{\bf E}\\{G_{1}(i,s)G_{2}(i,s)\\}U^{k}(s,i)-\frac{1}{2\pi}\int_{\mathbb{R}}\frac{w_{1}w_{2}\tilde{\psi}^{k}(p)}{1-v^{2}w_{1}w_{2}\tilde{\psi}(p)}dp\right|\leq{\epsilon}$ (4.17) and $\sup_{i\in{B_{L}}}\left|\sum_{|s|\leq{n}}{\bf E}\\{G_{1}(i,s)G_{2}(i,s)\\}-\frac{w_{1}w_{2}}{1-v^{2}w_{1}w_{2}}\right|\leq{\epsilon}$ (4.18) hold for enough $n$ and $b$ satisfying (2.9) for all $k\in\mathbb{N}$, all $z_{j}\in\Lambda_{\eta}$, $j=1,2$. We postpone the proof of Lemma 4.3 to the next section. ### 4.3 Proof of Lemma 4.2 and Theorem 2.1 #### 4.3.1 Proof of Lemma 4.2 We start with (4.14). Let us consider the average $F_{12}(i,s)={\bf E}\\{G^{2}_{1}(i,s)G_{2}(i,s)\\}$. Applying to $G_{2}(i,s)$ the resolvent identity (2.23), we obtain equality $F_{12}(i,s)=\zeta_{2}\delta_{is}{\bf E}\\{G^{2}_{1}(i,i)\\}-\zeta_{2}\sum_{|p|\leq{n}}{\bf E}\\{G^{2}_{1}(i,s)G_{2}(i,p)H(p,s)\\}.$ Applying formula (2.15) to ${\bf E}\\{G^{2}_{1}(i,s)G_{2}(i,p)H(p,s)\\}$ with $q=3$ and taking into account (2.25), we get relation $\displaystyle F_{12}(i,s)=$ $\displaystyle\zeta_{2}\delta_{is}{\bf E}\\{G^{2}_{1}(i,i)\\}+\zeta_{2}v^{2}[t_{12}U](i,s){\bf E}\\{G^{2}_{1}(s,s)\\}$ $\displaystyle+\zeta_{2}v^{2}[F_{12}U](i,s)g_{1}(s)+\zeta_{2}v^{2}F_{12}(i,s)U_{g_{2}}(s)$ $\displaystyle+\sum_{r=1}^{5}\beta_{r}(i,s),$ (4.19) where we denoted $g_{l}(s)={\bf E}\\{G_{l}(s,s)\\}$, $l=1,2$, $t_{12}(i,s)={\bf E}\\{G_{1}(i,s)G_{2}(i,s)\\}$ and the terms $\beta_{l}$, $l=1,\ldots,5$ are given by: $\displaystyle\beta_{1}(i,s)=$ $\displaystyle\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G^{2}_{1}(p,s)G_{1}(i,s)G_{2}(i,p)\\}U(p,s)$ $\displaystyle+\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G^{2}_{1}(i,s)G_{1}(p,s)G_{2}(i,p)\\}U(p,s)$ $\displaystyle+\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G^{2}_{1}(i,s)G_{2}(p,s)G_{2}(i,p)\\}U(p,s),$ $\displaystyle\beta_{2}(i,s)=$ $\displaystyle\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G_{1}(i,p)G_{2}(i,p)(G^{2}_{1}(s,s))^{0}\\}U(p,s)$ $\displaystyle+\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G^{2}_{1}(i,p)G_{2}(i,p)G^{0}_{1}(s,s)\\}U(p,s),$ $\displaystyle\beta_{3}(i,s)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\left\\{G^{2}_{1}(i,s)G_{2}(i,s)U^{0}_{G_{2}}(s)\right\\},$ $\displaystyle\beta_{4}(i,s)=$ $\displaystyle-\frac{\zeta_{2}}{6}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{D^{3}_{ps}\left(G^{2}(i,s)G_{2}(i,p)\right)\right\\},$ and $\displaystyle\beta_{5}(i,s)=$ $\displaystyle-\frac{\zeta_{2}}{4!}\sum_{|p|\leq{n}}{\bf E}\left\\{H(p,s)^{5}[D^{4}_{ps}(G^{2}(i,s)G_{2}(i,p))]^{(0)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{3!}\sum_{|p|\leq{n}}K_{2}{\bf E}\left\\{H(p,s)^{3}[D^{4}_{ps}(G^{2}(i,s)G_{2}(i,p))]^{(1)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{3!}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{H(p,s)[D^{4}_{ps}(G^{2}(i,s)G_{2}(i,p))]^{(2)}\right\\}$ with $K_{r}$ are the cumulants of $H(p,s)$ as in (3.5)-(3.6). Let us accept for the moment that $\max_{j=1,\ldots,5}\left\\{\sup_{|i|,|s|\leq{n}}|\beta_{r}(i,s)|\right\\}=O\left(b^{-1}\right),\quad\hbox{ as }\quad n,b\rightarrow\infty$ (4.20) holds for enough $n$ and $b$ satisfying (2.9). Using them and the definition of $q_{2}(s)$ (4.1), we rewrite (4.19) in the form $F_{12}(i,s)=v^{2}g_{1}(s)q_{2}(s)[F_{12}U](i,s)+R_{1}(i,s)+R_{2}(i,s)+\beta(i,s),$ (4.21) where we denoted $R_{1}(i,s)=q_{2}(i){\bf E}\\{G^{2}_{1}(i,i)\\}\delta_{is},$ (4.22) $R_{2}(i,s)=v^{2}q_{2}(s)[t_{12}U](i,s){\bf E}\\{G^{2}_{1}(s,s)\\}$ (4.23) and the vanishing term $\beta(i,s)=\frac{q_{2}(s)}{\zeta_{2}}\sum_{r=1}^{5}\beta_{r}(i,s).$ We define the linear operator $W$ that acts on the space of $N\times{N}$ matrices $F$ according to the formula $[WF](i,s)=v^{2}g_{1}(s)q_{2}(s)\sum_{|p|\leq{n}}F(i,p)U(p,s).$ It is easy to see that if $z_{l}\in\Lambda_{\eta}$, then the estimates (3.1) and (4.4) imply that $|R_{1}|\leq{\eta^{-3}}$ and $|R_{2}|\leq{v^{2}\eta^{-5}}$ and that $||W||_{(1,1)}\leq{\frac{v^{2}}{\eta^{2}}}<\frac{1}{2},$ (4.24) where the norm of $N\times{N}$ matrix $A$ is determined as $||A||_{(1,1)}=\sup_{i,s}|A(i,s)|$. This estimate verified by the direct computation of the norm $||WA||_{(1,1)}$ with $||A||_{(1,1)}=1$. Then (4.21) can be rewritten as $F_{12}(i,s)=\sum_{m=0}^{\infty}\left[W^{m}\left(R_{1}+R_{2}+\beta\right)\right](i,s).$ (4.25) The next steps of the proof of (4.14) are very elementary. To do this, we start with the following statements, proved in the previous work [1]. ###### Lemma 4.4. (see [1]) Given positive $\epsilon$, there exists a positive integer $L=L(\epsilon)$ such that relations $\sup_{i\in{B_{L}}}|{\bf E}\\{G(i,i;z)\\}-w(z)|\leq{\epsilon},\quad z\in\Lambda_{\eta}$ (4.26) and $\sup_{i\in{B_{L}}}|q(i;z)-w(z)|\leq{2\epsilon}\quad z\in\Lambda_{\eta}$ (4.27) hold for enough $n$ and $b$ satisfying (2.9), where $w$ and $q$ are given by (2.7) and (4.1). Now let us return to relation (4.25). We consider the first $M$ terms of the infinite series and use the decay of the matrix elements $U(i,s)=U^{(b)}(i,s)$. If one considers (4.22) and (4.23) with $i$ and $s$ taken far enough from the endpoints -$n$, $n$, then the variables $g_{1}(j)$, $q_{2}(k)$ enter into the finite series with $j$ and $k$ also far from the endpoints. Then one can use relations (4.26) and (4.27) and replace $g_{1}$ and $q_{2}$ by the constant values $w_{1}$ and $w_{2}$, respectively. This substitution leads to simplified expressions with error terms that vanish as $n,b\rightarrow\infty$. The second step is similar. It is to show that we can use Lemma 4.3 and replace the terms $R_{1}$ and $R_{2}$ of the finite series of (4.22)and (4.23) by corresponding expressions given by formulas (4.16) and (4.17). Let us start to perform this program. Taking into account the estimate of $\beta$ (4.20) and using bounded-ness of the terms $R_{1}$ and $R_{2}$, we can deduce from (4.25) equality $b\sum_{|s|\leq{n}}F_{12}(i,s)U(s,i)=b\sum_{m=0}^{M}\left[W^{m}(R_{1}+R_{2}).U\right](i,i)+\kappa_{1}(i,i),$ (4.28) where $M>0$ is such that given $\epsilon>0$ and $|\kappa_{1}(i,i)|<\epsilon$ for large enough $b$ and $N$. Now let us find such $h>0$ that the following holds $\sup_{h\leq{|t|}}\psi(t)<\epsilon\ \hbox{ and }\ \int_{h\leq{|t|}}\psi(t)dt\leq{\epsilon}.$ We determine the matrix $\hat{U}(i,p)=\left\\{\begin{array}[]{lll}U(i,p)&\textrm{if}&|i-p|\leq{bh};\\\ 0&\textrm{if}&|i-p|>bh\end{array}\right.$ and denote by $\hat{W}$ the corresponding linear operator $[\hat{W}F](i,s)=v^{2}g_{1}(s)q_{2}(s)\sum_{|p|\leq{n}}F_{12}(i,p)\hat{U}(p,s).$ Certainly , $\hat{W}$ admits the same estimate as $W$ (4.24). Given $\epsilon>0$ and $L>0$ the large number. Let us denote by $Q$ the first natural greater than $(M+k)h$. Then one can write that $b\sum_{m=0}^{M}\left[W^{m}(R_{1}+R_{2}).U\right](i,i)=b\sum_{m=0}^{M}\left[\hat{W}^{m}(R_{1}+R_{2})\hat{U}\right](i,i)+\kappa_{2}(i,i),$ (4.29) where $\sup_{i\in{B_{L+Q}}}|\kappa_{2}(i,i)|\leq{\epsilon},\quad\hbox{ as }\ n,b\longrightarrow{\infty}.$ (4.30) The proof of (4.30) uses elementary computations. Indeed, $\kappa_{2}(i,i)$ is represented as the sum of $M+1$ terms of the form $b\sum_{|s_{r}|\leq{n}}^{*}\nu^{2m}g_{1}(s_{1})q_{2}(s_{1})\ldots,g_{1}(s_{m})q_{2}(s_{m})[R_{1}+R_{2}](i,s_{m+1})$ $\times U(s_{m+1},s_{m})\ldots U(s_{1},i),$ where the sum is taken over the values of $s_{j}$ such that $|s_{j}-s_{j+1}|>bh$ at least for one of the numbers $j\leq{m}$. Now remembering the a priori bounds for $R_{1}$ (4.22) and $R_{2}$ (4.23), one obtains the following estimate of $\kappa_{2}$: $\displaystyle\sup_{|i|\leq{n}}|\kappa_{2}(i,i)|\leq$ $\displaystyle{\sum_{m=0}^{M}\frac{v^{2m}}{\eta^{2m+3}}\sum_{|s_{r}|\leq{n}}^{*}bU(i,s_{1})\ldots U(s_{m},s_{m+1})}$ $\displaystyle+\sum_{m=0}^{M}\frac{v^{2m+2}}{\eta^{2m+5}}\sum_{|s_{r}|\leq{n}}^{*}bU(i,s_{1})\ldots U(s_{m},s_{m+1}).$ (4.31) Assuming that $|s_{j}-s_{j+1}|>bh$ and using inequality $\displaystyle\sum_{|s_{i}|\leq{n}}U(i,s_{1})\ldots U(s_{j-1},s_{j})$ $\displaystyle\leq{\sum_{s_{i}\in\mathbb{Z}}U(i,s_{1})\ldots U(s_{j-1},s_{j})}$ (4.32) $\displaystyle\leq{\left[\int_{-\infty}^{+\infty}\psi(t)dt+\frac{\psi(0)}{b}\right]^{j}}$ $\displaystyle\leq{(1+1/b)^{j}},$ (4.33) one sees that for large enough $b$ and $n$, $\sum_{|s_{j}|\leq{n}}U^{j}(i,s_{j})\epsilon U^{m-j}(s_{j+1},s_{m+1})\leq{\epsilon}.$ Let us also mention here that given $\epsilon>0$, one has large enough $n$ and $b$ that $\sup_{i\in B_{L+Q}}|\sum_{|s|\leq{n}}U^{j}(i,s)-1|\leq{\epsilon},$ (4.34) where $j\leq{M}$. This follows from elementary computations related with the differences $P_{b}=\frac{1}{b}\sum_{t\in\mathbb{Z}}\psi\left(\frac{t}{b}\right)-\int_{\mathbb{R}}\psi(s)ds$ (4.35) and $T_{n,b}(i)\equiv T(i)=\frac{1}{b}\sum_{|t|\leq{n}}\psi\left(\frac{t-i}{b}\right)-\frac{1}{b}\sum_{t\in\mathbb{Z}}\psi\left(\frac{t}{b}\right).$ (4.36) that vanish in the limit $1\ll b\ll n$ (see previous work [1] for more details). This reasoning when slightly modified is used to estimate the second term in the RHS of (4.31). Now one can write that $\sup_{|i|\leq{n}}|\kappa_{2}(i,i)|\leq{2\epsilon\sum_{m=0}^{M}m\left[\frac{v^{2}}{\eta^{2}}\right]^{m}}\leq{\epsilon}.$ Regarding the RHS of (4.29) with $i\in B_{L+Q}$, one observes that the summations run over such values of $s_{r}$ that $|i-s_{1}|\leq{bh}$, $|s_{r}-s_{r+1}|\leq{bh}$, and thus $s_{j}\in B_{L}$ for all $j\leq{k+m-1}$. This means that we can apply relations (4.26) and (4.27) to the RHS of (4.29) and to replace $g_{1}$ by $w_{1}$, $q_{2}$ by $w_{2}$. From (4.28), it follows that $\displaystyle b[F_{12}U](i,i)=$ $\displaystyle\sum_{m=0}^{M}[v^{2}w_{1}w_{2}]^{m}\ b\sum_{|s_{m+1}|\leq{n}}\left(R_{1}(i,s_{m+1})+R_{2}(i,s_{m+1})\right)\hat{U}^{m+1}(s_{m+1},i)$ $\displaystyle+\kappa_{3}(i,i)$ with $\sup_{i\in B_{L+Q}}|\kappa_{3}(i,i)|\leq{4\epsilon}.$ Finally, applying Lemma 4.3 to the expressions involved in $R_{l}$ and taking into account that $\sup_{i\in B_{L+Q}}|bU^{m+1}(i,i)-\frac{1}{2\pi}\int_{\mathbb{R}}\tilde{\psi}^{m+1}(p)dp|\leq{\epsilon},$ (4.37) we obtain equality $\displaystyle b[F_{12}U](i,i)=$ $\displaystyle\frac{1}{2\pi}\frac{w^{2}_{1}w_{2}}{1-v^{2}w^{2}_{1}}\sum_{m=0}^{M}[v^{2}w_{1}w_{2}]^{m}\int_{\mathbb{R}}\tilde{\psi}^{m+1}(p)dp$ $\displaystyle+\frac{1}{2\pi}\frac{w^{2}_{1}w_{2}}{1-v^{2}w^{2}_{1}}\sum_{m=0}^{M}[v^{2}w_{1}w_{2}]^{m}v^{2}\int_{\mathbb{R}}\frac{w_{1}w_{2}\tilde{\psi}^{m+1}(p)}{1-v^{2}w_{1}w_{2}\tilde{\psi}(p)}dp+\kappa_{4}(i,i)$ (4.38) with $\sup_{i\in B_{L+Q}}|\kappa_{4}(i,i)|\leq{\epsilon}.$ Passing back in (4.38) to the infinite series and simplifying them, we arrive at the expression standing in the RHS of (4.14). Relation (4.14) is proved. Now let us prove (4.20). Inequality $U(p,s)\leq{b^{-1}}$, (3.1) and (3.17) imply that if $z_{l}\in\Lambda_{\eta}$, the estimate $\max_{r=1,2}\left\\{\sup_{|i|,|s|\leq{n}}|\beta_{r}(i,s)|\right\\}=O(b^{-1})$ (4.39) holds for enough $n$ and $b$ satisfying (2.9). To estimate $\beta_{3}$, we use the following estimate of the diagonal elements of the resolvent $G$, proved in the previous work [1]. ###### Lemma 4.5. (see [1]) If $z\in\Lambda_{\eta}$, then under conditions of Theorem 2.1, the estimate $\sup_{|s|\leq{n}}{\bf E}\\{|U^{0}_{G}(s;z)|^{2}\\}=O(b^{-2})$ (4.40) holds for enough $n$ and $b$ satisfying (2.9). Then inequality (3.1) and estimate (4.40), imply that $\sup_{|i|,|s|\leq{n}}|\beta_{3}(i,s)|=O(b^{-1}),\quad z_{1},z_{2}\in\Lambda_{\eta}\quad\hbox{ as }\ n,b\rightarrow\infty.$ (4.41) Using inequality $|K_{4}\left(H(p,s)\right)|\leq{\frac{4|\Delta_{ps}|}{b^{2}}}\leq{\frac{4[V_{4}+3v^{4}]}{b^{2}}\psi\left(\frac{p-s}{b}\right)}$ (4.42) and relations (3.1) and (2.25), we obtain that $|{\bf E}\left\\{D^{3}_{ps}\left(G^{2}(i,s)G_{2}(i,p)\right)\right\\}|=O(1),\quad\hbox{ as }\ n,b\rightarrow\infty$ and conclude that $\sup_{|i|,|s|\leq{n}}|\beta_{4}(i,s)|=O(b^{-1}),\quad z_{1},z_{2}\in\Lambda_{\eta}\quad\hbox{ as }\ n,b\rightarrow\infty.$ (4.43) Regarding the term $\beta_{5}$ and using similar arguments as those to the proof of (3.16) (see (3.22)-(3.23)), we conclude that $\sup_{|i|,|s|\leq{n}}|\beta_{5}(i,s)|=O(b^{-1}),\quad z_{1},z_{2}\in\Lambda_{\eta}\quad\hbox{ as }\ n,b\rightarrow\infty.$ (4.44) Now (4.20) follows from (4.39), (4.41), (4.43) and (4.44). To complete the proof of Lemma 4.2, let us prove (4.15). To do this we use the following simple statement, proved in the previous work [1]. ###### Lemma 4.6. (see [1]) If $z\in\Lambda_{\eta}$, then under conditions of Theorem 2.1, the estimate $\sup_{|s|\leq{n}}{\bf E}\\{|G(s,s;z)^{0}|^{2}\\}=O(b^{-1})$ (4.45) holds for enough $n$ and $b$ satisfying (2.9). We introduce the variable $M_{12}(i)=q_{2}(i)\zeta^{-1}_{2}\Upsilon_{12}(i)$ with $\Upsilon_{12}$ is given by (3.13). Using identity (3.11) and estimate (4.45), we obtain that $\displaystyle M_{12}(i)=$ $\displaystyle q_{2}(i)g_{2}(i){\bf E}\\{G^{2}_{1}(i,i)\\}\sum_{|p|\leq{n}}\frac{\Delta_{pi}}{b}g_{1}(p)g_{2}(p)$ $\displaystyle+q_{2}(i)g_{1}(i)g_{2}(i)\sum_{|p|\leq{n}}\frac{\Delta_{pi}}{b}{\bf E}\\{G^{2}_{1}(p,p)\\}g_{2}(p)+o(1),\quad\hbox{ as }\ n,b\rightarrow\infty.$ (4.46) If one considers (4.46) with $i$ taken far enough from the endpoints $-n$, $n$, then one can use relation (4.26) and (4.27) and replace $g_{1}$, $g_{2}$ and $q_{2}$ by the constant values $w_{1}$ and $w_{2}$. This substitution leads to simplified expressions with error terms that vanish as $n,b\rightarrow\infty$. To finish the proof, we use relation (2.1) and Lemma 4.3 and replace the terms $\sum_{p}\Delta_{pi}/b$ and $G^{2}_{1}$ of $M_{12}$ by the corresponding expressions given by relations (2.14) and (4.16). This proves (4.15). Lemma 4.2 is proved. $\hfill\blacksquare$ #### 4.3.2 Proof of Theorem 2.1 Let us return to relation (4.10). We introduce the linear operator $W^{(g_{2},q_{2})}$ acting on vectors $e\in\mathbb{C}^{N}$ with components $e(i)$ as follows; $\\{W^{(g_{2},q_{2})}(e)\\}(i)=v^{2}g_{2}(i)q_{2}(i)\sum_{|p|\leq{n}}e(p)U(p,i).$ (4.47) As a matter of fact, we can rewrite (4.10) in the following form: $[I-W^{(g_{2},q_{2})}](R_{12})(i)=\frac{1}{Nb}f_{12}(i)+\Gamma(i),$ (4.48) where $f_{12}$ and $\Gamma$ are given by (4.11) and (4.12). It is easy to see that if $z\in\Lambda_{\eta}$, then inequalities (3.1) and (4.4) imply that $||W^{(g_{2},q_{2})}||_{1}\leq{\frac{v^{2}}{(2v+1)^{2}}}<{\frac{1}{2}},$ where $||W^{(g_{2},q_{2})}||_{1}=\sup_{|V|_{1}=1}|W^{(g_{2},q_{2})}(V)|_{1}$ and $|V|_{1}=\sup_{i}|V(i)|$. Then (4.48) can be rewritten in the form $R_{12}(i)=\frac{1}{Nb}\sum_{m=0}^{\infty}\left([W^{(g_{2},q_{2})}]^{m}\vec{f}_{12}\right)(i)+o\left(\frac{1}{Nb}\right).$ Regarding the trace $\frac{1}{N}\sum_{|i|\leq{n}}R_{12}(i)=\frac{1}{N}\sum_{i\in B_{L}}R_{12}(i)+\frac{2bL}{N}O\left(\frac{1}{Nb}\right)=\frac{1}{N}\sum_{i\in B_{L}}R_{12}(i)+o\left(\frac{1}{Nb}\right)$ and repeating the same arguments of the proof of (4.14) presented above, we can write that $R_{12}(i)=\frac{1}{Nb}\sum_{m=0}^{M}\sum_{|t|\leq{n}}f_{12}(t)(v^{2}w^{2}_{2}U)^{m}(t,i)+\frac{1}{Nb}\Delta^{(2)}(i)$ with $\sup_{i\in B_{L}}|\Delta^{(2)}(i)|=o(1)$. Finally, observing that $f_{12}(t)$ asymptotically does not depend on $t$ (see Lemma 4.2), we arrive with the help of (4.34), at the expression (2.12). Theorem 2.1 is proved. $\hfill\blacksquare$ ## 5 Proof of auxiliary statement The main goal of this section is to prove Lemmas 3.1, 4.1 and 4.3. ### 5.1 Proof of Lemma 3.1 #### 5.1.1 Estimate of the term $Y_{1}$ (3.12) Here we have to use the resolvent identity (2.23) and the cumulants expansion formula (2.15) twice. However, the computations are based on the same inequalities as those of the proofs of Lemma 3.2. Regarding $Y_{1}(i)=\zeta_{2}b^{-2}\sum_{p}{\bf E}\\{g^{0}_{1}G_{2}(i,i)^{2}G_{2}(p,p)^{2}\\}\Delta_{pi}$, we apply to $G_{2}(i,i)$ the resolvent identity (2.23). Then we get relation $\displaystyle Y_{1}(i)=$ $\displaystyle{\zeta^{2}_{2}}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}\\}\Delta_{pi}$ $\displaystyle-\frac{\zeta^{2}_{2}}{b^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2}H(s,i)\\}\Delta_{pi}.$ Applying the formula (2.15) with $q=3$ to ${\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2}H(s,i)\\}$, we obtain that $\displaystyle Y_{1}(i)=$ $\displaystyle\frac{\zeta^{2}_{2}}{b^{2}}\sum_{|p|\leq{n}}{\bf E}(g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2})\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}v^{2}}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)^{2}G_{2}(p,p)^{2}U_{G_{2}}(i)\\}\Delta_{pi}+\sum_{r=1}^{3}Q_{r}(i)$ (5.1) with $\displaystyle Q_{1}(i)=$ $\displaystyle\frac{2\zeta^{2}_{2}v^{2}}{Nb^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{G_{1}^{2}(i,s)G_{2}(i,s)G_{2}(i,i)G_{2}(p,p)^{2}\\}U(s,i)\Delta_{pi}$ $\displaystyle+\frac{3\zeta^{2}_{2}v^{2}}{b^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}G_{2}(i,s)^{2}\\}U(s,i)\Delta_{pi}$ $\displaystyle+\frac{4\zeta^{2}_{2}v^{2}}{b^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)G_{2}(i,s)G_{2}(i,p)G_{2}(p,s)\\}U(s,i)\Delta_{pi},$ $\displaystyle Q_{2}(i)=$ $\displaystyle-\frac{\zeta^{2}_{2}}{b^{2}}\sum_{|s|,|p|\leq{n}}\frac{K_{4}}{6}{\bf E}\left\\{D_{si}^{3}(g^{0}_{1}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2})\right\\}\Delta_{pi}$ and $\displaystyle Q_{3}(i)=$ $\displaystyle-\frac{\zeta^{2}_{2}}{b^{2}4!}\sum_{|s|,|p|\leq{n}}{\bf E}\left\\{H(s,i)^{5}[D_{si}^{4}(g^{0}_{1}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2})]^{(0)}\right\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}}{b^{2}3!}\sum_{|s|,|p|\leq{n}}K_{2}{\bf E}\left\\{H(s,i)^{3}[D_{si}^{4}(g^{0}_{1}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2})]^{(1)}\right\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}}{b^{2}3!}\sum_{|s|,|p|\leq{n}}K_{4}{\bf E}\left\\{H(s,i)[D_{si}^{4}(g^{0}_{1}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2})]^{(2)}\right\\}\Delta_{pi},$ where $K_{r}$, $r=2,4$ are the cumulants of $H(s,i)$ as in (3.5). Applying to the second term of the RHS of (5.1) identity (3.11) and using the definition of $q_{2}(i)$ (4.1), we obtain that $\displaystyle Y_{1}(i)=$ $\displaystyle\frac{\zeta_{2}q_{2}(i)}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta_{2}v^{2}q_{2}(i)}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)^{2}G_{2}(p,p)^{2}U^{0}_{G_{2}}(i)\\}\Delta_{pi}$ $\displaystyle+\frac{q_{2}(i)}{\zeta_{2}}\sum_{r=1}^{3}Q_{r}(i).$ (5.2) Regarding the first term of the RHS of this equality, we apply the resolvent identity (2.23) to $G_{2}(i,i)$. Repeating the usual computations based on the formula (2.15) (with $q=3$) and relation (2.25), we obtain that $\frac{\zeta_{2}q_{2}(i)}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}\\}\Delta_{pi}=\frac{\zeta_{2}}{b^{2}}q^{2}_{2}(i)\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}\\}\Delta_{pi}$ $+\frac{\zeta_{2}v^{2}}{b^{2}}q^{2}_{2}(i)\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}U^{0}_{G_{2}}(i)\\}\Delta_{pi}+\frac{q_{2}(i)}{\zeta_{2}}\sum_{r=1}^{3}\breve{Q}_{r}(i)$ (5.3) with $\displaystyle\breve{Q}_{1}(i)=$ $\displaystyle\frac{2\zeta^{2}_{2}v^{2}q_{2}(i)}{Nb^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{G_{1}^{2}(i,s)G_{2}(i,s)G_{2}(p,p)^{2}\\}U(s,i)\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}v^{2}q_{2}(i)}{b^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}G_{2}(i,s)^{2}\\}U(s,i)\Delta_{pi}$ $\displaystyle+\frac{4\zeta^{2}_{2}v^{2}q_{2}(i)}{b^{2}}\sum_{|s|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(p,p)G_{2}(i,s)G_{2}(i,p)G_{2}(p,s)\\}U(s,i)\Delta_{pi},$ $\displaystyle\breve{Q}_{2}(i)=$ $\displaystyle-\frac{\zeta^{2}_{2}q_{2}(i)}{b^{2}}\sum_{|s|,|p|\leq{n}}\frac{K_{4}}{6}{\bf E}\left\\{D_{si}^{3}(g^{0}_{1}G_{2}(i,s)G_{2}(p,p)^{2})\right\\}\Delta_{pi}$ and $\displaystyle\breve{Q}_{3}(i)=$ $\displaystyle-\frac{\zeta^{2}_{2}}{b^{2}4!}\sum_{|s|,|p|\leq{n}}{\bf E}\left\\{H(s,i)^{5}[D_{si}^{4}(g^{0}_{1}G_{2}(i,s)G_{2}(p,p)^{2})]^{(0)}\right\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}}{b^{2}3!}\sum_{|s|,|p|\leq{n}}K_{2}{\bf E}\left\\{H(s,i)^{3}[D_{si}^{4}(g^{0}_{1}G_{2}(i,s)G_{2}(p,p)^{2})]^{(1)}\right\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta^{2}_{2}}{b^{2}3!}\sum_{|s|,|p|\leq{n}}K_{4}{\bf E}\left\\{H(s,i)[D_{si}^{4}(g^{0}_{1}G_{2}(i,s)G_{2}(p,p)^{2})]^{(2)}\right\\}\Delta_{pi},$ where $K_{r}$, $r=2,4$ are the cumulants of $H(s,i)$ as in (3.5). Substituting (5.3) into (5.2), we obtain that $\displaystyle Y_{1}(i)=$ $\displaystyle\frac{\zeta_{2}}{b^{2}}q^{2}_{2}(i)\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta_{2}v^{2}}{b^{2}}q^{2}_{2}(i)\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)G_{2}(p,p)^{2}U^{0}_{G_{2}}(i)\\}\Delta_{pi}$ $\displaystyle+\frac{\zeta_{2}v^{2}q_{2}(i)}{b^{2}}\sum_{|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,i)^{2}G_{2}(p,p)^{2}U^{0}_{G_{2}}(i)\\}\Delta_{pi}$ $\displaystyle+\frac{q_{2}(i)}{\zeta_{2}}\sum_{r=1}^{3}Q_{r}(i)+\frac{q_{2}(i)}{\zeta_{2}}\sum_{r=1}^{3}\breve{Q}_{r}(i).$ (5.4) Now let us estimate each term of the RHS of this equality. If one assumes for a while that $\sup_{|p|\leq{n}}|{\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}\\}|=O\left(N^{-1}b^{-1}+b^{-1}[{\bf Var}\\{g_{1}\\}]^{1/2}\right)$ (5.5) holds for enough $n$ and $b$ satisfying (2.9). Then this estimate and relations (4.4), (4.42) and (4.40) imply that the fist, the second and the third terms of the RHS of (5.4) are of the order indicated in the RHS of (3.14). Inequality (3.1), (3.2), (3.17) (with $m=1$ and $m=2$) and (4.4) imply that the term $q_{2}(i)\zeta^{-1}_{2}[Q_{1}(i)+\breve{Q}_{1}(i)]$ is of the order indicated in the RHS of (3.14). Using similar arguments as those of the proof of (3.16) (see (3.22)-(3.24)) and the following estimates (cf. (3.20)-(3.21)) $D_{si}^{r}(g^{0}_{1}G_{2}(i,i)G_{2}(i,s)G_{2}(p,p)^{2})=O\left(N^{-1}+|g_{1}^{0}|\right),\quad r=3,4$ and ${\bf Var}\\{[g_{n,b}(z_{l})]^{(\nu)}\\}=O\left({\bf Var}\\{g_{n,b}(z_{l})\\}+b^{-1}N^{-2}\right),\quad\nu=0,1,2,$ we obtain that the terms $Q_{r}$, $r=2,3$ are of the order indicated in the RHS of (3.14). We conclude that the terms $\breve{Q}_{r}$, $r=2,3$ and $\sup_{i}|Y_{1}(i)|$ are of the order indicated in the RHS of (3.14). Now let us prove (5.5). Let us apply the resolvent identity (2.23) to $G_{2}(p,p)$. Repeating the usual computations based on the formula (2.15) (with $q=3$) and relation (2.25), we obtain that $\displaystyle{\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}\\}=$ $\displaystyle q_{2}(p){\bf E}\\{g_{1}^{0}G_{2}(p,p)\\}+q_{2}(p){\bf E}\\{g_{1}^{0}G_{2}(p,p)^{2}U^{0}_{G_{2}}(p)\\}$ $\displaystyle+3q_{2}(p)v^{2}\sum_{|s|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(p,s)^{2}G_{2}(p,p)\\}U(s,p)$ $\displaystyle+\frac{2v^{2}}{N}q_{2}(p)\sum_{|s|\leq{n}}{\bf E}\\{G^{2}_{1}(s,p)G_{2}(s,p)G_{2}(p,p)\\}U(s,p)$ $\displaystyle-\frac{q_{2}(p)}{6}\sum_{|s|\leq{n}}K_{4}{\bf E}\left\\{D_{sp}^{3}(g^{0}_{1}G_{2}(p,p)G_{2}(p,s))\right\\}-q_{2}(p)\tilde{Q}(i)$ (5.6) with $\displaystyle\tilde{Q}(i)=$ $\displaystyle-\frac{1}{4!}\sum_{|s|\leq{n}}{\bf E}\left\\{H(s,p)^{5}[D_{sp}^{4}(g^{0}_{1}G_{2}(p,p)G_{2}(p,s))]^{(0)}\right\\}$ $\displaystyle+\frac{1}{3!}\sum_{|s|\leq{n}}K_{2}{\bf E}\left\\{H(s,p)^{3}[D_{sp}^{4}(g^{0}_{1}G_{2}(p,p)G_{2}(p,s))]^{(1)}\right\\}$ $\displaystyle+\frac{1}{3!}\sum_{|s|\leq{n}}K_{4}{\bf E}\left\\{H(s,p)[D_{sp}^{4}(g^{0}_{1}G_{2}(p,p)G_{2}(p,s))]^{(2)}\right\\},$ where $K_{r}$, $r=2,4$ are the cumulants of $H(s,p)$ as in (3.5). Let us estimate each term of the RHS of (5.6). It is easy to show that the estimate of the first term of the RHS of (5.6) follows from the following statement, proved in the previous work [1]. ###### Lemma 5.1. (see [1]) If $z\in\Lambda_{\eta}$, then under conditions of Theorem 2.1, the estimate $\sup_{|p|\leq{n}}|{\bf E}\\{g_{1}^{0}G_{2}(p,p)\\}|=O\left(b^{-1}n^{-1}+b^{-1}[{\bf Var}\\{g_{1}\\}]^{1/2}\right)$ (5.7) holds in the limit $n,b\rightarrow\infty$ (2.9). Then (5.5) follows from this Lemma.and the estimate (4.40) and the similar arguments used in the estimates of the terms $Q_{r}$, $r=1,2,3$ in (5.4). Estimate (5.5) is proved. #### 5.1.2 Estimate of $Y_{2}$ (3.12) We rewrite $Y_{2}$ in the form $Y_{2}(i)=\zeta_{2}v^{2}\sum_{s}{\bf E}\\{M(i,s)\\}U(s,i)$, where we denoted ${\bf E}\\{M(i,s)\\}={\bf E}\\{g^{0}_{1}G_{2}(i,s)^{2}\\}.$ To proceed with estimate of $Y_{2}$, we use the resolvent identity (2.23) and the cumulants expansion formula (2.15) twice. However, the computations are based on the results of Lemma 4.5, 4.6 and 5.1. Therefore we just indicate the main lines of the proof and do not go into the details. Applying to $G_{2}(i,s)$ the resolvent identity (2.23), we get equality ${\bf E}M(i,s)=\zeta_{2}\delta_{is}{\bf E}\\{g^{0}_{1}G_{2}(i,i)\\}-\zeta_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,t)H(t,s)\\}.$ (5.8) Regarding the first term of the RHS of this equality and using relation (5.7), it is easy to see that the term $\sum_{|s|\leq{n}}\zeta_{2}\delta_{is}{\bf E}\\{g^{0}_{1}G_{2}(i,i)\\}U(s,i)=\zeta_{2}\frac{\psi(0)}{b}{\bf E}\\{g^{0}_{1}G_{2}(i,i)\\}$ is the value of order indicated in (3.14). Let us consider the second term of (5.8). Applying formula (2.15) with $q=5$ to ${\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,t)H(t,s)\\}$ and taking account relations (2.25) and (3.11), we obtain that $-\zeta_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,t)H(t,s)\\}=\sum_{l=1}^{7}\Theta_{l}(i,s),$ (5.9) where $\displaystyle\Theta_{1}(i,s)=$ $\displaystyle v^{2}\zeta_{2}{\bf E}\\{g^{0}_{1}G_{2}(i,s)^{2}\\}{\bf E}U_{G_{2}}(s),$ $\displaystyle\Theta_{2}(i,s)=$ $\displaystyle v^{2}\zeta_{2}{\bf E}\\{g^{0}_{1}G_{2}(i,s)^{2}U^{0}_{G_{2}}(s)\\},$ $\displaystyle\Theta_{3}(i,s)=$ $\displaystyle\frac{2v^{2}\zeta_{2}}{N}\sum_{|t|\leq{n}}{\bf E}\\{G^{2}_{1}(s,t)U(t,s)G_{2}(i,s)G_{2}(i,t)\\},$ $\displaystyle\Theta_{4}(i,s)=$ $\displaystyle v^{2}\zeta_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,s)\\}U(t,s),$ $\displaystyle\Theta_{5}(i,s)=$ $\displaystyle 2v^{2}\zeta_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(t,s)G_{2}(i,t)\\}U(t,s),$ $\displaystyle\Theta_{6}(i,s)=$ $\displaystyle-\zeta_{2}\sum_{|t|\leq{n}}\frac{K_{4}\left(H(t,s)\right)}{6}{\bf E}\\{D^{3}_{ts}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))\\}$ and $\Theta_{7}(i,s)=-\zeta_{2}\sum_{|t|\leq{n}}\frac{K_{6}\left(H(t,s)\right)}{5!}{\bf E}\\{D^{5}_{ts}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))\\}+\tilde{\Theta}_{7}(i,s)$ with $\displaystyle\tilde{\Theta}_{7}(i,s)=$ $\displaystyle-\frac{\zeta_{2}}{6!}\sum_{|t|\leq{n}}{\bf E}\left\\{H(t,s)^{7}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))]^{(0)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{5!}\sum_{|t|\leq{n}}K_{2}\left(H(t,s)\right){\bf E}\left\\{H(t,s)^{5}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))]^{(1)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{(3!)^{2}}\sum_{|t|\leq{n}}K_{4}\left(H(t,s)\right){\bf E}\left\\{H(t,s)^{3}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))]^{(2)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{5!}\sum_{|t|\leq{n}}K_{6}\left(H(t,s)\right){\bf E}\left\\{H(t,s)[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t))]^{(3)}\right\\},$ where $K_{r}\left(H(t,s)\right)$, $r=2,4,6$ are the cumulants of $H(t,s)$ as in (3.5)-(3.6). The term $\Theta_{1}$ is of the form $v^{2}\zeta_{2}{\bf E}\\{M(i,s)\\}{\bf E}U_{G_{2}}(s)$ and can be put to the left hand side of (5.8). The terms $\Theta_{2}$ and $\Theta_{3}$ are of the order indicated in the RHS of (3.14). This can be shown with the help of the estimate (4.40) and inequality (eg. [1]) $\displaystyle\left|\sum_{|s|,|t|\leq{n}}G^{2}_{1}(s,t)G_{2}(i,s)G_{2}(i,t)\right|$ $\displaystyle\leq{||G_{1}^{2}||\left(\sum_{|s|\leq{n}}|G_{2}(i,s)|^{2}\right)^{1/2}\left(\sum_{|t|\leq{n}}|G_{2}(i,t)|^{2}\right)^{1/2}}\leq{\frac{1}{\eta^{4}}}.$ (5.10) Regarding $\Theta_{4}$, we apply the resolvent identity (2.23) to the factor $G_{2}(s,s)$. Repeating the usual computations based on the formula (2.15) with $q=5$ and taking into account relations (2.25) and (3.11), we obtain that $\Theta_{4}(i,s)=v^{2}\zeta^{2}_{2}\sum_{|t|\leq{n}}{\bf E}\\{M(i,t)\\}U(t,s)+v^{2}\zeta_{2}\Theta_{4}(i,s){\bf E}U_{G_{2}}(s)+\sum_{l=1}^{8}\Omega_{l}(i,s),$ (5.11) where $\displaystyle\Omega_{1}(i,s)=$ $\displaystyle v^{4}\zeta^{2}_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,s)U^{0}_{G_{2}}(s)\\}U(t,s),$ $\displaystyle\Omega_{2}(i,s)=$ $\displaystyle v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,t)^{2}G_{2}(s,p)^{2}\\}U(p,s)U(t,s),$ $\displaystyle\Omega_{3}(i,s)=$ $\displaystyle\frac{2v^{4}\zeta^{2}_{2}}{N}\sum_{|t|,|p|\leq{n}}{\bf E}\\{G^{2}_{1}(p,s)G_{2}(i,t)^{2}G_{2}(s,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega_{4}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,t)G_{2}(i,s)G_{2}(p,t)G_{2}(s,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega_{5}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,t)G_{2}(i,p)G_{2}(s,t)G_{2}(s,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega_{6}(i,s)=$ $\displaystyle-\zeta^{2}_{2}v^{2}\sum_{|t|,|p|\leq{n}}\frac{K_{4}\left(H(p,s)\right)}{6}{\bf E}\\{D^{3}_{ps}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))\\}U(t,s),$ $\displaystyle\Omega_{7}(i,s)=$ $\displaystyle-\zeta^{2}_{2}v^{2}\sum_{|t|,|p|\leq{n}}\frac{K_{6}\left(H(p,s)\right)}{5!}{\bf E}\\{D^{5}_{ps}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))\\}U(t,s)$ and $\displaystyle\Omega_{8}($ $\displaystyle i,s)$ $\displaystyle=$ $\displaystyle-\frac{\zeta^{2}_{2}v^{2}}{6!}\sum_{|t|,|p|\leq{n}}{\bf E}\left\\{H(p,s)^{7}[D_{ps}^{6}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))]^{(0)}\right\\}U(t,s)$ $\displaystyle+\frac{\zeta^{2}_{2}v^{2}}{5!}\sum_{|t|,|p|\leq{n}}K_{2}\left(H(p,s)\right){\bf E}\left\\{H(p,s)^{5}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))]^{(1)}\right\\}U(t,s)$ $\displaystyle+\frac{\zeta^{2}_{2}v^{2}}{(3!)^{2}}\sum_{|t|,|p|\leq{n}}K_{4}\left(H(p,s)\right){\bf E}\left\\{H(p,s)^{3}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))]^{(2)}\right\\}U(t,s)$ $\displaystyle+\frac{\zeta^{2}_{2}v^{2}}{5!}\sum_{|t|,|p|\leq{n}}K_{6}\left(H(p,s)\right){\bf E}\left\\{H(p,s)[D_{ts}^{6}(g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p))]^{(3)}\right\\}U(t,s)$ with $K_{r}\left(H(p,s)\right)$, $r=2,4,6$ are the cumulants of $H(p,s)$ as in (3.5)-(3.6). The terms $\Omega_{l}$, $l=1,\ldots,5$ are of the order indicated in the RHS of (3.14). This can be shown with the help of the estimate (4.40) and the inequalities (3.1), (3.2), (3.17) and (5.10). The term $\Omega_{6}$ contains $272$ terms that are of the order indicated in the RHS of (3.14). This can be checked by direct computations with the use of (3.17) and (5.10). Using similar argument as those of the proofs of (3.15) and (3.16) (see (3.22)-(3.24)), and the following estimate (cf. (3.18)) ${\bf E}|D^{5}_{pi}\\{g^{0}_{1}G_{2}(i,t)^{2}G_{2}(s,p)\\}|=O\left(N^{-1}+[{\bf Var}\\{g_{1}\\}]^{1/2}\right),\ \hbox{ as }\quad n,p\rightarrow\infty,$ (5.12) we conclude that the terms $\Omega_{7}$ and $\Omega_{8}$ are of the order indicated in the RHS of (3.14). Then, the relation (5.11) is of the form that leads to the estimates needed for $\sum_{s}{\bf E}\\{M(i,s)\\}U(s,i)$. Regarding $\Theta_{5}(i,s)$, we apply the resolvent identity (2.23) to the factor $G_{2}(t,s)$. Repeating the usual computations based on the formula (2.15) with $q=5$ and taking into account relations (2.25) and (3.11), we obtain that $\Theta_{5}(i,s)=2v^{2}\zeta^{2}_{2}\frac{\psi(0)}{b}{\bf E}M(i,s)+v^{2}\zeta_{2}\Theta_{5}(i,s){\bf E}U_{G_{2}}(s)+\sum_{l=1}^{9}\Omega^{{}^{\prime}}_{l}(i,s),$ (5.13) where $\displaystyle\Omega^{{}^{\prime}}_{1}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,s)U^{0}_{G_{2}}(s)\\}U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{2}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g_{1}^{0}G_{2}(i,p)G_{2}(s,s)G_{2}(i,t)G_{2}(t,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{3}(i,s)=$ $\displaystyle\frac{4v^{4}\zeta^{2}_{2}}{N}\sum_{|t|,|p|\leq{n}}{\bf E}\\{G^{2}_{1}(p,s)G_{2}(i,s)G_{2}(i,t)G_{2}(t,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{4}(i,s)=$ $\displaystyle 4v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(p,s)G_{2}(i,t)G_{2}(t,p)\\}U(p,s)U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{5}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,p)G_{2}(t,p)G_{2}(s,t)\\}U(p,s)U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{6}(i,s)=$ $\displaystyle 2v^{4}\zeta^{2}_{2}\sum_{|t|,|p|\leq{n}}{\bf E}\\{g^{0}_{1}G_{2}(i,s)^{2}G_{2}(p,t)^{2}\\}U(p,s)U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{7}(i,s)=$ $\displaystyle-2\zeta^{2}_{2}v^{2}\sum_{|t|,|p|\leq{n}}\frac{K_{4}\left(H(p,s)\right)}{6}{\bf E}\\{D^{3}_{ps}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))\\}U(t,s),$ $\displaystyle\Omega^{{}^{\prime}}_{8}(i,s)=$ $\displaystyle-2\zeta^{2}_{2}v^{2}\sum_{|t|,|p|\leq{n}}\frac{K_{6}\left(H(p,s)\right)}{5!}{\bf E}\\{D^{5}_{ps}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))\\}U(t,s)$ and $\displaystyle\Omega^{{}^{\prime}}$ ${}_{9}(i,s)$ $\displaystyle=$ $\displaystyle-\frac{2\zeta^{2}_{2}v^{2}}{6!}\sum_{|t|,|p|\leq{n}}{\bf E}\left\\{H(p,s)^{7}[D_{ps}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))]^{(0)}\right\\}U(t,s)$ $\displaystyle+\frac{2\zeta^{2}_{2}v^{2}}{5!}\sum_{|t|,|p|\leq{n}}K_{2}\left(H(p,s)\right){\bf E}\left\\{H(p,s)^{5}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))]^{(1)}\right\\}U(t,s)$ $\displaystyle+\frac{2\zeta^{2}_{2}v^{2}}{(3!)^{2}}\sum_{|t|,|p|\leq{n}}K_{4}\left(H(p,s)\right){\bf E}\left\\{H(p,s)^{3}[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))]^{(2)}\right\\}U(t,s)$ $\displaystyle+\frac{2\zeta^{2}_{2}v^{2}}{5!}\sum_{|t|,|p|\leq{n}}K_{6}\left(H(p,s)\right){\bf E}\left\\{H(p,s)[D_{ts}^{6}(g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p))]^{(3)}\right\\}U(t,s)$ with $K_{r}\left(H(p,s)\right)$, $r=2,4,6$ are the cumulants of $H(p,s)$ as in (3.5)-(3.6). The terms $\sum_{s}\Omega^{{}^{\prime}}_{l}(i,s)U(s,i)$, $l=1,\ldots,6$ are of the order indicated in the RHS of (3.14). This can be shown with the help of the estimate (4.40) and the inequalities (3.1), (3.2), (3.17) and (5.10). The term $\Omega^{{}^{\prime}}_{7}$ contains $356$ terms that are of the order indicated in the RHS of (3.14). This can be checked by direct computations with the use of (3.17) and (5.10). Using similar argument as those of the proofs of (3.15) and (3.16) (see (3.22)-(3.24)), and the following estimate (cf. (3.18)) ${\bf E}|D^{5}_{pi}\\{g^{0}_{1}G_{2}(i,s)G_{2}(i,t)G_{2}(t,p)\\}|=O\left(N^{-1}+[{\bf Var}\\{g_{1}\\}]^{1/2}\right),\ \hbox{ as }\quad n,p\rightarrow\infty,$ (5.14) we conclude that the terms $\Omega^{{}^{\prime}}_{8}$ and $\Omega^{{}^{\prime}}_{9}$ are of the order indicated in the RHS of (3.14). Then, the form of (5.13) is also such that, being substituted into (5.9) and then into (5.8), it leads to the needed estimates. The term $\Theta_{6}(i,s)$ contains $67$ terms. These terms can be gathered into three groups. In each group, the terms are estimated by the same values with the help of the same computations. We give estimates for the typical cases. Using (3.1), (3.2) and (3.17) (with $m=1$), we get for the terms of the first group: $\displaystyle\left|\frac{\zeta_{2}}{N}\sum_{|t|\leq{n}}K_{4}\left(H(t,s)\right){\bf E}\\{G_{1}^{2}(t,t)G_{1}(s,s)G_{1}(t,s)G_{2}(i,s)G_{2}(i,t)\\}\cdot\frac{1}{(1+\delta_{ts})^{3}}\right|$ $\displaystyle\leq{\frac{V_{4}+3v^{4}}{\eta^{5}Nb^{2}}\sum_{|t|\leq{n}}{\bf E}|G_{1}(t,s)G_{2}(i,t)|}\leq{\frac{V_{4}+3v^{4}}{\eta^{7}Nb^{2}}}.$ For the terms of the second group, we obtain estimates $\displaystyle\left|\zeta_{2}\sum_{|t|\leq{n}}K_{4}\left(H(t,s)\right){\bf E}\\{g_{1}^{0}G_{2}(s,s)^{2}G_{2}(i,t)^{2}\\}\cdot\frac{1}{(1+\delta_{ts})^{3}}\right|$ $\displaystyle\leq{\frac{V_{4}+3v^{4}}{\eta^{3}b^{2}}{\bf E}|g_{1}^{0}|\sum_{|t|\leq{n}}|G_{2}(i,t)^{2}|}\leq{\frac{[V_{4}+3v^{4}]\sqrt{{\bf Var}\\{g_{1}\\}}}{\eta^{5}b^{2}}}.$ Finally, for the terms of the third group, we get inequalities $\displaystyle\left|\sum_{|s|\leq{n}}\frac{\zeta_{2}}{N}\sum_{|t|\leq{n}}K_{4}\left(H(t,s)\right){\bf E}\\{G_{1}^{2}(s,s)G_{1}(t,t)G_{2}(t,t)G_{2}(i,s)^{2}\\}U(s,i)\cdot\frac{1}{(1+\delta_{ts})^{3}}\right|$ $\displaystyle\leq{\frac{V_{4}+3v^{4}}{\eta^{5}Nb}\sum_{|s|\leq{n}}{\bf E}|G_{2}(i,s)^{2}|\sum_{|t|\leq{n}}U(t,s)U(s,i)}=O\left(\frac{1}{Nb^{2}}\right).$ Gathering all the estimates of $67$ terms, we obtain that $\left|\sum_{|s|\leq{n}}\Theta_{6}(i,s)U(s,i)\right|=O\left(\frac{1}{Nb^{2}}+\frac{\sqrt{{\bf Var}\\{g_{1}\\}}}{b^{2}}\right).$ Using similar argument as those of the proofs of (3.15) and (3.16) (see (3.22)-(3.24)), we conclude that $\Theta_{7}$ and $\sup_{i}|Y_{2}(i)|$ are of the order indicated in (3.14). Estimate (3.14) is proved and so Lemma 3.1 is proved.$\hfill\blacksquare$ ### 5.2 Proof of Lemma 4.1 Let us consider the variable $K(i,s)={\bf E}\\{RG^{0}(i,i)\\}={\bf E}\\{R^{0}G(i,i)\\},$ where we denoted $R=g^{0}U^{0}_{G}(s)$. Applying to $G_{2}(i,i)$ the resolvent identity (2.23) and taking account formula (2.15) with $q=3$ and relation (2.25), we obtain that ${\bf E}\\{R^{0}G(i,i)\\}=\zeta v^{2}{\bf E}\\{R^{0}G(i,i)U_{G}(i)\\}+\sum_{a=1}^{5}l_{a}(i,s)$ (5.15) with $\displaystyle l_{1}(i,s)=$ $\displaystyle\zeta v^{2}\sum_{|p|\leq{n}}{\bf E}\\{R^{0}G(i,p)^{2}\\}U(p,i),$ $\displaystyle l_{2}(i,s)=$ $\displaystyle 2\zeta v^{2}\sum_{|p|,|t|\leq{n}}{\bf E}\\{g^{0}G(t,p)G(t,i)G(i,p)\\}U(t,s)U(p,i),$ $\displaystyle l_{3}(i,s)=$ $\displaystyle\frac{2\zeta v^{2}}{N}\sum_{|p|,|t|\leq{n}}{\bf E}\\{G(p,t)G(i,t)U^{0}_{G}(s)G(i,p)\\}U(p,i),$ $\displaystyle l_{4}(i,s)=$ $\displaystyle-\frac{\zeta}{6}\sum_{|p|\leq{n}}K_{4}{\bf E}\\{D^{3}_{pi}(R^{0}G(i,p))\\}$ and $\displaystyle l_{5}(i,s)=$ $\displaystyle-\frac{\zeta}{4!}\sum_{|p|\leq{n}}{\bf E}\left\\{H(p,i)^{5}[D_{pi}^{4}(R^{0}G(i,p))]^{(0)}\right\\}$ $\displaystyle+\frac{\zeta}{3!}\sum_{|p|\leq{n}}K_{2}{\bf E}\left\\{H(p,i)^{3}[D_{pi}^{4}(R^{0}G(i,p))]^{(1)}\right\\}$ $\displaystyle+\frac{\zeta}{3!}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{H(p,i)[D_{pi}^{4}(R^{0}G(i,p))]^{(2)}\right\\},$ where $K_{r}$, $r=2,4$ are the cumulants of $H(p,i)$ as in (3.5). Let us use the identity ${\bf E}R^{0}XY={\bf E}RX^{0}{\bf E}Y+{\bf E}RY^{0}{\bf E}X+{\bf E}RX^{0}Y^{0}-{\bf E}R{\bf E}X^{0}Y^{0},$ and rewrite (5.15) in the form ${\bf E}\\{R^{0}G(i,i)\\}=K(i,s)=v^{2}q(i)g(i)\sum_{|t|\leq{n}}K(t,s)U(t,i)+\Pi(i,s)$ (5.16) with $\displaystyle\Pi(i,s)=$ $\displaystyle v^{2}q(i)\left[{\bf E}\\{RU^{0}_{G}(i)G^{0}(i,i)\\}-{\bf E}\\{g^{0}U^{0}_{G}(s)\\}{\bf E}\\{G^{0}(i,i)U^{0}_{G}(i)\\}\right]$ $\displaystyle+\frac{q(i)}{\zeta}\sum_{a=1}^{5}l_{a}(i,s),$ (5.17) where $g(i)={\bf E}\\{G(i,i)\\}$ and $q$ is given by (4.1). Now we rewrite (5.16) in the form of a vector equality $\vec{K}(.,s)=[I-W^{(q,g)}]^{-1}\vec{\Pi}(.,s),$ where we denote by $W^{(q,g)}$ the linear operator acting on a vector $e$ with components $e(i)$ as $[W^{(q,g)}e](i)=v^{2}q(i)g(i)\sum_{|t|\leq{n}}e(t)U(t,i)$ and vectors $[\vec{\Pi}(.,s)](i)=\Pi(i,s)$. It is easy to see that if $z\in\Lambda_{\eta}$, then $||W^{(q,g)}||\leq{\frac{1}{2}}$. Thus, to prove relation (4.6), it is sufficient to show that $\sup_{|i|,|s|\leq{n}}|\Pi(i,s)|=O\left(\frac{1}{Nb^{2}}+\frac{1}{b^{2}}\left({\bf Var}\\{g\\}\right)^{1/2}\right).$ (5.18) Let us prove (5.18). Taking into account inequality (3.1), (3.2), (5.10) and estimate (4.40), we obtain that $|l_{a}(i,s)|\leq{\frac{c}{b^{2}}\left({\bf Var}\\{g\\}\right)^{1/2}}\quad\ a=1,2$ (5.19) and $|l_{3}(i,s)|\leq{\frac{c}{Nb^{2}}},$ (5.20) where c is a constant. Using similar arguments as those of the proof of (3.16) (see (3.22)-(3.24)) and the following estimates (cf. (3.20)-(3.21)) $D_{pi}^{r}(R^{0}G(i,p))=O\left(N^{-1}+|g_{1}^{0}|\right),\quad r=3,4$ and ${\bf Var}\\{[g_{n,b}(z)]^{(\nu)}\\}=O\left({\bf Var}\\{g_{n,b}(z)\\}+b^{-1}N^{-2}\right),\quad\nu=0,1,2,$ we obtain that the terms $l_{a}$, $a=4,5$ are of the order indicated in the RHS of (4.6). Finally, we derive inequality $\displaystyle|\Pi(i,s)|\leq$ $\displaystyle{c\left({\bf Var}\\{g\\}\right)^{1/2}\left(\left({\bf E}|U^{0}_{G}(i)|^{4}\right)^{1/2}+\frac{1}{b^{2}}\left({\bf E}|U^{0}_{G}(i)|^{2}\right)^{1/2}\right)}$ $\displaystyle+c\left(\frac{1}{Nb^{2}}+\frac{1}{b^{2}}\left({\bf Var}\\{g\\}\right)^{1/2}\right),$ (5.21) where $c$ is a constant. Then (5.18), (5.21) and Lemma 4.1 follow from (4.40) and the following estimate. ###### Lemma 5.2. If $z\in\Lambda_{\eta}$, then under conditions of Theorem 2.1, the estimate $\sup_{|s|\leq{n}}{\bf E}\\{|U^{0}_{G}(s;z)|^{4}\\}=O(b^{-4})$ (5.22) holds in the limit $n,b\rightarrow\infty$. Proof of Lemma 5.2. Let us consider variable ${\bf E}\\{U^{0}_{G_{1}}(x_{1})U^{0}_{G_{2}}(x_{2})U^{0}_{G_{3}}(x_{3})U^{0}_{G_{4}}(x_{4})\\}={\bf E}[U^{0}_{G_{1}}(x_{1})U^{0}_{G_{2}}(x_{2})U^{0}_{G_{3}}(x_{3})]^{0}U_{G_{4}}(x_{4}).$ Set $T=U^{0}_{G_{1}}U^{0}_{G_{2}}U^{0}_{G_{3}}$ and $M(x_{1},x_{2},x_{3},t)={\bf E}T^{0}G_{4}(t,t)$. We apply to $G_{4}(t,t)$ the resolvent identity $(3.2)$ and obtain ${\bf E}T^{0}G_{4}(t,t)=-\zeta_{4}\sum_{|s|\leq{n}}{\bf E}\\{T^{0}G_{4}(t,s)H(s,t)\\}.$ Applying (2.15) to ${\bf E}\\{T^{0}G_{4}(t,s)H(s,t)\\}$ with $q=3$ and taking into account (2.25), we get relation $\displaystyle{\bf E}T^{0}G_{4}(t,t)$ $\displaystyle=\zeta_{4}v^{2}{\bf E}\\{T^{0}G_{4}(t,t)U_{G_{4}}(t)\\}+\zeta_{4}v^{2}{\bf E}\left\\{T^{0}\sum_{|s|\leq{n}}G_{4}(t,s)^{2}U(s,t)\right\\}$ $\displaystyle+2\zeta_{4}v^{2}\sum_{(i,j,k)}{\bf E}\left\\{U^{0}_{G_{i}}(x_{i})U^{0}_{G_{j}}(x_{j})\sum_{|y|,|s|\leq{n}}G_{k}(y,s)G_{k}(t,y)G_{4}(t,s)U(y,x_{k})U(s,t)\right\\}$ $\displaystyle+\zeta_{4}\Gamma_{1}(t)+\zeta_{4}\Gamma_{2}(t)$ (5.23) with $\Gamma_{1}(t)=-\sum_{|s|\leq{n}}\frac{K_{4}}{3!}{\bf E}\left\\{D^{3}_{st}(T^{0}G_{4}(t,s))\right\\}$ (5.24) and $\displaystyle\Gamma_{2}(t)=$ $\displaystyle-\frac{1}{4!}\sum_{|s|\leq{n}}{\bf E}\left\\{H(s,t)^{5}[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(0)}\right\\}$ $\displaystyle+\sum_{|s|\leq{n}}\frac{K_{2}}{3!}{\bf E}\left\\{H(s,t)^{3}[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(1)}\right\\}$ $\displaystyle+\sum_{|s|\leq{n}}\frac{K_{4}}{3!}{\bf E}\left\\{H(s,t)[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(2)}\right\\},$ (5.25) where $K_{r}$, $r=2,4$ are the cumulants of $H(s,t)$ as in (3.5). In (5.23), we introduce the notation $\sum_{(i,j,k)}\xi(x_{i},x_{j},x_{k})=\xi(x_{1},x_{2},x_{3})+\xi(x_{1},x_{3},x_{2})+\xi(x_{2},x_{3},x_{1}).$ Applying to the first term of the RHS of (5.23) relation (3.11) and using $q_{4}(t)$ (4.1), we obtain that $\displaystyle{\bf E}T^{0}G_{4}(t,t)$ $\displaystyle=q_{4}(t)v^{2}{\bf E}\\{T^{0}G_{4}(t,t)U^{0}_{G_{4}}(t)\\}+q_{4}(t)v^{2}{\bf E}\left\\{T^{0}\sum_{|s|\leq{n}}G_{4}(t,s)^{2}U(s,t)\right\\}$ $\displaystyle+2q_{4}(t)v^{2}\sum_{(i,j,k)}{\bf E}\left\\{U^{0}_{G_{i}}(x_{i})U^{0}_{G_{j}}(x_{j})\sum_{|y|,|s|\leq{n}}G_{k}(y,s)G_{k}(t,y)G_{4}(t,s)U(y,x_{k})U(s,t)\right\\}$ $\displaystyle+q_{4}(t)\left(\Gamma_{1}(t)+\Gamma_{2}(t)\right).$ Now gathering relation given by (2.1), (3.1), (3.2), (5.10), (4.4) and $\sup_{|t|\leq{n}}{\bf E}|T^{0}U^{0}_{G_{4}}(t)|\leq{{\bf E}|T|\sup_{|t|\leq{n}}{\bf E}|U^{0}_{G_{4}}(t)|}+\sup_{|t|\leq{n}}{\bf E}|TU^{0}_{G_{4}}(t)|$ imply the following inequality $\displaystyle|\sum_{|t|\leq{n}}M(x_{1},x_{2},x_{3},t)U(t,x_{4})|\leq$ $\displaystyle{\frac{v^{2}}{\eta^{2}}\sup_{|t|\leq{n}}{\bf E}|TU^{0}_{G_{4}}(t)|+\frac{v^{2}}{\eta^{2}}{\bf E}|T|\sup_{|t|\leq{n}}{\bf E}|U^{0}_{G_{4}}(t)|}$ $\displaystyle+\frac{2v^{2}}{\eta^{3}b}{\bf E}|T|+\frac{6v^{2}}{\eta^{4}b^{2}}{\bf E}|U^{0}_{G_{i}}(x_{i})U^{0}_{G_{j}}(x_{j})|$ $\displaystyle+\frac{1}{\eta}\sup_{|t|\leq{n}}|\Gamma_{1}(t)+\Gamma_{2}(t)|.$ (5.26) Henceforth, for sake of clarity, we consider $G=G_{1}=G_{3}=\bar{G}_{2}=\bar{G}_{4}$ and $x=x_{r}$, $r=1,\ldots,4$, then we get $T=\left(U^{0}_{G}(x)\right)^{2}U^{0}_{\bar{G}}(x)$ and ${\bf E}|T|\leq{\left({\bf E}|U^{0}_{G}|^{4}\right)^{1/2}\left({\bf E}|U^{0}_{G}|^{2}\right)^{1/2}}.$ (5.27) Let us assume for the moment that $\sup_{|t|\leq{n}}|\Gamma_{1}(t)+\Gamma_{2}(t)|=O\left(b^{-4}+b^{-2}\sqrt{W}\right),\quad z\in\Lambda{\eta}$ (5.28) with $W=\sup_{x}{\bf E}|U^{0}_{G}(x)|^{4}$. Now returning to (5.26) and gathering estimates given by relations (4.40), (5.27) and (5.28) imply the following estimate $W\leq{A_{1}b^{-2}\sqrt{W}+A_{2}b^{-4}},$ where $A_{1}$, $A_{2}$ are some constants. This proves (5.22). To complete the proof of Lemma 5.2, let us prove (5.28). To do this, we use the following statement. ###### Lemma 5.3. If $z\in\Lambda_{\eta}$, then under conditions of Theorem 2.1, the estimates $D^{r}_{st}\left(U^{0}_{G}(x)\right)=O(b^{-1}),\ \quad r=1,\ldots,4,$ (5.29) $D^{r}_{st}\left(T^{0}\bar{G}(t,s)\right)=O\left(b^{-3}+b^{-2}|U^{0}_{G}(x)|+b^{-1}|U^{0}_{G}(x)|^{2}+|U^{0}_{G}(x)|^{3}\right),\quad r=3,4$ (5.30) and ${\bf E}|[U^{0}_{G}(x)]^{(\nu)}|^{2r}=O\left(b^{-3r}+{\bf E}|U^{0}_{G}(x)|^{2r}\right),\ r=1,2$ (5.31) hold for all $\nu=0,1,2$, all $|x|\leq{n}$ and large enough $n$ and $b$ satisfying (2.9). We prove this Lemma at the end of this subsection. Let us return to the proof of (5.28). Regarding the variable $\Gamma_{1}$ (5.24) and using (4.40), (4.42) and (5.30), one gets with the help of (5.27) that $\sum_{|s|\leq{n}}\frac{2[V_{4}+3v^{4}]}{3b}{\bf E}|D^{3}_{st}(T^{0}\bar{G}(t,s))|U(s,t)=O\left(b^{-4}+b^{-2}\sqrt{W}\right).$ (5.32) Now let us estimate $\Gamma_{2}$ (5.25). Regarding the first term of the RHS of (5.25) and using (4.40), (5.30) and (5.31), we obtain inequality $\displaystyle\sum_{|s|\leq{n}}{\bf E}|H(s,t)^{5}[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(0)}|$ $\displaystyle\leq{c\sum_{|s|\leq{n}}{\bf E}\left\\{\frac{|H(s,t)|^{5}}{b^{3}}+\frac{|H(s,t)|^{5}}{b^{2}}|[U_{G}^{0}(x)]^{(0)}|+\frac{|H(s,t)|^{5}}{b}|[U_{G}^{0}(x)]^{(0)}|^{2}\right\\}}$ $\displaystyle+c\sum_{|s|\leq{n}}{\bf E}\left\\{|H(s,t)|^{5}|[U_{G}^{0}(x)]^{(0)}|^{3}\right\\}$ $\displaystyle\leq{c\sum_{|s|\leq{n}}\left[\frac{\mu_{5}}{b^{11/2}}\psi\left(\frac{s-t}{b}\right)+\frac{\mu_{10}^{1/2}}{b^{9/2}}\left({\bf E}|[U_{G}^{0}(x)]^{(0)}|^{2}\right)^{1/2}\psi\left(\frac{s-t}{b}\right)^{1/2}\right]}$ $\displaystyle+c\sum_{|s|\leq{n}}\left[\frac{\mu_{10}^{1/2}}{b^{7/2}}\left({\bf E}|[U_{G}^{0}(x)]^{(0)}|^{4}\right)^{1/2}\psi\left(\frac{s-t}{b}\right)^{1/2}\right]$ $\displaystyle=O\left(\frac{1}{b^{9/2}}+\frac{1}{b^{5/2}}\sqrt{W}\right).$ (5.33) Repeating the arguments used to prove (5.33), it is easy to show that the term $\sum_{|s|\leq{n}}\frac{K_{2}}{3!}{\bf E}\left\\{H(s,t)^{3}[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(1)}\right\\}+\sum_{|s|\leq{n}}\frac{K_{4}}{3!}{\bf E}\left\\{H(s,t)[D^{4}_{st}\left(T^{0}G_{4}(t,s)\right)]^{(2)}\right\\}$ is of the order indicated in the RHS of (5.28) and that $\sup_{|t|\leq{n}}|\Gamma_{2}(t)|=O\left(b^{-4}+b^{-2}\sqrt{W}\right).$ (5.34) Then the estimate (5.28) follows from (5.32) and (5.34). Lemma 5.2 is proved. Proof of Lemma 5.3. We prove Lemma 5.2 with $r=1$ because the general case does not differ from this one. We start with the proof of (5.29). Using (2.25), we obtain that $D^{1}_{st}\left(U^{0}_{G}(x)\right)=-2\sum_{|k|\leq{n}}G(k,s)G(k,t)U(k,x).$ Then estimate (5.29) (with $r=1$) follows from this relation and inequality $|U(k,x)|\leq{b^{-1}}$ and (3.17) (with $m=1$). The general case does not differ from this one, so the estimate (5.29) is proved. Let us prove (5.30). Remembering that $T=[U^{0}_{G}(x)]^{2}U^{0}_{\bar{G}}(x)$ and using (2.25) and (5.29), we obtain that $D^{1}_{st}\\{T^{0}\\}=O(b^{-1}|U^{0}_{G}(x)|^{2}),$ $D^{2}_{st}\\{T^{0}\\}=O\left(b^{-2}|U^{0}_{G}(x)|+b^{-1}|U^{0}_{G}(x)|^{2}\right),$ $D^{3}_{st}\\{T^{0}\\}=O\left(b^{-3}+b^{-2}|U^{0}_{G}(x)|+b^{-1}|U^{0}_{G}(x)|^{2}\right).$ Now it is easy to show that (5.30) is true. Finally, we prove (5.31) with $r=1$ because the general case does not doffer from this one. To simplify computation, we use the notation: for each pair $(s,t)$ and $\nu=0,1,2$, let $H^{(\nu)}_{st}=H^{(\nu)}=\hat{H}$ be the matrix defined by $\hat{H}(r,i)=\left\\{\begin{array}[]{lll}H(r,i),&\textrm{if}&(r,i)\neq(s,t);\\\ \hat{H}(s,t),&\textrm{if}&(r,i)=(s,t)\end{array}\right.$ with $|\hat{H}(s,t)|\leq{|H(s,t)|}$ and its resolvent by $G^{(\nu)}_{sp}(z)=\hat{G}(z)$. Then the resolvent identity (2.23) imply that $\displaystyle U_{\hat{G}}(x)=$ $\displaystyle U_{G}(x)-\frac{1}{b}\sum_{|k|,|r|,|i|\leq{n}}\hat{G}(k,r)\\{\hat{H}-H\\}(r,i)G(i,k)\psi\left(\frac{x-k}{b}\right)$ $\displaystyle=$ $\displaystyle U_{G}(x)-\frac{1}{b}\sum_{|k|\leq{n}}B(k,s,t)\psi\left(\frac{x-k}{b}\right)$ with $B(k,s,t)=\hat{G}(k,s)[\hat{H}(s,t)-H(s,t)]G(t,k)$. Then inequality (3.1) implies that $\displaystyle{\bf E}|U^{0}_{\hat{G}}(x)|^{2}$ $\displaystyle\leq{2{\bf E}|U^{0}_{G}(x)|^{2}+\frac{2}{b^{2}}{\bf E}\left|\sum_{|k|\leq{n}}B^{0}(k,s,t)\psi\left(\frac{x-k}{b}\right)\right|^{2}}$ $\displaystyle\leq{2{\bf E}|U^{0}_{G}(x)|^{2}+\frac{8}{\eta^{4}b^{2}}{\bf E}\left(|\hat{H}(s,t)|+{\bf E}|H(s,t)|\right)^{2}}$ $\displaystyle\leq{2{\bf E}|U^{0}_{G}(x)|^{2}+\frac{8}{\eta^{4}b^{3}}\left[{\bf E}|a(s,p)|^{2}\psi\left(\frac{s-p}{b}\right)+3\left({\bf E}|a(s,p)|\right)^{2}\psi\left(\frac{s-p}{b}\right)^{2}\right]}.$ This proves (5.31). Lemma 5.3 is proved. $\hfill\blacksquare$ ### 5.3 Proof of Lemma 4.3. We prove relation (4.17) with $k=1$ because the general case does not differ from this one. To derive relations for the average value of the variable $t_{12}(i,s)={\bf E}G_{1}(i,s)G_{2}(i,s)$, we use identity (2.23) and relation (2.15) (with $q=3$) and repeat the proof of relation (4.14). Simple computations lead to $\displaystyle t_{12}(i,s)=$ $\displaystyle\zeta_{2}g_{1}(i)\delta_{is}+\zeta_{2}v^{2}t_{12}(i,s)U_{g_{2}}(s)$ $\displaystyle+\zeta_{2}v^{2}\sum_{|p|\leq{n}}t_{12}(i,p)g_{1}(s)U(p,s)+\sum_{j=1}^{6}\gamma_{j}(i,s),$ (5.35) with $\displaystyle\gamma_{1}(i,s)=$ $\displaystyle\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\\{G_{1}(i,s)G_{2}(i,p)G_{1}(p,s)\\}U(p,s),$ $\displaystyle\gamma_{2}(i,s)=$ $\displaystyle\zeta_{2}v^{2}\sum_{|p|\leq{n}}{\bf E}\left\\{G_{1}(i,s)G_{2}(i,p)G_{2}(p,s)\right\\}U(p,s)$ $\displaystyle\gamma_{3}(i,s)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\\{G_{1}(i,s)G_{2}(i,s)U^{0}_{G_{1}}(s)\\},$ $\displaystyle\gamma_{4}(i,s)=$ $\displaystyle\zeta_{2}v^{2}{\bf E}\left\\{G^{0}_{1}(s,s)\sum_{|p|\leq{n}}G_{1}(i,p)G_{2}(i,p)U(p,s)\right\\},$ $\displaystyle\gamma_{5}(i,s)=$ $\displaystyle-\frac{\zeta_{2}}{6}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{D^{3}_{ps}(G_{1}(i,s)G_{2}(i,p))\right\\}$ and $\displaystyle\gamma_{6}(i,s)=$ $\displaystyle-\frac{\zeta_{2}}{4!}\sum_{|p|\leq{n}}{\bf E}\left\\{H(p,s)^{5}[D^{4}_{ps}\left(G_{1}(i,s)G_{2}(i,p)\right)]^{(0)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{3!}\sum_{|p|\leq{n}}K_{2}{\bf E}\left\\{H(p,s)^{3}[D^{4}_{ps}\left(G_{1}(i,s)G_{2}(i,p)\right)]^{(1)}\right\\}$ $\displaystyle+\frac{\zeta_{2}}{3!}\sum_{|p|\leq{n}}K_{4}{\bf E}\left\\{H(p,s)[D^{4}_{ps}\left(G_{1}(i,s)G_{2}(i,p)\right)]^{(2)}\right\\},$ where $K_{r}$, $r=2,4$ are the cumulants of $H(p,s)$ as in (3.5). Using (3.17), it is easy to show that $\sup_{|i|,|s|\leq{n}}|\gamma_{1}(i,s)|=o(b^{-1}),\quad\sup_{|i|\leq{n}}|\sum_{|s|\leq{n}}\gamma_{1}(i,s)|=o(b^{-1}).$ The same is valid for $\gamma_{2}$. Similar estimates for $\gamma_{3}$, $\gamma_{4}$, $\gamma_{5}$ and $\gamma_{6}$ follow from relations (4.40), (4.45) and simple arguments as those to the proof of (4.20) (see (4.42)-(4.44)). Thus, (5.35) implies that $t_{12}(i,s)=g_{1}(i)q_{2}(i)\delta_{is}+v^{2}g_{1}(s)q_{2}(s)\\{t_{12}U\\}(i,s)+\Delta(i,s),$ (5.36) where $\sup_{|i|,|s|\leq{n}}|\Delta(i,s)|=o(1)\quad\hbox{ and }\quad\sup_{|i|\leq{n}}|\sum_{|s|\leq{n}}\Delta(i,s)|=o(1)$ (5.37) in the limit $n,b\rightarrow\infty$. We rewrite relation (5.36) in the matrix form (cf. (4.25)) $t_{12}=\\{I-W^{(g_{1},q_{2})}\\}^{-1}(Diag(g_{1}q_{2})+\Delta)=\sum_{m=0}^{+\infty}\\{W^{(g_{1},q_{2})}\\}^{m}(Diag(g_{1}q_{2})+\Delta).$ (5.38) Now we can apply to (5.38) the same arguments as in the proof of (4.14). Replacing $g_{1}$ and $q_{2}$ by $w_{1}$ and $w_{2}$, respectively, we derive from (5.37) that for $i\in B_{L+Q}$, $t_{12}(i,s)=\sum_{m=0}^{M}v^{2m}(w_{1}w_{2})^{m+1}[U^{m}](i,s)+o(1),\quad n,b\rightarrow\infty.$ (5.39) Multiplying both sides of (5.39) by $U(s,i)$ and summing over $s$, we obtain the relation $\sum_{|s|\leq{n}}t_{12}(i,s)U(s,i)=\sum_{m=0}^{M}v^{2m}(w_{1}w_{2})^{m+1}[U^{m+1}](i,i)+o(1),\ N,b\rightarrow\infty.$ Now convergence (4.37) implies the relation that leads, with $M$ replaced by $\infty$, to (4.17). To prove (4.18), let us sum (5.39) over $s$. The second part of (5.37) tells us that the terms $\Delta$ remain small when summed over $s$. Thus we can write relations $\sum_{|s|\leq{n}}t_{12}(i,s)=\sum_{m=0}^{M}(v^{2}w_{1}w_{2})^{m+1}\sum_{|s|\leq{n}}[U^{m}](i,s)+o(1),\ N,b\rightarrow\infty.$ (5.40) Taking into account estimates for terms (4.35)-(4.36) (see previous work [1] for more details), it is easy to observe that convergence (4.34) together with (5.40) imply (4.18). Finally, we prove (4.16). To derive relations for the average value of variable $t_{11}(i,s)={\bf E}G_{1}(i,s)G_{1}(i,s)$, we repeat the proof of (4.18) and replace $G_{2}$ by $G_{1}$. Then one obtains (4.16). Lemma 4.3 is proved. $\hfill\blacksquare$ ## 6 Asymptotic properties of $T(z_{1},z_{2})$ The asymptotic expression for $T(z_{1},z_{2})$ regarded in the limit $z_{1}=\lambda_{1}+i0$, $z_{2}=\lambda_{2}+i0$ supplies one with the information about the local properties of eigenvalue distribution provided that $\lambda_{1}-\lambda_{2}=O(N^{-1})$. Indeed, according to (2.5), the formal definition of the eigenvalue density $\rho_{n,b}(\lambda)=\sigma^{{}^{\prime}}_{n,b}(\lambda)$ is $\rho_{n,b}(\lambda)=\frac{1}{2i}[g_{n,b}(\lambda+i0)-g_{n,b}(\lambda-i0)].$ We consider the density-density correlation function of $\rho_{n,b}$ $R_{n,b}(\lambda_{1},\lambda_{2})=-\frac{1}{4}\sum_{\delta_{1},\delta_{2}=-1,1}\delta_{1}\delta_{2}C_{N,b}(\lambda_{1}+i\delta_{1}0,\lambda_{2}+i\delta_{2}0).$ In general, even if $R_{n,b}$ can be rigorously determined, it is difficult to carry out direct study of it. Taking into account relation $(2.13)$, one can simpler-expression $\Xi_{n,b}(\lambda_{1},\lambda_{2})=-\frac{1}{4Nb}\sum_{\delta_{1},\delta_{2}=-1,+1}\delta_{1}\delta_{2}T(\lambda_{1}+i\delta_{1}0,\lambda_{1}+i\delta_{1}0)$ (6.1) and assume that it corresponds to the leading term to $R_{n,b}(\lambda_{1},\lambda_{2})$ in the limit $n,b\rightarrow\infty$. It should be noted that for Wigner random matrices this approach is justified by the study of the simultaneous limiting transition $N\rightarrow\infty$, $\mathrm{Im}z_{j}\rightarrow 0$ in the studies of $C_{N}(z_{1},z_{2})$ [5, 6, 10, 18]. ###### Theorem 6.1. Let $T(z_{1},z_{2})$ is given by (2.12). Assume that function $\hat{\psi}(p)$ is such that there exist positive constants $c_{1}$, $\delta$ and $v>1$ that $\hat{\psi}(p)=\hat{\psi}(0)-c_{1}|p|^{\nu}+o(|p|^{\nu})$ (6.2) for all $p$ such that $|p|\leq{\delta}$, $\delta\rightarrow 0$. Then $\Xi_{n,b}(\lambda_{1},\lambda_{2})=\frac{1}{Nb}\frac{c_{2}}{|\lambda_{1}-\lambda_{2}|^{2-1/v}}(1+o(1))$ (6.3) for $\lambda_{j}$, $j=1,2$ satisfying $\lambda_{1},\lambda_{2}\rightarrow\lambda\in(-2v,2v).$ (6.4) We see from (2.12) that there are two terms in $T(z_{1},z_{2})$. The first was found in [16] for band random matrices, the second coincides with that found in [19] for the ensemble of Wigner random matrices. The proof of (6.3) consists of two parts already done in [16] and [19]. For completeness, we reproduce here these computations. Proof of Theorem 6.1. Let us start with the term of (6.1) that correspond to $\delta_{1}\delta_{2}=-1$. It follows from (2.7) that $\frac{1-v^{2}w_{1}w_{2}}{w_{1}w_{2}}=\frac{z_{1}-z_{2}}{w_{1}-w_{2}}.$ (6.5) The above identity yields relations $\epsilon|w(\lambda+i\epsilon)|^{2}=\mathrm{Im}w(\lambda+i\epsilon)(1-v^{2}|w(\lambda+i\epsilon)|^{2})\quad\hbox{ and }\quad|w(\lambda+i0)|^{2}=v^{-2}$ for $\lambda$ such that $\mathrm{Im}{w}(\lambda+i0)>0$. Combining these relations with (1.4) for the real and imaginary parts of $w(\lambda+i0)=\tau(\lambda)+i\rho(\lambda)$, we obtain that $v^{2}\tau^{2}=\frac{\lambda^{2}}{4v^{2}}\quad\hbox{ and }\quad v^{2}\rho^{2}=1-\frac{\lambda^{2}}{4v^{2}}$ (6.6) (here and below we omit the variable $\lambda$). This implies the existence of the limits $w(z_{1})=\overline{w(z_{2})}$ for (6.4). One can easily deduce from (6.5) that in the limit (6.4) $\frac{1-v^{2}w(z_{1})w(z_{2})}{w(z_{1})w(z_{2})}=\frac{\lambda_{1}-\lambda_{2}}{2i\rho}=o(1).$ (6.7) Also we have that $(1-v^{2}w^{2}_{1})(1-v^{2}w^{2}_{2})=2-2v^{2}(\tau^{2}-\rho^{2})=4v^{2}\rho^{2}.$ (6.8) Now let us consider the leading term of the correlation function. Rewrite (2.12) as $\displaystyle T(z_{1},z_{2})=$ $\displaystyle Q(z_{1},z_{2})+Q^{{}^{\prime}}(z_{1},z_{2})+\frac{2v^{2}Q(z_{1},z_{2})}{(1-v^{2}w^{2}_{1})(1-v^{2}w^{2}_{2})}$ $\displaystyle=$ $\displaystyle\frac{2v^{2}S(z_{1},z_{2})}{(1-v^{2}w^{2}_{1})(1-v^{2}w^{2}_{2})}+Q^{{}^{\prime}}(z_{1},z_{2})$ with $S(z_{1},z_{2})=\frac{1}{2\pi}\int_{-\infty}^{+\infty}\frac{w^{2}_{1}w^{2}_{2}\hat{\psi}(p)}{(1-v^{2}w_{1}w_{2}\hat{\psi}(p))^{2}}dp$ (6.9) and $Q^{{}^{\prime}}(z_{1},z_{2})=\frac{2\Delta v^{4}w_{1}^{3}w_{2}^{3}}{(1-v^{2}w_{1}^{2})(1-v^{2}w_{2}^{2})},$ (6.10) where $\Delta$ is given by (2.14). It is easy to observe that relations (6.6) and $|w(\lambda+i0)|^{2}=|w(\lambda-i0)|^{2}=1/v^{2}$ imply that (cf. [19]) $Q^{{}^{\prime}}(\lambda_{1}+i0,\lambda_{2}-i0)+Q^{{}^{\prime}}(\lambda_{1}-i0,\lambda_{2}+i0)=\frac{\Delta}{v^{4}\rho^{2}}.$ (6.11) Now let us consider $S(z_{1},z_{2})$ (6.9) and let us write $S(z_{1},z_{2})=\frac{1}{2\pi}\left\\{\int_{-\delta}^{\delta}+\int_{\mathbf{R}\setminus(-\delta,\delta)}\right\\}\frac{w^{2}_{1}w^{2}_{2}\hat{\psi}(p)}{(1-v^{2}w_{1}w_{2}\hat{\psi}(p))^{2}}dp=I_{1}+I_{2}.$ Relation (6.5) and (6.7) imply equality $[1-v^{2}w_{1}w_{2}\hat{\psi}(p)]^{2}=[\hat{\Psi}(p)-1]^{2}(1+o(1)).$ (6.12) Since $\psi(t)$ is monotone, then $\liminf_{p\in\mathbf{R}\setminus(-\delta,\delta)}[\Psi(p)-1]^{2}>0.$ This means that $I_{2}<\infty$ in the limit (6.4). Relations (6.2), (6.7) and (6.12) imply in the limit (6.4) and that if we take $\delta|\lambda_{1}-\lambda_{2}|^{-1/\nu}\rightarrow\infty$, we obtain asymptotically (cf. [16]) $I_{1}(\lambda_{1}+i0,\lambda_{2}-i0)+I_{1}(\lambda_{1}-i0,\lambda_{2}+i0)=4B_{v}(c_{1})\frac{(2v\rho)^{2-1/\nu}}{|\lambda_{1}-\lambda_{2}|^{2-1/\nu}},$ (6.13) where $B_{v}(c_{1})=\frac{1}{2\pi c^{1/\nu}_{1}}\left[\int_{0}^{\infty}\frac{ds}{1+s^{2\nu}}-2\int_{0}^{\infty}\frac{ds}{(1+s^{2\nu})^{2}}\right]$ (6.14) and $c_{1}$ is as in (6.2). To prove (6.3), it remains to consider the sum $I_{1}(\lambda_{1}+i0,\lambda_{2}-i0)+I_{2}(\lambda_{1}-i0,\lambda_{2}+i0).$ It is easy to observe that relations of the form (6.8) imply the bounded ness of this sum in the limit (6.4). Now gathering relations (6.8), (6.11) and (6.13), we derive that $\Xi_{n,b}(\lambda_{1},\lambda_{2})=\frac{1}{Nb}\frac{B_{\nu}(c_{1})}{(2v\rho)^{1/\nu}}\frac{1}{|\lambda_{1}-\lambda_{2}|^{2-1/\nu}}(1+o(1)).$ (6.15) This proves (6.3). $\hfill\blacksquare$ Let us discuss two consequences of Theorem 6.1. * $\bullet$ If $\nu=2$ and $c_{1}=\int t^{2}\psi(t)<\infty$. Regarding the RHS of (2.11) in the limit (6.4) with $\lambda_{j}=\lambda+\frac{r_{j}}{N}$, $j=1,2$, we obtain the asymptotic relation (see [16]) $\displaystyle\Xi(\lambda_{1},\lambda_{2})$ $\displaystyle=-\frac{B_{2}(c_{1})}{2\sqrt{2}(v^{2}\rho)^{1/2}}\frac{\sqrt{N}}{b}\frac{1}{|r_{1}-r_{2}|^{3/2}}(1+o(1))$ $\displaystyle=-C\frac{\sqrt{N}}{b}\frac{1}{|r_{1}-r_{2}|^{3/2}}(1+o(1)),\quad C>0.$ (6.16) * $\bullet$ If $\Psi(t)=O(|t|^{-1-\nu})$ with $1<\nu<2$, we obtain the asymptotic relation (see [16]) $\Xi(\lambda_{1},\lambda_{2})=\frac{B_{\nu}(c_{1})}{(2v^{2}\rho)^{1/\nu}}\frac{N^{1-1/\nu}}{b}\frac{1}{|r_{1}-r_{2}|^{2-1/\nu}}(1+o(1))$ (6.17) and conclude that the expression for (6.1) is proportional to $\frac{N^{1-1/\nu}}{b}\frac{1}{|r_{1}-r_{2}|^{2-1/\nu}}.$ The form of asymptotic expressions (6.16) and (6.17) coincides with the expressions determined by Khorunzhy and Kirsch (see [16]) for the spectral correlation function of band random matrices [16]. The first conclusion is that the leading terms of the ensemble we study (see (2.3)) and the ensemble of band random matrices are different but in the local scale, the form (6.16) and (6.17) is the same. More precisely, the tow ensembles mentioned above belong to the same class of spectral universality. Our main conclusion is that the limiting expression for $\Xi_{n,b}(\lambda_{1},\lambda_{2})$ exhibits different behavior depending on the rate of decay of $\psi(t)$ at infinity. In both cases (see (6.16) and (6.17)) the exponents do not depend on the particular form of the function $\psi(t)$. Moreover, in the first case the exponents do not depend on $\psi$ at all. This can be regarded as a kind of spectral universality for the random matrix ensembles $\\{H_{n,b}\\}$ (2.3). One can deduce that these characteristics also do not depend on the probability distribution of the random variables $a(i,j)$ (1.1). ## References * [1] S. Ayadi: Semicircle Law For Random Matrices Of Long-Range Percolation Model. Arxiv PR/0806.4497v1, to appear in Random Operators and Stochastic Eqs. N4, Volume 16, (2009). * [2] S. Ayadi: Asymptotic properties of random matrices of long-range percolation model. (submited in ROSE) * [3] D. Bessis, C. Itzykson, J. B. Zuber. Quantum field theory thechniques in graphical enumeration. Adv. Appl. Math. 1, 109-157 (1980) * [4] P. Bleher and A. Its. Semiclassical asymptotics of orthogonal polynomials, Rieman-Hilbert problem, and universality in the matrix model. Annals of Mathematics, 150, 185-266 (1999) * [5] A. Boutet de Monvel, Khorunzhy: Asymptotic distribution of smoothed eigenvalue density: I. Gaussian random matrices, Random Oper. Stoch. Eqs. 7, 1-22 (1999) II. Wigner random matrices, Random Oper. Stoch. Eqs. 7, 149-167 (1999) * [6] E. Brézin, A. Zee: Universality of the correlations between eigenvalues of large random matrices.Nucl. Phys. B 402 no. 3, 613-627 (1993); Ambjorn J, Jurkiewicz J, Makeenko Yu M.:Multiloop correlators for two-dimensional quantum gravity. Phys. lett. B 251 (4), 517-524 (1990) * [7] G. Casati, L. Molinari, F. Izrailev. Scaling properties of band random matrices. Phys. Rev. Lett. 64 1851 (1990) * [8] D. Coppersmith, D. Gamarnik, M. I. Sviridenko: The diametre of long-range percolation graph. In Mathematics and Computer Science II. Trends Math., Birkhauser, Basel, 147-159 (2002) * [9] A. Crisanti, G. Paladin, A. Vulpiani. Products of Random Matrices in Statistical Physics. Berlin: Springer, (1993) * [10] F. J. Dyson: Statistical theory of the energy levels of complex systems (III).J.Math. Phys 3, 166-175 (1962) * [11] P. A. Deift, A. Its, X. Zhou. A Riemann-Hilbert approach to asymptotic problems arising in the theory of random matrix models, and also in the theory of integrable statistical mechanics. Ann. Math 146, 149-235 (1997) * [12] T. Guhr, A. Müller-Groeling, H. A. Weidenmüller. Random -matrix theories in quantum physics: Common concepts, Phys. Rep. 299, 189-425 (1998) * [13] Y. V. Fyodorov, A. D. Mirlin. Scaling properties of localization in random band matrices. A $\sigma$ model approach. Phys. Rev. Lett. 67, 2405 (1991) * [14] F. Haake. Quantum Signatures of Chaos. Berlin: Springer, (1991) * [15] S. Janson, T. Luczak, A. Rucinski. Random Graphs. John Wiles and Sons, Inc. New York. (2002) * [16] A. Khorunzhy, W. Kirsch: On Asymptotic Expansions and Scales of Spectral Universality in Band Random Matrix Ensembles.Commun. Math. Phys. 231, 223-255 (2002) * [17] O. Khorunzhiy, W. Kirsch, P. Müller. Lifshitz tails for spectra of Erdős-Rènyi random graphs. Ann. Appl. Probab. Volume 16, Number 1, 295-309, (2006) * [18] A. Khorunzhy: On smoothed density of states for Wigner random matrices. Rand. Oper. Stoch. Eqs. 5, 147-162 (1997) * [19] A. Khorunzhy, B. Khoruzhenko, L. Pastur: Asymptotic properties of large random matrices with independent entries.J.Math. Phys. 37 , 5033-5060 (1996) * [20] A. Khorunzhy, B. Khoruzhenko, L. Pastur, M. Shcherbina. Large-n limit in statistical mechanics and the spectral theory of disordered systems. In Phase Transitions and Critical Phenomena, Vol.15, edg C.Domb and J.L.Lebowitz.Academic Press, London, pp. 73-239, (1992) * [21] A. Khorunzhy, L. Pastur: On the eigenvalue distribution of the deformed Wigner ensemble of random matrices. Adv. Soviet. Math. 19, 97-107 (1994) * [22] V. Marchenko, L. Pastur. Math. USSR-sb 1, 457 (1967) * [23] V. Marchenko, L. Pastur: Eigenvalue distribution of some class of random matrices. Matem. Sbornik. 72, 507 (1972) * [24] M. L. Mehta: Random matrices, 2nd ed. Academic, New York, (1991) * [25] S. A. Molchanov, L. Pastur, A. Khorunzhy: Eigenvalue distribution for band random matrices in the limit of their infinite rank. Teor. Matem. Fizika 99, (1992) * [26] L. A. Pastur. Theor. Math.Phys. 10, 67 (1972) * [27] C. Porter: Statistical Theories of Spectra: Fluctuations. New York: Acad. Press, (1965) * [28] A. B. Soshnikov. Universality at the edge of the spectrum in Wigner random matrices. Commun. Math. Phys. 207, 697-733 (1999) * [29] P. Sylvestrov. Summing graphs for random band matrices. Phys. Rev. E 55, 6419-6432 (1997) * [30] D. Voiculescu, K. J. Dykema, A. Nica. Free Random Variables, A noncommutative probability approch to free products with applications to random matrices, operator algebras and harmonic analysis on free groups. CRM Monograph Series, 1. Providence, RI: AMS, 1992 * [31] E. Wigner: Charecteristic vector of bordered matrices with infinite dimentions. Ann. Math. 62, (1955)
arxiv-papers
2009-04-18T09:26:39
2024-09-04T02:49:01.982666
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Slim Ayadi", "submitter": "Ayadi Slim", "url": "https://arxiv.org/abs/0904.2837" }
0904.2839
# On the classification of unstable $H^{\ast}V-A$-modules Dorra BOURGUIBA 111 pris en charge par l’unité de recherche 00/UR/15-05. Faculté de Sciences–Mathématiques, Université de Tunis, TN-1060 Tunis, Tunisie. e-mail: dorra.bourguiba@fst.rnu.tn ###### Abstract In this work, we begin studying the classification, up to isomorphism, of unstable $\mathrm{H}^{\ast}V-A$-modules $E$ such that $\mathbb{F}_{2}\otimes_{\mathrm{H}^{\ast}V}E$ is isomorphic to a given unstable $A$-module $M$. In fact this classification depends on the structure of $M$ as unstable $A$-module. In this paper, we are interested in the case $M$ a nil-closed unstable $A$-module and the case $M$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$. We also study, for $V=\mathbb{Z}/2\mathbb{Z}$, the case $M$ is the Brown-Gitler module $\mathrm{J}(2)$. ## 1 Introduction Let $V$ be an elementary abelian 2-group of rank $d$, that is a group isomorphic to $(\mathbb{Z}/2\mathbb{Z})^{d},\;d\in\mathbb{N}$, $BV$ be a classifying space for the group $V$ and $\mathrm{H}^{\ast}V=H^{\ast}(BV;\mathbb{F}_{2})$. We recall that $\mathrm{H}^{\ast}V$ is an $\mathbb{F}_{2}$-polynomial algebra $\mathbb{F}_{2}[t_{1},\ldots,t_{d}]$ on $d$ generators $t_{i},1\leq i\leq d$, of degree one. Let $A$ be the mod.2 Steenrod algebra and $\mathcal{U}$ the category of unstable $A$-modules. We recall that $\mathrm{H}^{\ast}V-\mathcal{U}$ is the category whose objects are unstable $\mathrm{H}^{\ast}V-A$-modules and morphisms are $\mathrm{H}^{\ast}V$-linear and $A$-linear maps of degree zero. For example, the mod.2 equivariant cohomology of a $V$-CW-complex, which is the cohomology of the Borel construction, is an unstable $\mathrm{H}^{\ast}V-A$-module. Let $E$ be an unstable $\mathrm{H}^{*}V-A$-module, we denote by $\overline{E}$ the unstable $A$-module $\mathbb{F}_{2}\otimes_{\mathrm{H}^{\ast}V}E=E/\widetilde{\mathrm{H}^{*}}V.E$, where $\widetilde{\mathrm{H}^{*}}V$ denotes the augmentation ideal of $\mathrm{H}^{*}V$ . We have the following problem: $\mathcal{(P)}$ : Let $M$ be an unstable A-module. Classify, up to isomorphism, unstable $\mathrm{H}^{\ast}V-A$-modules such that $\overline{E}\cong M$ (as unstable $A$-modules). It is clear that, for every subgroup $W$ of $V$, the unstable $\mathrm{H}^{\ast}V-A$-module: $\mathrm{H}^{\ast}W\otimes M$ is a solution for the problem $\mathcal{(P)}$. For $W=0$, a solution of $\mathcal{(P)}$ is given by the unstable $\mathrm{H}^{\ast}V-A$-module $M$ which is trivial as an $\mathrm{H}^{\ast}V$-module. For $W=V$, a solution of $\mathcal{(P)}$ is given by the unstable $\mathrm{H}^{\ast}V-A$-module $\mathrm{H}^{\ast}V\otimes M$ which is free as an $\mathrm{H}^{\ast}V$-module. If $V=\mathbb{Z}/2\mathbb{Z}$ and $M=\Sigma N$ a suspension of an unstable $A$-module $N$, then we have, at least, the following two solutions of the problem $\mathcal{(P)}$ which are free as $H^{*}(\mathbb{Z}/2\mathbb{Z})$-modules: 1. 1. $\Sigma(H^{*}(\mathbb{Z}/2\mathbb{Z})\otimes N)$. 2. 2. $((H^{*}(\mathbb{Z}/2\mathbb{Z})^{\geq 1})\otimes N$. These two solutions are different as unstable $A$-modules (here $H^{*}(\mathbb{Z}/2\mathbb{Z})^{\geq 1}$ is the sub-algebra of $H^{*}(\mathbb{Z}/2\mathbb{Z})$ of elements of degree bigger than or equal to one). This shows that the solutions of the problem $\mathcal{(P)}$ i.e. the classification, up to isomorphism, of unstable $\mathrm{H}^{\ast}V-A$-modules such that $\overline{E}\cong M$ (as unstable $A$-modules), depends on the structure of $E$ as an $\mathrm{H}^{\ast}V$-module and on the structure of $M$ as unstable $A$-module. In this paper we will discuss the solutions of $\mathcal{(P)}$ if $M$ is a nil-closed unstable $A$-module and $E$ is free as an $H^{*}V$-module and the solutions of $\mathcal{(P)}$ if $M$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$ or to $\mathrm{J}(2)$ and $E$ is free as an $H^{*}V$-module . We begin by proving the following result (which is solution of $(\mathcal{P})$ when $M$ is a nil-closed unstable $A$-module ). ###### Theorem 1.1. Let $E$ be unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $\mathrm{H}^{\ast}V$-module. If $\overline{E}$ is a nil-closed unstable $A$-module, then there exists two reduced $\mathcal{U}$-injectives $I_{0},\;I_{1}$ and an $\mathrm{H}^{\ast}V-A$-linear map $\varphi:\mathrm{H}^{\ast}V\otimes I_{0}\rightarrow\mathrm{H}^{\ast}V\otimes I_{1}$ such that: 1. 1. $E\cong ker\varphi$ 2. 2. $\overline{E}\cong ker\overline{\varphi}$ The proof of this result is based on the classification of $\mathrm{H}^{\ast}V-\mathcal{U}$-injectives and on some properties of the injective hull in the category $\mathrm{H}^{\ast}V-\mathcal{U}$. Our work is naturally motivated by topology as shown in the study of homotopy fixed points of a $\mathbb{Z}/2$-action (see [L1]). Let $X$ be a space equipped with an action of $\mathbb{Z}/2$ and $X^{\mathrm{h}\mathbb{Z}/2}$ denote the space of homotopy fixed points of this action. The problem of determining the $\bmod{.\hskip 2.0pt2}$ cohomology of $X^{\mathrm{h}\mathbb{Z}/2}$ (we ignore deliberately the questions of $2$-completion) involves two steps: * – determining the $\bmod{.\hskip 2.0pt2}$ equivariant cohomology $\mathrm{H}^{*}_{\mathbb{Z}/2}X$; * – determining $\mathrm{Fix}_{\mathbb{Z}/2}\hskip 2.0pt\mathrm{H}^{*}_{\mathbb{Z}/2}X$ (for the definition of the functor $\mathrm{Fix}_{\mathbb{Z}/2}$ see section 2). For the first step, see for example [DL], the main information one has about the $\mathbb{Z}/2$-space $X$ is that the Serre spectral sequence, for $\bmod{.\hskip 2.0pt2}$ cohomology, associated to the fibration $X\rightarrow X_{\mathrm{h}\mathbb{Z}/2}\rightarrow\mathrm{B}\mathbb{Z}/2$ collapses ($X_{\mathrm{h}\mathbb{Z}/2}$ denotes the Borel construction $\mathrm{E}\mathbb{Z}/2\times_{\mathbb{Z}/2}X$). This collapsing implies that $\mathrm{H}^{*}_{\mathbb{Z}/2}X$ is $\mathrm{H}$-free and that $\overline{\mathrm{H}^{*}_{\mathbb{Z}/2}X}$ is canonically isomorphic to $\mathrm{H}^{*}X$. This gives clearly a topological application of problem $(\mathcal{P})$. We then prove the following results (related to the case $\overline{E}$ is $\sum^{n}\mathbb{F}_{2}$ and $\mathrm{J}(2)$). ###### Theorem 1.2. Let $E$ be unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $\mathrm{H}^{\ast}V$-module. If $\overline{E}$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$, then there exists an element $u$ in $\mathrm{H}^{\ast}V$ such that: 1. 1. $u=\displaystyle\prod_{i}\theta_{i}^{\alpha_{i}}$, where $\theta_{i}\in(\mathrm{H}^{1}V)\setminus\\{0\\}$ and $\alpha_{i}\in\mathbb{N}$ 2. 2. $E\cong\sum^{d}u\mathrm{H}^{\ast}V$ with $d+\displaystyle\sum_{i}\alpha_{i}=n$ ###### Proposition 1.3. Let $E$ be an $\mathrm{H}-A$-module which is $\mathrm{H}$-free and such that $\overline{E}$ is isomorphic to $\mathrm{J}(2)$ then: $E\cong\mathrm{H}\otimes\mathrm{J}(2)$ or $E$ is the sub-$\mathrm{H}-A$-module of $\mathrm{H}\oplus\sum\mathrm{H}$ generated by $(t,\Sigma 1)$ and $(t^{2},0)$. The proofs of these two results are based on Smith theory, some properties of the functor $\mathrm{F}ix$ and on a result of J.P. Serre. The paper is structured as follows. In section 2, we introduce the definitions of reduced and nil-closed unstable $A$-modules. We give the classification of injective modules in the category $\mathcal{U}$ and in the category $H^{*}V-\mathcal{U}$. We also recall the algebraic Smith theory. In section 3, we establish some properties of $E$ when $\overline{E}$ is a reduced unstable $A$-module. The results will be useful in section 4, where we give the solutions of the problem ($\mathcal{P}$) when $E$ is free as an $\mathrm{H}^{\ast}V$-module and $\overline{E}$ is nil-closed. In section 5, we give some topological applications. In section 6, we give the solutions of the problem ($\mathcal{P}$) when $E$ is free as an $\mathrm{H}^{\ast}V$-module and $\overline{E}$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$, we also give a topological application. In section 7, we solve the problem ($\mathcal{P}$) when $\overline{E}$ is the Brown-Gitler module $\mathrm{J}(2)$ and $V$ is $\mathbb{Z}/2\mathbb{Z}$. Acknowledgements. I would like to thank Professor Jean Lannes and Professor Said Zarati for several useful discussions. I am grateful to the referee for his suggestions. ## 2 Preliminaries on the categories $\mathcal{U}$ and $\mathrm{H}^{\ast}V-\mathcal{U}$ In this section, we will fix some notations, recall some definitions and results about the categories $\mathcal{U}$ and $\mathrm{H}^{\ast}V-\mathcal{U}$. ### 2.1 Nilpotent unstable $A$-modules Let $N$ be an unstable $A$-module. We denote by $Sq_{0}$ the $\mathbb{Z}/2\mathbb{Z}$-linear map: $Sq_{0}:N\rightarrow N,\;x\mapsto Sq_{0}(x)=Sq^{\mid x\mid}x.$ An unstable $A$-module $N$ is called nilpotent if: $\forall\;x\in N,\;\exists\;n\in\mathbb{N};\;Sq_{0}^{n}x=0.$ For example, finite unstable $A$-modules and suspension of unstable $A$-modules are nilpotent. Let $Tor^{\mathrm{H}^{\ast}V}_{1}(\mathbb{F}_{2},N)$ be the first derived functor of the functor $\mathbb{F}_{2}\otimes_{\mathrm{H}^{\ast}V}-\;:\mathrm{H}^{\ast}V-\mathcal{U}\rightarrow\mathcal{U}$, we have the following useful result. ###### Proposition 2.1.1. ([S] page 150) Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module, then the unstable $A$-module $Tor^{\mathrm{H}^{\ast}V}_{1}(\mathbb{F}_{2},N)$ is nilpotent. ### 2.2 Reduced unstable $A$-modules An unstable $A$-module $M$ is called reduced if the $\mathbb{Z}/2\mathbb{Z}$-linear map: $Sq_{0}:M\rightarrow M,\;x\mapsto Sq_{0}(x)=Sq^{\mid x\mid}x,$ is an injection. Another characterization of reduced unstable $A$-module in terms of nilpotent modules is the following. ###### Lemma 2.2.1. ([LZ1]) An unstable $A$-module is reduced if it does not contain a non-trivial nilpotent module. In particular, any $A$-linear map from a nilpotent $A$-module to a reduced one is trivial. ### 2.3 Nil-closed unstable $A$-modules Let $M$ be an unstable $A$-module. We denote by $Sq_{1}$ the $\mathbb{Z}/2\mathbb{Z}$-linear map: $Sq_{1}:N\rightarrow N,\;x\mapsto Sq_{1}(x)=Sq^{\mid x\mid-1}x.$ ###### Definition 2.3.1. ([EP]) An unstable $A$-module $M$ is called nil-closed if: 1. 1. $M$ is reduced. 2. 2. $Ker(Sq_{1})=Im(Sq_{0})$. We have the following two characterizations of unstable nil-closed $A$-modules. ###### Lemma 2.3.2. ([LZ1]) Let $M$ be an unstable $A$-module and $\mathcal{E}(M)$ be its injective hull. The unstable $A$-module $M$ is nil-closed if and only if $M$ and the quotient $\mathcal{E}(M)/M$ are reduced. Let $Ext^{s}_{\mathcal{U}}(-,M)$ be the s-th derived functor of the functor $\mathrm{H}om_{\mathcal{U}}(-,M)$. ###### Lemma 2.3.3. ([LZ1]) An unstable $A$-module $M$ is nil-closed if and only if $Ext^{s}_{\mathcal{U}}(N,M)=0$ for any nilpotent unstable $A$-module $N$ and $s=0,1$. ### 2.4 Injectives in the category $\mathcal{U}$ Let $I$ be an unstable $A$-module, $I$ is called an injective in the category $\mathcal{U}$ or $\mathcal{U}$-injective for short, if the functor $\mathrm{H}om_{\mathcal{U}}(-,I)$ is exact. The classification of $\mathcal{U}$-injectives (see [LZ1], [LS]) is the following. Let $\mathrm{J}(n),\;n\in\mathbb{N}$, be the $n$-th Brown- Gitler module, characterized up to isomorphism, by the functorial bijection on the unstable $A$-module M: $\mathrm{H}om_{\mathcal{U}}(M,\mathrm{J}(n))\cong\mathrm{H}om_{\mathbb{F}_{2}}(M^{n},\mathbb{F}_{2})$ Clearly $\mathrm{J}(n)$ is an $\mathcal{U}$-injective and it is a finite module. Let $\mathcal{L}$ be a set of representatives for $\mathcal{U}$-isomorphism classes of indecomposable direct factors of $\mathrm{H}^{\ast}(\mathbb{Z}/2\mathbb{Z})^{m},\;m\in\mathbb{N}$ (each class is represented in $\mathcal{L}$ only once). We have: ###### Theorem 2.4.1. Let $I$ be an $\mathcal{U}$-injective module. Then there exists a set of cardinals $a_{L,n}\;,(L,n)\in\mathcal{L}\times\mathbb{N}$, such that $I\cong\displaystyle\bigoplus_{(L,n)}(L\otimes\mathrm{J}(n))^{\oplus a_{L,n}}$ . Conversely, any unstable $A$-module of that form is $\mathcal{U}$-injective. Let’s remark that $\mathrm{H}^{\ast}V$ is an $\mathcal{U}$-injective. ### 2.5 The injectives of the category $\mathrm{H}^{\ast}V-\mathcal{U}$ The classification of injectives of the category $\mathrm{H}^{\ast}V-\mathcal{U}\;\;(\mathrm{H}^{\ast}V-\mathcal{U}$-injectives for short) is given by Lannes-Zarati [LZ2] as follows. Let $\mathrm{J}_{V}(n),\;n\in\mathbb{N}$, be the unstable $\mathrm{H}^{\ast}V-A$-module characterized, up to isomorphism, by the functorial bijection on the unstable $\mathrm{H}^{\ast}V-A$-module M: $\mathrm{H}om_{\mathrm{H}^{\ast}V-\mathcal{U}}(M,\mathrm{J}_{V}(n))\cong\mathrm{H}om_{\mathbb{F}_{2}}(M^{n},\mathbb{F}_{2})$ Clearly $\mathrm{J}_{V}(n)$ is an $\mathrm{H}^{\ast}V-\mathcal{U}$-injective. Let $\mathcal{W}$ be the set of subgroups of $V$ and let $(W,n)\in\mathcal{W}\times\mathbb{N}$, we write $E(V,W,n)=\mathrm{H}^{\ast}V\otimes_{\mathrm{H}^{\ast}V/W}\mathrm{J}_{V/W}(n)$ (in this formula $\mathrm{H}^{\ast}V$ is an $\mathrm{H}^{\ast}V/W$-module via the map induced in mod.2 cohomology by the canonical projection $V\rightarrow V/W$). ###### Theorem 2.5.1. ([LZ2]) If I is an injective of the category of $\mathrm{H}^{\ast}V-\mathcal{U}$, then $I\cong\displaystyle\bigoplus_{(L,W,n)\in\mathcal{L}\times\mathcal{W}\times\mathbb{N}}(E(V,W,n)\otimes_{\mathbb{F}_{2}}L)^{\oplus_{a_{L,W,n}}}$. Conversely, each $\mathrm{H}^{\ast}V-A$-module of this form is an $\mathrm{H}^{\ast}V-\mathcal{U}$-injective. Clearly $\mathrm{H}^{\ast}V$ is an $\mathrm{H}^{\ast}V-\mathcal{U}$-injective. ### 2.6 Algebraic Smith theory #### 2.6.1 The functors $\mathrm{F}ix$ We introduce the functors $\mathrm{F}ix$ ([L1], [LZ2]). We denote by $\mathrm{F}ix_{V}:\mathrm{H}^{\ast}V-\mathcal{U}\rightarrow\mathcal{U}$ the left adjoint of the functor $\mathrm{H}^{\ast}V\otimes-:\mathcal{U}\rightarrow\mathrm{H}^{\ast}V-\mathcal{U}$ We have the functorial bijection: $\displaystyle\mathrm{H}om_{\mathrm{H}^{\ast}V-\mathcal{U}}(N,\;H^{\ast}V\otimes P)\cong\mathrm{H}om_{\mathcal{U}}(\mathrm{F}ix_{V}N,\;P)$ for every unstable $\mathrm{H}^{\ast}V-A$-module $N$ and every unstable $A$-module $P$. The functor $\mathrm{F}ix_{V}$ has the following properties. 2.6.1.1. The functor $\mathrm{F}ix_{V}$ is an exact functor. 2.6.1.2. Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module and $\mathcal{E}(N)$ be its injective hull. Then, the module $\mathrm{F}ix_{V}\mathcal{E}(N)$ is the injective hull of $\mathrm{F}ix_{V}N$. #### 2.6.2 Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module, we denote by $\eta_{{}_{V}}:\;N\rightarrow\mathrm{H}^{\ast}V\otimes\mathrm{F}ix_{{}_{V}}N$ the adjoint of the identity of $Fix_{{}_{V}}N$. We denote by $\mathrm{c}_{V}=\displaystyle\prod_{u\in\mathrm{H}^{1}V-\\{0\\}}u$ the top Dickson invariant, we have the following result (see [LZ2] corollary 2.3). ###### Proposition 2.6.1. Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module. The localization of the map $\eta_{{}_{V}}$ $\eta_{{}_{V}}[\mathrm{c}_{V}^{-1}]:N[\mathrm{c}_{V}^{-1}]\rightarrow\mathrm{H}^{\ast}V[\mathrm{c}_{v}^{-1}]\otimes\mathrm{F}ix_{V}N$ is an injection. This shows in particular, that if $N$ is torsion-free then the map $\eta_{{}_{V}}$ is an injection. The proposition 2.6.1 can be reformulated as follows. ###### Proposition 2.6.2. Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module. If $N$ is torsion-free then its injective hull in $\mathrm{H}^{\ast}V-\mathcal{U}$ is free as an $H^{*}V$-module and is isomorphic to $\displaystyle\bigoplus_{(L,n)\in\mathcal{L}\times\mathbb{N}}(\mathrm{H}^{\ast}V\otimes\mathrm{J}(n))\otimes L$ ###### Proof. Since the module is torsion-free then the map $\eta_{{}_{V}}:\;N\rightarrow\mathrm{H}^{\ast}V\otimes\mathrm{F}ix_{{}_{V}}N$ adjoint of the identity of $\mathrm{F}ix_{{}_{V}}N$ is an injection. So $N$ is a sub-$\mathrm{H}^{\ast}V-A$-module of $\mathrm{H}^{\ast}V\otimes\mathrm{F}ix_{{}_{V}}N$. By 2.6.1.1 and 2.6.1.2, we have that the injective hull of $N$ is isomorphic to $\mathrm{H}^{\ast}V\otimes I$, where $I$ is an $\mathcal{U}$-injective. ∎ ###### Remark 2.6.3. As a consequence of proposition 2.6.2, we have that if $E$ is an unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $\mathrm{H}^{\ast}V$-module then its injective hull (in the category $\mathrm{H}^{\ast}V-\mathcal{U}$) is also free as an $\mathrm{H}^{\ast}V$-module. ###### Proposition 2.6.4. [LZ2]. Let $N$ be an unstable $\mathrm{H}^{\ast}V-A$-module which is of finite type as an $\mathrm{H}^{\ast}V$-module. The localization of the map $\eta_{{}_{V}}$ $\eta_{{}_{V}}[\mathrm{c}_{V}^{-1}]:N[\mathrm{c}_{V}^{-1}]\rightarrow\mathrm{H}^{\ast}V[\mathrm{c}_{V}^{-1}]\otimes\mathrm{F}ix_{V}N$ is an isomorphism. In particular, the previous result shows that: 1. 1. If $N$ is free as an $\mathrm{H}^{\ast}V$-module, then the map $\eta_{V}$ is an injection. 2. 2. The isomorphism of the proposition proves that $dim\overline{E}=dim\mathrm{F}ix_{V}E$ where $dim$ is the total dimension (see [LZ2]). ## 3 Some properties of $E$ when $\overline{E}$ is reduced In this section we will prove some algebraic results which will be useful for section 4. In fact, we will analyze the relation between an unstable $\mathrm{H}^{\ast}V-A$-module $E$ and its (associated) unstable $A$-module $\overline{E}$. For this, we will begin by giving some technical results. ### 3.1 Technical results ###### Lemma 3.1.1. Let $P$ and $Q$ be unstable $\mathrm{H}^{\ast}V-A$-modules, free as $\mathrm{H}^{\ast}V$-modules and $f:P\rightarrow Q$ an $\mathrm{H}^{\ast}V-A$-linear map. If the induced map $\overline{f}:\overline{P}\rightarrow\overline{Q}$ is an injection then $f$ is also an injection. ###### Proof. Let’s denote by $Imf$ the image of $f$, by $\widetilde{f}:P\rightarrow Imf$ the natural surjection and by $i:Imf\hookrightarrow Q$ the inclusion of $Imf$ in $Q$. Since $\overline{f}$ is an injection so the induced map $\overline{(\widetilde{f})}$ is an isomorphism of unstable $A$-modules and then the induced map $\overline{i}$ is an injection. This shows that $\overline{Imf}$ is the image of $\overline{f}$. Since the module $Imf$ is a sub-$\mathrm{H}^{\ast}V$-module of the $\mathrm{H}^{\ast}V$-free module $Q$ and $\overline{i}:\overline{Imf}\hookrightarrow\overline{Q}$ is an injection, so $Imf$ is free as an $\mathrm{H}^{\ast}V$-module. In particular, we have that $Tor_{1}^{\mathrm{H}^{\ast}V}(\mathbb{F}_{2},Imf)$=0 (see for example [R]). Let’s denote by $N$ the kernel of the map $\widetilde{f}$, so we have the following short exact sequence in $\mathrm{H}^{\ast}V-\mathcal{U}$: $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{N\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 53.62497pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 68.62497pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 68.62497pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{P\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 88.6562pt\raise 12.61111pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 9.61111pt\hbox{$\scriptstyle{\widetilde{f}}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 106.43399pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 106.43399pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{Imf\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.21411pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 145.21411pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces\,.$ By applying the functor ($\mathbb{F}_{2}\otimes_{\mathrm{H}^{\ast}V}-$) to the previous sequence, we prove that $\overline{N}$ is trivial (since the map $\overline{(\widetilde{f})}$ is an isomorphism and $Imf$ is free as an $\mathrm{H}^{\ast}V-A$-module). Hence the module $N$ is trivial and the map $f$ is an injection. ∎ The converse of this lemma is not true in general, but we have the following result: ###### Lemma 3.1.2. Let $P$ and $Q$ be unstable $\mathrm{H}^{\ast}V-A$-modules, free as $\mathrm{H}^{\ast}V$-modules and $f:P\rightarrow Q$ an $\mathrm{H}^{\ast}V-A$-linear map which is an injection. If $\overline{P}$ is a reduced unstable $A$-module, then the induced map $\overline{f}:\overline{P}\rightarrow\overline{Q}$ is an injection. ###### Proof. We denote by $C$ the quotient of $Q$ by $P$, we have the following short exact sequence in $\mathrm{H}^{\ast}V-\mathcal{U}$: $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{P\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 50.21873pt\raise 12.1111pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 9.1111pt\hbox{$\scriptstyle{f}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 67.30902pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 67.30902pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{Q\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 90.21457pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 105.21457pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 105.21457pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{C\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 143.07706pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 143.07706pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces\,.$ By applying the functor ($\mathbb{F}_{2}\otimes_{\mathrm{H}^{\ast}V}-$) to the previous sequence, we obtain an exact sequence in $\mathcal{U}$: $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{Tor^{\mathrm{H}^{\ast}V}_{1}(\mathbb{F}_{2},C)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 69.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 69.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\overline{P}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 86.52911pt\raise 11.83888pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 8.83888pt\hbox{$\scriptstyle{\overline{f}}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 104.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 104.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\overline{Q}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 124.02911pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 139.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 139.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\overline{C}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 174.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 174.02911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces\,.$ Since $\overline{P}$ is reduced as unstable $A$-module and $Tor_{1}^{{\mathrm{H}^{\ast}V}}(\mathbb{F}_{2},C)$ is nilpotent (see proposition 2.1.1), then the map $\overline{f}$ is an injection. ∎ ### 3.2 Statement of some properties of $E$ when $\overline{E}$ is reduced The first result of this paragraph concerns the relation between the injective hull of $E$ and the induced module $\overline{E}$. ###### Theorem 3.2.1. Let $E$ be an unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $H^{*}V$-module and let $\mathcal{E}(E)$ be its injective hull (in the category $\mathrm{H}^{\ast}V-\mathcal{U}$). We suppose that $\overline{E}$ is reduced and let $I$ be its injective hull in the category $\mathcal{U}$. Then $\mathcal{E}(E)$ is isomorphic, as an unstable $\mathrm{H}^{*}V-A$-module, to $\mathrm{H}^{*}V\otimes I$. ###### Proof. Since $E$ is free as an $\mathrm{H}^{*}V$-module, then $\mathcal{E}(E)$ is isomorphic, in the category $\mathrm{H}^{*}V-\mathcal{U}$, to $\mathrm{H}^{*}V\otimes J$, where $J$ is an $\mathcal{U}$-injective (see proposition 2.6.2). Let’s denote by $i$ the inclusion of $E$ in $\mathcal{E}(E)$, we have, by lemma 3.1.2, that the induced map $\overline{i}$ is an injection. We will prove, by using the definition, that $J$ is the injective hull of $\overline{E}$, in the category $\mathcal{U}$. Let $P$ be a sub-$A$-module of $J$ such that the $A$-module $(\overline{i})^{-1}(P)$ is trivial, we have to show that the unstable $A$-module $P$ is trivial. Since $(\overline{i})^{-1}(P)$ is trivial then the composition: $\pi\circ\overline{i}:\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\overline{E}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 12.0pt\raise 11.83888pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 8.83888pt\hbox{$\scriptstyle{\overline{i}}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{J\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 49.01184pt\raise 10.50694pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 7.50694pt\hbox{$\scriptstyle{\pi}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 66.00693pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 66.00693pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{J/P}$}}}}}}}\ignorespaces}}}}\ignorespaces$ is an injection. By lemma 3.1.1, the following composition $\textstyle{E\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{i}$$\textstyle{\mathrm{H}^{*}V\otimes J\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{*}V\otimes(J/P)}$ is an injection, which proves that the unstable $\mathrm{H}^{*}V-A$-module $i^{-1}(\mathrm{H}^{*}V\otimes P)$ is trivial. Since $\mathrm{H}^{*}V\otimes J$ is the injective hull of $E$ so the unstable $\mathrm{H}^{*}V-A$-module $\mathrm{H}^{*}V\otimes P$ is trivial. ∎ ###### Corollary 3.2.2. Let $E$ be an unstable $\mathrm{H}^{\ast}V-A$-module such that: 1. 1. $E$ is free as an $\mathrm{H}^{*}V$-module. 2. 2. $\overline{E}$ is reduced as unstable $A$-module. Then $E$ is reduced as unstable $A$-module. ###### Proof. We have, by theorem 3.2.1, that the injective hull of $E$ is $\mathrm{H}^{*}V\otimes I$, where $I$ is the injective hull of $\overline{E}$ in $\mathcal{U}$. Since $\overline{E}$ is reduced, then $I$ is a reduced $\mathcal{U}$-injective. This shows that $E$ is reduced as an unstable $A$-module because its injective hull (in the category $\mathrm{H}^{\ast}V-\mathcal{U}$) is $\mathrm{H}^{*}V\otimes I$ which is reduced as unstable $A$-module. ∎ ###### Remark 3.2.3. In the previous result the condition (1): $E$ is free as an $\mathrm{H}^{*}V$-module is necessary. In fact, the finite $\mathrm{H}-A$-module $\mathrm{J}_{\mathbb{Z}/2\mathbb{Z}}(1)$ is not free as an $\mathrm{H}$-module and not reduced as an unstable $A$-module, however $\overline{\mathrm{J}_{\mathbb{Z}/2\mathbb{Z}}(1)}=\mathbb{F}_{2}$ is a reduced unstable $A$-module. Observe that $\mathrm{J}_{\mathbb{Z}/2\mathbb{Z}}(1)$ is isomorphic, as unstable $A$-module, to $\mathbb{F}_{2}\oplus\sum\mathbb{F}_{2}$, the structure of $\mathrm{H}$-module is given by: $t.\iota=\Sigma\iota$, where $\iota$ is the generator of $\mathbb{F}_{2}$ and $t$ the generator of $\mathrm{H}$. Observe that the converse of corollary 3.2.2 is false. In fact, the $\mathrm{H}-A$-module $E=\mathrm{H}^{\geq 1}$ is reduced as unstable $A$-module however the unstable $A$-module $\overline{E}\cong\sum\mathbb{F}_{2}$ is not reduced. ## 4 Description of $E$ when $\overline{E}$ is nil-closed The main result of this paragraph concerns the relation between the two first terms of a (minimal) injective resolution of $E$ and $\overline{E}$. ###### Theorem 4.1. Let $E$ be an unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $\mathrm{H}^{*}V$-module. We suppose that: 1. 1. $\overline{E}$ is nil-closed. 2. 2. $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\overline{E}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{i_{1}}$$\textstyle{I_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{....}$ is the beginning of a (minimal) $\mathcal{U}$\- injective resolution of $\overline{E}$. Then there exists an $\mathrm{H}^{\ast}V-A$-linear map $\varphi:\mathrm{H}^{*}V\otimes I_{0}\rightarrow\mathrm{H}^{*}V\otimes I_{1}$ such that: 1. 1. $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{E\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{*}V\otimes I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\varphi}$$\textstyle{\mathrm{H}^{*}V\otimes I_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{....}$ is the beginning of a (minimal) injective resolution of $E$ (in the category $\mathrm{H}^{*}V-\mathcal{U}$). 2. 2. $\overline{\varphi}=i_{1}$ ###### Proof. The unstable $A$-module $\overline{E}$ is nil-closed so is reduced, we have then, by theorem 3.2.1, that the injective hull of $E$ is $\mathrm{H}^{*}V\otimes I_{0}$. We denote by $C_{0}$ the quotient of $\mathrm{H}^{\ast}V\otimes I_{0}$ by $E$. We have the following short exact sequence in $\mathrm{H}^{\ast}V-\mathcal{U}$: $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{E\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 51.25252pt\raise 15.64444pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 12.64444pt\hbox{$\scriptstyle{i_{0}}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathrm{H}^{*}V\otimes I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 92.45828pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 107.45828pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 107.45828pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{C_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 145.32077pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 145.32077pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces\,.$ Since the induced map $\overline{i_{0}}$ is an injection (see lemma 3.1.2), then the unstable $A$-module $Tor_{1}^{\mathrm{H}^{\ast}V}(\mathbb{F}_{2},C_{0})$ is trivial; this shows that the module $C_{0}$ is free as an $\mathrm{H}^{*}V$-module (see for example [NS], proposition A.1.5). We verify that the $\mathcal{U}$-injective hull of $\overline{C_{0}}$ is $I_{1}$ and that $C_{0}$ is reduced since $\overline{C_{0}}$ is reduced (see corollary 3.2.2). This implies, by theorem 3.2.1, that the $\mathrm{H}^{*}V-\mathcal{U}$-injective hull of $C_{0}$ is isomorphic to $\mathrm{H}^{*}V\otimes I_{1}$. ∎ ###### Remark 4.2. let $M$ be a nil-closed unstable $A$-module and $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{M\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{i_{0}}$$\textstyle{I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{i_{1}}$$\textstyle{I_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{....}$ be the beginning of a (minimal) $\mathcal{U}$-injective resolution of $M$. We denote by $(\mathrm{H}om_{\mathrm{H}^{\ast}V-\mathcal{U}}(\mathrm{H}^{\ast}V\otimes I_{0},\;\mathrm{H}^{\ast}V\otimes I_{1}))_{i_{1}}$ the set of $\mathrm{H}^{\ast}V-A$-linear map $\varphi:\mathrm{H}^{\ast}V\otimes I_{0}\rightarrow\mathrm{H}^{\ast}V\otimes I_{1}$ such that $\overline{\varphi}=i_{1}$. Using Lannes T-functor (see [L1]) we have: $(\mathrm{H}om_{\mathrm{H}^{\ast}V-\mathcal{U}}(\mathrm{H}^{\ast}V\otimes I_{0},\;\mathrm{H}^{\ast}V\otimes I_{1}))_{i_{1}}\cong(\mathrm{H}om_{\mathcal{U}}(T_{V}I_{0},\;I_{1}))_{i_{1}}$ where $(\mathrm{H}om_{\mathcal{U}}(T_{V}I_{0},\;I_{1}))_{i_{1}}$ is the set of $A$-linear map $\psi:T_{V}I_{0}\rightarrow I_{1}$ such that $\psi\circ i=i_{1}$, where $i:I_{0}\hookrightarrow T_{V}I_{0}$ denotes the natural inclusion. The kernel of any element $\psi\in(\mathrm{H}om_{\mathcal{U}}(T_{V}I_{0},\;I_{1}))_{i_{1}}$, which is free as an $\mathrm{H}^{*}V$-module, is an unstable $\mathrm{H}^{\ast}V-A$-module such that $\overline{ker\psi}\cong M$. ###### Remark 4.3. If $\overline{E}$ is an $\mathcal{U}$-injective then the only unstable free $\mathrm{H}^{\ast}V-A$-module, up to isomorphism, solution of the problem $(\mathcal{P})$ is $\mathrm{H}^{\ast}V\otimes\overline{E}$. Let $n$ be an even integer. The unstable free $\mathrm{H}-A$-modules, up to isomorphism, solution of the problem $(\mathcal{P})$ when $M$ is $\mathrm{H}^{*}BSO(n)$ are $\mathrm{H}^{*}BO(n)$ and $\mathrm{H}\otimes\mathrm{H}^{*}BSO(n)$. We verify that these two $\mathrm{H}-A$-modules are not isomorphic in the category $\mathrm{H}-\mathcal{U}$ (since it does not exist an $A$-linear section of the projection $\mathrm{H}^{*}BO(n)\rightarrow\mathrm{H}^{*}BSO(n)$). ## 5 Applications ### 5.1 Our first application concerns the determination of the $\bmod{.\hskip 2.0pt2}$ cohomology of the mapping space $\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n}),Y)$ whose domain is a classifying space for the group $\mathbb{Z}/2^{n}$ and whose range is a space $Y$ such that $\mathrm{H}^{*}Y$ is concentrated in even degrees. We will just recall some facts, ignoring the p-completion problems. For further details see [DL]. One proceeds by induction on the integer $n$. Let us set $\hskip 24.0ptX=\mathbf{hom}\hskip 1.0pt(\mathrm{E}\hskip 1.0pt(\mathbb{Z}/2^{n})/(\mathbb{Z}/2^{n-1}),Y)\hskip 24.0pt.$ The space $X$ has the homotopy type of $\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n-1}),Y)$ and is equipped of an action $\mathbb{Z}/2$ such that one has a homotopy equivalence $\hskip 24.0pt\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n}),Y)\cong X^{\mathrm{h}\hskip 1.0pt\mathbb{Z}/2}\hskip 24.0pt,$ $X^{\mathrm{h}\hskip 1.0pt\mathbb{Z}/2}$ denoting the homotopy fixed point space: $\mathbf{hom}_{\mathbb{Z}/2}\hskip 1.0pt(\mathrm{E}\hskip 1.0pt\mathbb{Z}/2,X)$. Using $\mathrm{Fix}_{\mathbb{Z}/2}$-theory [L1], one gets: $\hskip 24.0pt\mathrm{H}^{*}\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n}),Y)\cong\mathrm{Fix}_{\mathbb{Z}/2}\hskip 2.0pt\mathrm{H}^{*}_{\mathbb{Z}/2}\hskip 1.0ptX\hskip 24.0pt.$ Since the computation of the functor $\mathrm{Fix}_{\mathbb{Z}/2}$ on an unstable $\mathrm{H}-\mathrm{A}$-module is not difficult in general, the determination of the $\bmod{.\hskip 2.0pt2}$ cohomology of the mapping space $\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n}),Y)$ is reduced to the determination of the unstable $\mathrm{H}-\mathrm{A}$-module $\mathrm{H}^{*}_{\mathbb{Z}/2}\hskip 1.0ptX$. As we are going to explain, this last point is closely related to problem $(\mathcal{P})$. One knows by induction on $n$ that the $\bmod{.\hskip 2.0pt2}$ cohomology of the space $X$ as the one of the space $Y$ is concentrated in even degrees and one checks that the action of $\mathbb{Z}/2$ on $\mathrm{H}^{*}(Y;\mathbb{Z})$ is trivial. These two facts imply that the Serre spectral sequence, for $\bmod{.\hskip 2.0pt2}$ cohomology, associated to the fibration $X\rightarrow X_{\mathrm{h}\mathbb{Z}/2}\rightarrow\mathrm{B}\mathbb{Z}/2$ collapses ($X_{\mathrm{h}\mathbb{Z}/2}$ denotes the Borel construction $\mathrm{E}\mathbb{Z}/2\times_{\mathbb{Z}/2}X$). This collapsing implies in turn that $\mathrm{H}^{*}_{\mathbb{Z}/2}X$ is $\mathrm{H}$-free and that $\overline{\mathrm{H}^{*}_{\mathbb{Z}/2}X}$ is isomorphic to $\mathrm{H}^{*}X$. So the determination of $\mathrm{H}^{*}\mathbf{hom}\hskip 1.0pt(\mathrm{B}\hskip 1.0pt(\mathbb{Z}/2^{n}),Y)$ is indeed reduced to the resolution of a problem $(\mathcal{P})$. We conclude this subsection by a concrete example (we follow [De], section 6); we take $n=2$ and $Y=\mathrm{BSU}(2)$. Using $\mathrm{T}_{\mathbb{Z}/2}$-computations one sees that $X$ has the homotopy type of $\mathrm{BSU}(2)\coprod\mathrm{BSU}(2)$; one checks also that the $\mathbb{Z}/2$-action preserves the connected components. The $(\mathcal{P})$-problem asociated to the determination of the unstable $\mathrm{H}-\mathrm{A}$-module $\mathrm{H}^{*}_{\mathbb{Z}/2}\hskip 1.0ptX$ is the following one: Find the unstable $\mathrm{H}-\mathrm{A}$-modules $E$ such that * – $E$ is $\mathrm{H}$-free; * – the unstable $\mathrm{A}$-module $\overline{E}$ is isomorphic to $\mathrm{H}^{*}\mathrm{BSU}(2)$. Using the fact that the injective hull, in the category $\mathrm{H}-\mathcal{U}$, of $E$ is $\mathrm{H}\otimes\mathrm{H}$ (see theorem 3.2), one checks that one has two possibilities: * – $E\cong\mathrm{H}\otimes\mathrm{H}^{*}\mathrm{BSU}(2)$; * – $E\cong\mathrm{H}\otimes_{\mathrm{H}^{*}\mathrm{BU}(1)}\mathrm{H}^{*}\mathrm{BU}(2)$ (the structures of unstable $\mathrm{H}^{*}\mathrm{BU}(1)-\mathrm{A}$-modules on $\mathrm{H}=\mathrm{H}^{*}\mathrm{BO}(1)$ and $\mathrm{H}^{*}\mathrm{BU}(2)$ are respectively induced by the inclusion of $\mathrm{O}(1)$ in $\mathrm{U}(1)$ and the determinant homomorphism from $\mathrm{U}(2)$ to $\mathrm{U}(1)$). ### 5.2 The theorem 4.1 can be illustrated, topologically, as follows: ###### Proposition 5.2.1. Let $X$ be a CW-complex on which acts an elementary abelian group 2-group $V$. Suppose that: 1. 1. $\mathrm{H}^{\ast}X$ is nil-closed 2. 2. $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{\ast}X\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\alpha}$$\textstyle{I_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{....}$ is the beginning of a (minimal) $\mathcal{U}$-injective resolution of $\mathrm{H}^{\ast}X$ 3. 3. $\mathrm{H}^{\ast}_{V}X$ is free as an $\mathrm{H}^{*}V$-module. Then there exists an $\mathrm{H}^{\ast}V-A$-linear map $\varphi:\;\mathrm{H}^{*}V\otimes I_{0}\rightarrow\mathrm{H}^{*}V\otimes I_{1}$ such that: 1. 1. $\mathrm{H}^{\ast}_{V}X\cong Ker(\varphi)$. 2. 2. $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{\ast}_{V}X\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{*}V\otimes I_{0}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\varphi}$$\textstyle{\mathrm{H}^{*}V\otimes I_{1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{....}$ is the beginning of a (minimal) injective resolution of $\mathrm{H}^{\ast}_{V}X$ (in the category $\mathrm{H}^{*}V-\mathcal{U}$). 3. 3. $\overline{\varphi}=\alpha:I_{0}\rightarrow I_{1}$. In particular, we have: ###### Corollary 5.2.2. Let $X$ be a CW-complex on which acts an elementary abelian group 2-group $V$. Suppose that: 1. 1. $\mathrm{H}^{\ast}X$ is a reduced $\mathcal{U}$-injective, 2. 2. $\mathrm{H}^{\ast}_{V}X$ is free as an $\mathrm{H}^{*}V$-module. Then $\mathrm{H}^{\ast}_{V}X\cong\mathrm{H}^{\ast}V\otimes H^{*}X$. ## 6 Description of $E$ when $\overline{E}$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$ In this section, we prove the following result. ###### Theorem 6.1. Let $E$ be unstable $\mathrm{H}^{\ast}V-A$-module which is free as an $\mathrm{H}^{\ast}V$-module. If $\overline{E}$ is isomorphic to $\sum^{n}\mathbb{F}_{2}$, then there exists an element $u$ in $\mathrm{H}^{\ast}V$ such that: 1. 1. $u=\displaystyle\prod_{i}\theta_{i}^{\alpha_{i}}$, where $\theta_{i}\in(\mathrm{H}^{1}V)\setminus\\{0\\}$ and $\alpha_{i}\in\mathbb{N}$ 2. 2. $E\cong\sum^{d}u\mathrm{H}^{\ast}V$ with $d+\displaystyle\sum_{i}\alpha_{i}=n$. ###### Proof. Let $N$ be an unstable $A$-module, we denote by $\mathrm{d}imN$ the total dimension of $N$ that is $\mathrm{d}im\;N=\sum_{i}\mathrm{d}im\;N^{i}$. We have the equality $\mathrm{d}im\;\overline{E}=1=\mathrm{d}im\;\mathrm{F}ix_{{}_{V}}E$ (see [LZ3]), so we deduce that $\mathrm{F}ix_{{}_{V}}E=\sum^{l}\mathbb{F}_{2}$, where $l\in\mathbb{N}$. Let $\eta_{{}_{V}}:\;E\rightarrow\mathrm{H}^{\ast}V\otimes\mathrm{F}ix_{{}_{V}}E$ be the adjoint of the identity of $\mathrm{F}ix_{{}_{V}}E$ (see [LZ2]). Since the map $\eta_{V}$ is an injection, then the module $E$ is a sub-$\mathrm{H}^{\ast}V-A$-module of $\sum^{l}\mathrm{H}^{\ast}V$. Let’s write $E=\sum^{l}E^{\prime}$, where $E^{\prime}$ is sub-$\mathrm{H}^{\ast}V-A$-module of $\mathrm{H}^{\ast}V$ . By a result of J-P. Serre (see [Se]), there exists $N$ such that: $\mathrm{c}_{V}^{N}\mathrm{H}^{\ast}V\subset E^{\prime}\subset\mathrm{H}^{\ast}V$. Since $E^{\prime}$ is free as an $\mathrm{H}^{\ast}V$-module and of dimension one, then there exists $u\in\mathrm{\widetilde{H}}^{\ast}V$ such that $E^{\prime}=u\mathrm{H}^{\ast}V$. The inclusion $\mathrm{c}_{V}^{N}\mathrm{H}^{\ast}V\subset u\mathrm{H}^{\ast}V$ proves that $u=\displaystyle\prod_{i}\theta_{i}^{\alpha_{i}}$, where $\theta_{i}\in(\mathrm{H}^{1}V)\setminus\\{0\\}$ and $\alpha_{i}\in\mathbb{N}$. ∎ ###### Remark 6.2. We remark that by the previous result, we can determinate $E$ when $\overline{E}$ is isomorphic to $\mathbb{F}_{2}\oplus\sum^{n}\mathbb{F}_{2}$. In this case, we verify that $E\cong\mathrm{H}^{\ast}V\oplus\sum^{d}u\mathrm{H}^{\ast}V$, where $u=\displaystyle\prod_{i}\theta_{i}^{\alpha_{i}}$, $\theta_{i}\in\mathrm{H}^{\ast}V\setminus\\{0\\}$, $\alpha_{i}\in\mathbb{N}$ and $d+\displaystyle\sum_{i}\alpha_{i}=n$. In fact, since the $\mathrm{H}^{\ast}V-\mathcal{U}$-injective module $\mathrm{H}^{\ast}V$ is a sub-$\mathrm{H}^{\ast}V$-module of $E$, then $E\cong\mathrm{H}^{\ast}V\oplus E^{\prime}$, where $E^{\prime}$ is an unstable $\mathrm{H}^{\ast}V-A$-module, free as an $\mathrm{H}^{\ast}V$-module and such that $\overline{E^{\prime}}\cong\sum^{n}\mathbb{F}_{2}$. The result holds from theorem 6.1. 6.3 Example We give an example showing how to realize topologically the cases of theorem 6.1 and remark 6.2. Let $\rho:V\rightarrow\mathrm{O}(d)$ be a group homomorphism. $\rho$ gives both an action of $V$ on $\mathrm{D}^{d}$, $\mathrm{S}^{d-1}$ and a $d$-dimensional orthogonal bundle whose mod.2 Euler class is denoted by $e(\rho)$. The long exact sequence of the pair ($\mathrm{D}^{d},\;\mathrm{S}^{d-1}$) and the Thom isomorphism give the long (Gysin) exact sequence (see for example [Hu]): $\textstyle{\cdots\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{*-1}V\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}_{V}^{*-1}\mathrm{S}^{d-1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\Sigma^{-d}\mathrm{H}^{*}V\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\scriptstyle{\smile e(\rho)}$$\textstyle{\mathrm{H}^{*}V\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{H}^{*}_{V}\mathrm{S}^{d-1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\cdots}$ The decomposition $\rho\cong\displaystyle\oplus_{i=1}^{d}\;\rho_{i}$ of the representation $\rho$ into orthogonal representations of dimension 1 gives $e(\rho)=\prod_{i}e(\rho_{i}).$ We have now two cases. \- If none of the representations $\rho_{i}$ is trivial then $e(\rho)$ is non zero and $\mathrm{H}^{\ast}_{V}(\mathrm{D}^{d},\mathrm{S}^{d-1})$ is isomorphic to $e(\rho)\mathrm{H}^{*}V$ as an $\mathrm{H}^{*}V-\mathrm{A}$-module. This illustrates theorem 6.1. \- Otherwise, let’s write $\rho=\sigma\oplus\tau$, $\sigma$ (resp. $\tau$) being the direct sum of the non trivial (resp. trivial) representations $\rho_{i}$. Then $\mathrm{H}^{*}_{V}\mathrm{S}^{d-1}\cong\mathrm{H}^{*}V\oplus\Sigma^{\mathrm{d}im\tau}\;e(\sigma)\mathrm{H}^{*}V$ and $\mathrm{H}^{\ast}_{V}(\mathrm{S}^{d-1})$ is an illustration of the remark 6.2. ## 7 Determination of $E$ when $V$ is $\mathbb{Z}/2\mathbb{Z}$ and $\overline{E}$ is $\mathrm{J}(2)$ In this section, we assume that $V$ is $\mathbb{Z}/2\mathbb{Z}$ and $\overline{E}$ is the Brown-Gitler module $\mathrm{J}(2)$. We denote by $\mathrm{H}=\mathbb{F}_{2}[t]$ the cohomology of $\mathbb{Z}/2\mathbb{Z}$, where $t$ is an element of $\mathrm{H}$ of degree one. We have the following result. ###### Proposition 7.1. Let $E$ be an $\mathrm{H}-A$-module which is $\mathrm{H}$-free and such that $\overline{E}$ is isomorphic to $\mathrm{J}(2)$ then: $E\cong\mathrm{H}\otimes\mathrm{J}(2)$ or $E$ is the sub-$\mathrm{H}-A$-module of $\mathrm{H}\oplus\sum\mathrm{H}$ generated by $(t,\Sigma 1)$ and $(t^{2},0)$. ###### Proof. This proof uses the Smith theory (see [DW], [LZ2] theorem 2.1) which gives us an exact sequence (*) in $\mathrm{H}-\mathcal{U}$: $(*)\;\;\;\;\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{E\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 50.72046pt\raise 11.1875pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 8.18748pt\hbox{$\scriptstyle{\eta}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathrm{H}\otimes\mathrm{F}ixE\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 90.41663pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 105.41663pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 105.41663pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{C\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 143.27911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 143.27911pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces$ where $C$ the quotient of $\mathrm{H}\otimes\mathrm{F}ixE$ is finite and also $\mathrm{F}ixE$ is finite. If the module $C$ is trivial then $E$ is isomorphic to $\mathrm{H}\otimes\mathrm{J}(2)$. When $C$ is a non trivial module. By applying the functor $\mathbb{F}_{2}\otimes_{\mathrm{H}}-$ to the exact sequence (*), we obtain: $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\sum\tau C\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\overline{E}=\mathrm{J}(2)\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\mathrm{F}ixE\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\overline{C}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{0}$ where $\tau C$ is the trivial part of $C$ (see [BHZ]). Let’s denote by $Q$ the quotient of $\overline{E}$ by $\sum\tau C$. By properties of the module $\mathrm{J}(2)$, we have that $\sum\tau C=\sum^{2}\mathbb{F}_{2}$ and $Q=\sum\mathbb{F}_{2}$. The exact sequence: $\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\sum\mathbb{F}_{2}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{FixE\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{\overline{C}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$$\textstyle{0}$ gives that $FixE\cong\sum\mathbb{F}_{2}\oplus\overline{C}$. One checks that the module $\overline{C}$ is either isomorphic to $\mathbb{F}_{2}$ or $\sum\mathbb{F}_{2}$. If $\overline{C}=\sum\mathbb{F}_{2}$ then $\mathrm{F}ixE\cong\sum\mathbb{F}_{2}\oplus\sum\mathbb{F}_{2}$ as an unstable $A$-module, which implies that the module $E$ is a suspension which is impossible because $\overline{E}=\mathrm{J}(2)$ is not a suspension. We conclude that $\overline{C}=\mathbb{F}_{2}$. Since $\tau C=\sum\mathbb{F}_{2}$ then we get $C$ is isomorphic to $\mathrm{H}^{\leq 1}$, where $\mathrm{H}^{\leq 1}$ denotes the sub-$\mathrm{H}-A$-module of $\mathrm{H}$ consisting of elements of degree less or equal than 1. We have the following exact sequence in $\mathrm{H}-\mathcal{U}$: $\lx@xy@svg{\hbox{\raise 0.0pt\hbox{\kern 5.5pt\hbox{\ignorespaces\ignorespaces\ignorespaces\hbox{\vtop{\kern 0.0pt\offinterlineskip\halign{\entry@#!@&&\entry@@#!@\cr&&&&\crcr}}}\ignorespaces{\hbox{\kern-5.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 29.5pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{E\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 52.45831pt\raise 9.0pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{$\scriptstyle{}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 67.45831pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathrm{H}\oplus\sum\mathrm{H}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces\ignorespaces\ignorespaces{\hbox{\kern 92.94647pt\raise 11.1875pt\hbox{{}\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\hbox{\hbox{\kern 0.0pt\raise 8.18748pt\hbox{$\scriptstyle{\varphi}$}}}\kern 3.0pt}}}}}}\ignorespaces{\hbox{\kern 110.23605pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 110.23605pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{\mathrm{H}^{\leq 1}\ignorespaces\ignorespaces\ignorespaces\ignorespaces}$}}}}}}}\ignorespaces\ignorespaces\ignorespaces\ignorespaces{}{\hbox{\lx@xy@droprule}}\ignorespaces{\hbox{\kern 147.73605pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 6.0pt\hbox{\lx@xy@tip{1}\lx@xy@tip{-1}}}}}}{\hbox{\lx@xy@droprule}}{\hbox{\lx@xy@droprule}}{\hbox{\kern 147.73605pt\raise 0.0pt\hbox{\hbox{\kern 0.0pt\raise 0.0pt\hbox{\hbox{\kern 3.0pt\raise 0.0pt\hbox{$\textstyle{0}$}}}}}}}\ignorespaces}}}}\ignorespaces.$ The module $E$, we are searching for, is the kernel of $\varphi$ and we check that it is the sub-$\mathrm{H}-\mathrm{A}$-module of $\mathrm{H}\oplus\sum\mathrm{H}$ generated by the elements $(t,\Sigma 1)$ and $(t^{2},0)$. ∎ ###### Remark 7.2. Let be $\mathbb{Z}/2\mathbb{Z}$ act on a real projective space $\mathbb{R}\mathrm{P}^{2}$; let $x_{0}$ be a fixed point of this action (the set of fixed point is not empty for example by an argument of Lefschetz number). We have: \- The Serre spectral sequence collapses to give that: $\mathrm{H}^{\ast}_{V}(\mathbb{R}\mathrm{P}^{2},x_{0})$ is $\mathrm{H}$-free and $\overline{\mathrm{H}^{\ast}_{V}(\mathbb{R}\mathrm{P}^{2},x_{0})}$ is isomorphic to $\mathrm{J}(2)$. \- In [DW], Dwyer and Wilkerson have shown that $\mathrm{H}^{\ast}_{V}\mathbb{R}\mathrm{P}^{2}=\mathbb{F}_{2}[t,y]/(f)$ where $y$ restricts to $x$ and $f=y^{i}(y+t)^{j}$ for $i+j=3$. It is easy to check that this computation agrees with theorem 7.1. ## References * [BHZ] D.Bourguiba, S.Hammouda, S.Zarati: Profondeur et cohomologie équivariante, African Diaspora Mathematics Research, Special Issue Vol 4 Number 3, 11-21. * [De] F.X.Dehon Cobordisme complexe des espaces profinis et foncteur $\mathrm{T}$ de Lannes, Mémoires de la Société Mathématique de France 98, SMF 2004. * [DL] F.X.Dehon, J.Lannes: Sur les espaces fonctionnels dont la source est le classifiant d’un groupe de Lie compact, commutatif I.H.E.S. 89 (1999) 127-177. * [DW] W.G.Dwyer, C.W.Wilkerson: Smith theory revisited, Annals of Mathematics, 127(1988) 191-198. * [EP] M.J.Errockh, C.Peterson: Injective resolutions of unstable modules, Journal of Pure and Applied Algebra 97(1994) 37-50. * [Hu] D.Husemoller: Fibre bundles, McGraw-Hill, series in higher mathematics, 1966. * [L1] J.Lannes: Sur les espaces fonctionnels dont la source est le classifiant d’un p-groupe abélien élémentaire, Publ. I.H.E.S. 75 (1992) 135-224. * [LS] J.Lannes, L.Shwartz: Sur la structure des $A$-modules instables injectifs, Topology 28 (1989) 153-169. * [LZ1] J.Lannes, S.Zarati: Sur les $\mathcal{U}$-injectifs, Ann. Scient. Ec. Norm. Sup. 19 (1986) 1-31. * [LZ2] J.Lannes, S.Zarati: Théorie de Smith algébrique et classification des $\mathrm{H}^{\ast}V-\mathcal{U}$-injectifs, Bull. Soc. Math. France 123 (1995) 189-223. * [LZ3] J.Lannes, S.Zarati: Tor et Ext-dimensions des $\mathrm{H}^{*}V-\mathrm{A}$-modules instables qui sont de type fini comme $\mathrm{H}^{*}V$-modules, Progress in Mathematics, Birkhäuser Verlag, vol 136 (1996) 241-253. * [NS] M.D.Neusel, L.Smith: Invariant theory of finite groups, volume 94 of Mathematical Surveys and Monographs. American Mathematical Society, Providence, RI, 2002. * [R] J.Rotman: An introduction to homological algebra, Academic Press, 1979. * [S] L.Schwartz: Unstable modules over the Steenrod algebra and Sullivan’s fixed point set conjecture, University of Chicago Press, 1984. * [Se] J-P.Serre: Sur la dimension cohomologique des groupes profinis, Topology 3. (1965), 413-420.
arxiv-papers
2009-04-18T10:19:11
2024-09-04T02:49:01.998662
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Dorra Bourguiba", "submitter": "Dorra Bourguiba", "url": "https://arxiv.org/abs/0904.2839" }
0904.2990
# Probing high-density behavior of symmetry energy from pion emission in heavy-ion collisions Zhao-Qing Fenga111Corresponding author. Tel. +86 931 4969215. _E-mail address:_ fengzhq@impcas.ac.cn, Gen-Ming Jinb a _Institute of Modern Physics, Chinese Academy of Sciences, Lanzhou 730000, People’s Republic of China_ Abstract Within the framework of the improved isospin dependent quantum molecular dynamics (ImIQMD) model, the emission of pion in heavy-ion collisions in the region 1 A GeV as a probe of nuclear symmetry energy at supra-saturation densities is investigated systematically, in which the pion is considered to be mainly produced by the decay of resonances $\triangle$(1232) and N*(1440). The total pion multiplicities and the $\pi^{-}/\pi^{+}$ yields are calculated for selected Skyrme parameters SkP, SLy6, Ska and SIII, and also for the cases of different stiffness of symmetry energy with the parameter SLy6. Preliminary results compared with the measured data by the FOPI collaboration favor a hard symmetry energy of the potential term proportional to $(\rho/\rho_{0})^{\gamma_{s}}$ with $\gamma_{s}=2$. _PACS_ : 25.75.-q, 13.75.Gx, 25.80.Ls _Keywords:_ ImIQMD model; pion emission; Skyrme parameters; symmetry energy Heavy-ion collisions induced by radioactive beam at intermediate energies play a significant role to extract the information of nuclear equation of state (EoS) of isospin asymmetric nuclear matter under extreme conditions. Besides nucleonic observables such as rapidity distribution and flow of free nucleons and light clusters (such as deuteron, triton and alpha etc.), also mesons emitted from the reaction zone can be probes of the hot and dense nuclear matter. The energy per nucleon in the isospin asymmetric nuclear matter is usually expressed as $E(\rho,\delta)=E(\rho,\delta=0)+E_{\textrm{sym}}(\rho)\delta^{2}+\textsc{O}(\delta^{2})$ in terms of baryon density $\rho=\rho_{n}+\rho_{p}$, relative neutron excess $\delta=(\rho_{n}-\rho_{p})/(\rho_{n}+\rho_{p})$, energy per nucleon in a symmetric nuclear matter $E(\rho,\delta=0)$ and bulk nuclear symmetry energy $E_{\textrm{sym}}=\frac{1}{2}\frac{\partial^{2}E(\rho,\delta)}{\partial\delta^{2}}\mid_{\delta=0}$. In general, two different forms have been predicted by some microscopical or phenomenological many-body approaches. One is the symmetry energy increases monotonically with density, and the other is the symmetry energy increases initially up to a supra-saturation density and then decreases at higher densities. Based on recent analysis of experimental data associated with transport models, a symmetry energy of the form $E_{\textrm{sym}}(\rho)\approx 31.6(\rho/\rho_{0})^{\gamma}$ MeV with $\gamma=0.69-1.05$ was extracted for densities between 0.1$\rho_{0}$ and 1.2$\rho_{0}$ [1, 2]. The symmetry energy at supra-saturation densities can be investigated by analyzing isospin sensitive observables in theoretically, such as the neutron/proton ratio of emitted nucleons, $\pi^{-}/\pi^{+}$, $\Sigma^{-}/\Sigma^{+}$ and $K^{0}/K^{+}$ [2]. Recently, a very soft symmetry energy at supra-saturation densities was pointed out by fitting the FOPI data [3] using IBUU04 model [4]. With the establishment of high-energy radioactive beam facilities in the world, such as the CSR (IMP in Lanzhou, China), FAIR (GSI in Darmstadt, Germany), RIKEN (Japan), SPIRAL2 (GANIL in Caen, France) and FRIB (MSU, USA) [2], the high- density behavior of the symmetry energy can be studied more detail experimentally in the near future. The emission of pion in heavy-ion collisions in the region 1 A GeV is especially sensitive as a probe of symmetry energy at supra-saturation densities. Further investigations of the pion emissions in the 1 A GeV region are still necessary by improving transport models or developing some new approaches. The ImIQMD model has been successfully applied to treat heavy-ion fusion reactions near Coulomb barrier [5, 6, 7]. Recently, Zhang _et al_ analyzed the neutron-proton spectral double ratios to extract the symmetry energy per nucleon at sub-saturation density with a similar model [8]. To investigate the pion emission, we further include the inelastic channels in nucleon-nucleon collisions. In the ImIQMD model, the time evolutions of the baryons and pions in the system under the self-consistently generated mean-field are governed by Hamilton’s equations of motion, which read as $\displaystyle\dot{\mathbf{p}}_{i}=-\frac{\partial H}{\partial\mathbf{r}_{i}},\quad\dot{\mathbf{r}}_{i}=\frac{\partial H}{\partial\mathbf{p}_{i}}.$ (1) Here we omit the shell correction part in the Hamiltonian $H$ as described in Ref. [6]. The Hamiltonian of baryons consists of the relativistic energy, the effective interaction potential and the momentum dependent part as follows: $H_{B}=\sum_{i}\sqrt{\textbf{p}_{i}^{2}+m_{i}^{2}}+U_{int}+U_{mom}.$ (2) Here the $\textbf{p}_{i}$ and $m_{i}$ represent the momentum and the mass of the baryons. The effective interaction potential is composed of the Coulomb interaction and the local interaction $U_{int}=U_{Coul}+U_{loc}.$ (3) The Coulomb interaction potential is written as $U_{Coul}=\frac{1}{2}\sum_{i,j,j\neq i}\frac{e_{i}e_{j}}{r_{ij}}erf(r_{ij}/\sqrt{4L})$ (4) where the $e_{j}$ is the charged number including protons and charged resonances. The $r_{ij}=|\mathbf{r}_{i}-\mathbf{r}_{j}|$ is the relative distance of two charged particles. The local interaction potential is derived directly from the Skyrme energy- density functional and expressed as $U_{loc}=\int V_{loc}(\rho(\mathbf{r}))d\mathbf{r}.$ (5) The local potential energy-density functional reads $\displaystyle V_{loc}(\rho)=\frac{\alpha}{2}\frac{\rho^{2}}{\rho_{0}}+\frac{\beta}{1+\gamma}\frac{\rho^{1+\gamma}}{\rho_{0}^{\gamma}}+\frac{g_{sur}}{2\rho_{0}}(\nabla\rho)^{2}+\frac{g_{sur}^{iso}}{2\rho_{0}}[\nabla(\rho_{n}-\rho_{p})]^{2}+$ $\displaystyle\left(a_{sym}\frac{\rho^{2}}{\rho_{0}}+b_{sym}\frac{\rho^{1+\gamma}}{\rho_{0}^{\gamma}}+c_{sym}\frac{\rho^{8/3}}{\rho_{0}^{5/3}}\right)\delta^{2}+g_{\tau}\rho^{8/3}/\rho_{0}^{5/3},$ (6) where the $\rho_{n}$, $\rho_{p}$ and $\rho=\rho_{n}+\rho_{p}$ are the neutron, proton and total densities, respectively, and the $\delta=(\rho_{n}-\rho_{p})/(\rho_{n}+\rho_{p})$ is the isospin asymmetry. The coefficients $\alpha$, $\beta$, $\gamma$, $g_{sur}$, $g_{sur}^{iso}$, $g_{\tau}$ are related to the Skyrme parameters $t_{0},t_{1},t_{2},t_{3}$ and $x_{0},x_{1},x_{2},x_{3}$ [6]. The parameters of the potential part in the symmetry energy term are also derived directly from Skyrme energy-density parameters as $\displaystyle a_{sym}=-\frac{1}{8}(2x_{0}+1)t_{0}\rho_{0},\quad b_{sym}=-\frac{1}{48}(2x_{3}+1)t_{3}\rho_{0}^{\gamma},$ $\displaystyle c_{sym}=-\frac{1}{24}\left(\frac{3}{2}\pi^{2}\right)^{2/3}\rho_{0}^{5/3}[3t_{1}x_{1}-t_{2}(5x_{2}+4)].$ (7) The momentum dependent term in the Hamiltonian is the same of the form in Ref. [9] and expressed as $U_{mom}=\frac{\delta}{2}\sum_{i,j,j\neq i}\frac{\rho_{ij}}{\rho_{0}}[\ln(\epsilon(\textbf{p}_{i}-\textbf{p}_{j})^{2}+1)]^{2},$ (8) with $\rho_{ij}=\frac{1}{(4\pi L)^{3/2}}\exp\left[-\frac{(\textbf{r}_{i}-\textbf{r}_{j})^{2}}{4L}\right],$ (9) which does not distinguish between protons and neutrons. Here the $L$ denotes the square of the pocket-wave width, which is dependent on the mass number of the nucleus. The parameters $\delta$ and $\epsilon$ were determined by fitting the real part of the proton-nucleus optical potential as a function of incident energy. In Table 1 we list the ImIQMD parameters related to several typical Skyrme forces after including the momentum dependent interaction. The parameters $\alpha$, $\beta$ and $\gamma$ are redetermined in order to reproduce the binding energy ($E_{B}$=-16 MeV) of symmetric nuclear matter at saturation density $\rho_{0}$ and to satisfy the relation $\frac{\partial E/A}{\partial\rho}\mid_{\rho=\rho_{0}}$=0 for a given incompressibility. Combined Eq.(7) with the kinetic energy part, the symmetry energy per nucleon in the ImIQMD model is given by $E_{sym}(\rho)=\frac{1}{3}\frac{\hbar^{2}}{2m}\left(\frac{3}{2}\pi^{2}\rho\right)^{2/3}+a_{sym}\frac{\rho}{\rho_{0}}+b_{sym}\left(\frac{\rho}{\rho_{0}}\right)^{\gamma}+c_{sym}\left(\frac{\rho}{\rho_{0}}\right)^{5/3}.$ (10) More clearly compared with other transport models, the symmetry energy can be expressed as $E_{sym}(\rho)=\frac{1}{3}\frac{\hbar^{2}}{2m}\left(\frac{3}{2}\pi^{2}\rho\right)^{2/3}+\frac{1}{2}C_{sym}\left(\frac{\rho}{\rho_{0}}\right)^{\gamma_{s}}.$ (11) The value $\gamma_{s}=1$ is used in IQMD model [10, 11]. In Fig. 1 we show a comparison of the energy per nucleon in symmetric nuclear matter with and without the momentum dependent potentials in the left panel and the nuclear symmetry energy in the right panel for different cases of Skyrme forces SkP, Sly6, Ska and SIII from Eq. (10), $\gamma_{s}$=0.5 (soft) and 2 (hard) with $C_{sym}$=32 MeV in Eq. (11), and also compared with the form $E_{sym}=31.6(\rho/\rho_{0})^{\mu}$ MeV ($\mu$=0.5 and $\mu$=2) [1]. Analogously to baryons, the Hamiltonian of pions is represented as $H_{\pi}=\sum_{i=1}^{N_{\pi}}\left(\sqrt{\textbf{p}_{i}^{2}+m_{\pi}^{2}}+V_{i}^{Coul}\right),$ (12) where the $\textbf{p}_{i}$ and $m_{\pi}$ represent the momentum and the mass of the pions. The Coulomb interaction is given by $V_{i}^{Coul}=\sum_{j=1}^{N_{B}}\frac{e_{i}e_{j}}{r_{ij}},$ (13) where the $N_{\pi}$ and $N_{B}$ is the total number of pions and baryons including charged resonances. Thus, the pion propagation in the whole stage is guided essentially by the Coulomb force. The in-medium pion potential in the mean field is not considered in the model. However, the inclusion of the pion optical potential based on the perturbation expansion of the $\Delta$-hole model gives negligible influence on the transverse momentum distribution [12]. The pion is created by the decay of the resonances $\triangle$(1232) and N*(1440) which are produced in inelastic NN scattering. The cross section of direct pion production is very small in the considered energies and not included in the model [13]. The reaction channels are given as follows: $\displaystyle NN\leftrightarrow N\triangle,$ $\displaystyle NN\leftrightarrow NN^{\ast},$ $\displaystyle NN\leftrightarrow\triangle\triangle,$ $\displaystyle\Delta\leftrightarrow N\pi,$ $\displaystyle N^{\ast}\leftrightarrow N\pi.$ (14) The cross sections of each channel to produce resonances are parameterized by fitting the data calculated with the one-boson exchange model [14]. In the 1 A GeV region, there are mostly $\Delta$ resonances which disintegrate into a $\pi$ and a nucleon, however, the $N^{\ast}$ yet gives considerable contribution to the high energetic pion yield. The energy and momentum dependent decay width is used in the calculation [15]. Pion meson in heavy-ion collisions is mainly produced at supra-saturation densities of compressed nuclear matter larger than the normal density $\rho_{0}$. The production of pions is influenced by the $\triangle$(1232) and the Fermi motion of baryons in the vicinity of the threshold energies. The $\pi^{-}$/$\pi^{+}$ ratio is a sensitive probe to extract the high-density behavior of the symmetry energy per energy. Shown in Fig. 2 is a comparison of the measured total pion multiplicity and $\pi^{-}$/$\pi^{+}$ yields by the FOPI collaboration in central 197Au+197Au collisions [3] and the results calculated by IQMD model [10] as well as by the ImIQMD model for Skyrme parameters SkP, SLy6, Ska and SIII, which correspond to different modulus of incompressibility as listed in table 1. The total multiplicity of pion is mainly determined by the cross sections of the channels $NN\leftrightarrow N\triangle$. The ImIQMD model with four Skyrme parameters predicts rather well the total yields at higher incident energies, but slightly overestimates the values near threshold energies, which may be influenced by the in-medium cross sections. In this work, we use the in-vacuum cross sections of nucleon-nucleon elastic and inelastic collisions. Reasonable consideration of the in-medium inelastic collisions in producing $\Delta$ and $N^{\ast}$ is still an open problem in transport models, which have been performed in Giessen-BUU model [16]. Using the isobar model, one gets the ratio $\pi^{-}$/$\pi^{+}$=1.95 for pions from the $\Delta$ resonance, and $\pi^{-}$/$\pi^{+}$=1.7 from the $N^{\ast}$ for the system 197Au+197Au [17]. These relations are globally valid, i.e. independent of the pion energy. On the other hand, the statistical model predicts that the $\pi^{-}$/$\pi^{+}$ ratio is sensitive to the difference in the chemical potentials of neutrons and protons by the relation $\pi^{-}/\pi^{+}\propto\exp[2(\mu_{n}-\mu_{p})/T]=\exp[8\delta E_{sym}(\rho)/T]$, where the $T$ is nuclear temperature [18]. The observed energy dependence of the $\pi^{-}$/$\pi^{+}$ ratio is due to the re-scattering and absorption process of pions and nucleons in the mean field of the compressed nuclear matter. We use the free absorption cross sections in collisions of pions and nucleons by fitting the experimental data. The branch ratio of the charged $\pi$ and $\pi^{0}$ is determined by the Clebsch-Gordan coefficients with the decay of the resonances $\triangle$(1232) and N*(1440). The $\pi^{-}/\pi^{+}$ ratio is sensitive to the stiffness of the symmetry energy at the lower incident energies. The ImIQMD model can predict the decrease trend of the $\pi^{-}/\pi^{+}$ ratio with incident energy. While the ImIQMD model with different Skyrme parameters gives the same excitation functions of the total pion multiplicity owing to the same cross sections in the production of pions and resonances for each case, the $\pi^{-}/\pi^{+}$ yields is different resulting from the symmetry energy. The compressed nuclear matter with central density about two times of the normal density is formed in heavy-ion collisions in the 1 A GeV region. To extract more information of symmetry energy in heavy-ion collisions from the pion production, in Fig. 3 we calculated the time evolution of average central density from low to high incident energies and the excitation functions of the $\pi^{-}$/$\pi^{+}$ ratios with the force SLy6, but different stiffness of the symmetry energy which corresponds to hard ($\gamma_{s}$=2), linear ($\gamma_{s}$=1), soft ($\gamma_{s}$=0.5) and supersoft (SIII)), and also compared with IQMD results [10] as well as the FOPI data [3]. The ImIQMD model gives larger values of $\pi^{-}$/$\pi^{+}$ than the ones calculated by IQMD, which mainly results from the cross section of the channel $N\pi\rightarrow\Delta$ and the larger coefficient $C_{sym}$. We considered the pion absorption process according to the Breit-Wigner formula with the cross section given in Ref. [13]. Our calculations show that a stiff symmetry energy is close to experimental data. The results does not support a very soft symmetry energy at high-density from analyzing the same experimental data reported in Ref. [4]. Situation is different in IBUU04 model, each nucleon in the evolution is enforced by the symmetry potential associated with isospin and momentum. Inversely, a transport model reported in Ref. [19] also predicted the larger ratios for stiffer symmetry energy from the analysis of the $\pi^{-}$/$\pi^{+}$ and $K^{0}/K^{+}$ yields. The influence of the symmetry energy on pion production in heavy-ion collisions is also studied from the distribution of transverse momentum of the total charged pions and the ratio $\pi^{-}$/$\pi^{+}$ for the cases of stiff and soft symmetry energies as shown in Fig. 4. The $\pi^{-}$ mesons are mostly produced from neutron-neutron collisions, and for a stiff symmetry energy, a wider high- density zone is formed in the calculation of the ImIQMD model. The larger $\pi^{-}$/$\pi^{+}$ ratio is also clear in the momentum distribution and the larger errors at the higher transverse momentum are resulted from the limited simulation events. The final $\pi^{-}$/$\pi^{+}$ ratio with different stiffness of the symmetry energy is shown in Fig. 5 as a function of N/Z of the systems in the reactions 40Ca+40Ca, 96Ru+96Ru, 96Zr+96Zr and 197Au+197Au, and also plotted the ratios of N/Z and (N/Z)2 as a function of N/Z at incident energy 0.4A GeV and 1.5A GeV, respectively. The FOPI data [3] and the results calculated by IQMD model [10] are also given for a comparison. Experimental data and calculations show that an increase trend of the $\pi^{-}$/$\pi^{+}$ ratio in realistic heavy ion collisions than that predicted by the isobar model is found at near threshold energy 0.4A GeV, especially for the larger N/Z systems. The ratio decreases with the incident energy and the value is located between the lines of (N/Z)2 and N/Z at incident energy 1.5A GeV. The phenomena can be explained from the fact that the symmetry energy enhances the N/Z ratio in the high-density region at lower incident energy. The decrease of the $\pi^{-}$/$\pi^{+}$ ratio with the incident energy is mainly owing to the production of pions from secondary nucleon-nucleon collisions, such as a neutron converts a proton by producing $\pi^{-}$. Subsequent collisions of the energetic proton can convert again to neutron by producing $\pi^{+}$. One can see that the stiff symmetry energy is also close to the experimental data. Recently, a moderately soft symmetry energy with $\gamma_{s}\simeq 0.9\pm 0.3$ was extracted from the analysis of neutron-proton elliptic flow of the FOPI/LAND data for the reaction 197Au+197Au using the UrQMD model [20]. Further experimental works associated transport models should be performed in more details to get reliable information of the high-density trend of the symmetry energy in heavy-ion collisions. In summary, the pion production in heavy-ion collisions in the region 1 A GeV is investigated systematically by using the ImIQMD model. The total multiplicity of produced pion and the $\pi^{-}/\pi^{+}$ ratio in central collisions are calculated for the selected Skyrme parameters SkP, SLy6, Ska, SIII which correspond to different modulus of incompressibility of symmetric nuclear matter and different cases of the stiffness of symmetry energy, and compared them with the experimental data by the FOPI collaborations as well as IQMD results. The $\pi^{-}/\pi^{+}$ excitation functions for the reaction 197Au+197Au and the dependence of the $\pi^{-}/\pi^{+}$ ratio on N/Z of reaction systems at energy 0.4A GeV are compared with the force SLy6, but different stiffness of the symmetry energy. Calculations show that a stiffer symmetry energy of the potential term with $\gamma_{s}=2$ is close to the experimental data. Acknowledgements This work was supported by the National Natural Science Foundation of China under Grant Nos. 10805061 and 10775061, the special foundation of the president fund, the west doctoral project of Chinese Academy of Sciences, and major state basic research development program under Grant No. 2007CB815000. ## References * [1] L.W. Chen, C.M. Ko, B.A. Li, Phys. Rev. Lett. 94 (2005) 032701; L.W. Chen, V. Greco, C.M. Ko, B.A. Li, Phys. Rev. Lett. 90 (2003) 162701. * [2] B.A. Li, L.W. Chen, C.M. Ko, Phys. Rep. 464 (2008) 113\. * [3] W. Reisdorf, M. Stockmeier, A. Andronic, et al. (FOPI collaboration), Nucl. Phys. A 781 (2007) 459\. * [4] Z.G. Xiao, B.A. Li, L.W. Chen, et al., Phys. Rev. Lett. 102 (2009) 062502. * [5] Z.Q. Feng, F.S. Zhang, G.M. Jin, X. Huang, Nucl. Phys. A 750 (2005) 232\. * [6] Z.Q. Feng, G.M. Jin, F.S. Zhang, Nucl. Phys. A 802 (2008) 91; Z.Q. Feng, G.M. Jin, Phys. Rev. C 80 (2009) 037601. * [7] N. Wang, Z.X. Li, X.Z Wu, et al., Phys. Rev. C 69 (2004) 034608. * [8] Y.X. Zhang, P. Danielewicz, M. Famiano, et al., Phys. Lett. B 664 (2008) 145. * [9] J. Aichelin, A. Rosenhauer, G. Peilert, et al., Phys. Rev. Lett. 58 (1987) 1926. * [10] Ch. Hartnack, R.K. Puri, J. Aichelin, et al., Eur. Phys. J. A 1 (1998) 151. * [11] L.W. Chen, F.S. Zhang, G.M. Jin, Phys. Rev. C 58 (1998) 2283. * [12] C. Fuchs, L. Sehn, E. Lehmann, et al., Phys. Rev. C 55 (1997) 411. * [13] B.A. Li, A.T. Sustich, B. Zhang, C.M. Ko, Int. J Mod. Phys. E 10 (2001) 1. * [14] S. Huber, J. Aichelin, Nucl. Phys. A 573 (1994) 587. * [15] Z.Q. Feng, G.M. Jin, Chin. Phys. Lett. 26 (2009) 062501. * [16] A.B. Larionov, W. Cassing, S. Leupold, U. Mosel, Nucl. Phys. A 696 (2001) 747; A.B. Larionov, U. Mosel, Nucl. Phys. A 728 (2003) 135\. * [17] R. Stock, Phys. Rep. 135 (1986) 259. * [18] G.F. Bertsch, Nature 283 (1980) 280; A. Bonasera, G.F. Bertsch, Phys. Lett. B 195 (1987) 521. * [19] G. Ferini, T. Gaitanos, M. Colonna, et al., Phys. Rev. Lett. 97 (2006) 202301. * [20] W. Trautmann, M. Chartier, Y. Leifels, el al., arXiv:0907.2822. Table 1: ImIQMD parameters and properties of symmetric nuclear matter for Skyrme effective interactions after the inclusion of the momentum dependent interaction with parameters $\delta$=1.57 MeV and $\epsilon$=500 c2/GeV2 Parameters SkM* Ska SIII SVI SkP RATP SLy6 $\alpha$ (MeV) -325.1 -179.3 -128.1 -123.0 -357.7 -250.3 -296.7 $\beta$ (MeV) 238.3 71.9 42.2 51.6 286.3 149.6 199.3 $\gamma$ 1.14 1.35 2.14 2.14 1.15 1.19 1.14 $g_{sur}$(MeV fm2) 21.8 26.5 18.3 14.1 19.5 25.6 22.9 $g_{sur}^{iso}$(MeV fm2) -5.5 -7.9 -4.9 -3.0 -11.3 0.0 -2.7 $g_{\tau}$ (MeV) 5.9 13.9 6.4 1.1 0.0 11.0 9.9 $C_{sym}$ (MeV) 30.1 33.0 28.2 27.0 30.9 29.3 32.0 $a_{sym}$ (MeV) 62.4 29.8 38.9 42.9 94.0 79.3 130.6 $b_{sym}$ (MeV) -38.3 -5.9 -18.4 -22.0 -63.5 -58.2 -123.7 $c_{sym}$ (MeV) -6.4 -3.0 -3.8 -5.5 -13.0 -4.1 12.8 $\rho_{\infty}$ (fm-3) 0.16 0.155 0.145 0.144 0.162 0.16 0.16 $m_{\infty}^{\ast}/m$ 0.639 0.51 0.62 0.73 0.77 0.56 0.57 $K_{\infty}$ (MeV) 215 262 353 366 200 239 230 Figure 1: The density dependence of the energy per nucleon in symmetric nuclear matter at temperature T=0 MeV with and without the momentum dependent potentials (left panel) and comparison of the density dependence of the nuclear symmetry energy for different Skyrme forces SkP, Sly6, Ska and SIII, and the symmetry energy $E_{sym}=31.6(\rho/\rho_{0})^{\gamma}$ MeV (the two cases $\gamma$=0.5 and $\gamma$=2) taken in Refs. [1, 2] (right panel). Figure 2: Comparison of calculated pion multiplicity and $\pi^{-}$/$\pi^{+}$ ratios in central 197Au+197Au collisions with different Skyrme parameters, and compared with IQMD results [10] as well as the FOPI data [3]. Figure 3: Evolution of average central density at different incident energies (left panel) and the excitation functions of the $\pi^{-}$/$\pi^{+}$ ratios at different stiffness of the symmetry energy (hard, linear, soft and supersoft), and compared with IQMD results [10] as well as the FOPI data [3] (right panel). Figure 4: Distributions of transverse momentum of final $\pi^{-}$ and $\pi^{+}$ and the ratio $\pi^{-}$/$\pi^{+}$ for the cases of stiff and soft symmetry energies in the reaction 197Au+197Au at incident energy $E_{lab}=$ 0.4A GeV. Figure 5: The $\pi^{-}$/$\pi^{+}$ yields as a function of the neutron over proton N/Z of reaction systems for head on collisions at incident energy $E_{lab}=$ 0.4A GeV and 1.5A GeV, respectively.
arxiv-papers
2009-04-20T09:41:03
2024-09-04T02:49:02.015655
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zhao-Qing Feng, Gen-Ming Jin", "submitter": "Zhaoqing Feng", "url": "https://arxiv.org/abs/0904.2990" }
0904.2994
# Influence of entrance channels on formation of superheavy nuclei in massive fusion reactions Zhao-Qing Fenga111Corresponding author. Tel. +86 931 4969215. _E-mail address:_ fengzhq@impcas.ac.cn, Jun-Qing Lia, Gen-Ming Jina a _Institute of Modern Physics, Chinese Academy of Sciences, Lanzhou 730000, China_ Abstract Within the framework of the dinuclear system (DNS) model, the production cross sections of superheavy nuclei Hs (Z=108) and Z=112 combined with different reaction systems are analyzed systematically. It is found that the mass asymmetries and the reaction Q values of the combinations play a very important role on the formation cross sections of the evaporation residues. Both methods by solving the master equations along the mass asymmetry degree of freedom (1D) and along the proton and the neutron degrees of freedom (2D) are compared each other and with the available experimental results. _PACS:_ 25.70.Jj, 24.10.-i, 25.60.Pj _Keywords:_ DNS model; production cross sections; mass asymmetries; reaction Q values The synthesis of heavy or superheavy nuclei (SHN) is a very important subject in nuclear physics motivated with respect to the island of stability which is predicted theoretically, and has obtained much experimental research with fusion-evaporation reactions [1, 2]. Combinations with a doubly magic nucleus or nearly magic nucleus are usually chosen owing to the larger reaction $Q$ values. Six new elements with Z=107-112 were synthesized in cold fusion reactions for the first time and investigated at GSI (Darmstadt, Germany) with the heavy-ion accelerator UNILAC and the SHIP separator [1, 3]. Recently, experiments on the synthesis of element 113 in the 70Zn+209Bi reaction have been performed successfully at RIKEN (Tokyo, Japan) [4]. However, it is difficulty to produce heavier SHN in the cold fusion reactions because of the smaller production cross sections that are lower than 1 pb for $Z>113$. The superheavy elements Z=113-116, 118 were synthesized at FLNR in Dubna (Russia) with the double magic nucleus 48Ca bombarding actinide nuclei [5, 6, 7]. New heavy isotopes 259Db and 265Bh have also been synthesized at HIRFL in Lanzhou (China) [8]. Further experimental works are necessary in order to testify the new synthesized SHN. A better understanding of the formation of SHN in the massive fusion reactions is still a challenge for theory. In this letter, we focus on the influence of the entrance mass asymmetry and the reaction Q value of projectile-target combinations on the production cross sections of superheavy residues. In the DNS model, the evaporation residue cross section is expressed as a sum over partial waves with angular momentum $J$ at the centre-of-mass energy $E_{c.m.}$ [9, 10, 11], $\sigma_{ER}(E_{c.m.})=\frac{\pi\hbar^{2}}{2\mu E_{c.m.}}\sum_{J=0}^{J_{max}}(2J+1)T(E_{c.m.},J)P_{CN}(E_{c.m.},J)W_{sur}(E_{c.m.},J).$ (1) Here, $T(E_{c.m.},J)$ is the transmission probability of the two colliding nuclei overcoming the Coulomb potential barrier in the entrance channel to form the DNS. The $P_{CN}$ is the probability that the system will evolve from a touching configuration into the compound nucleus in competition with quasi- fission of the DNS and fission of the heavy fragment. The last term is the survival probability of the formed compound nucleus, which can be estimated with the statistical evaporation model by considering the competition between neutron evaporation and fission [9]. We take the maximal angular momentum as $J_{max}=30$ since the fission barrier of the heavy nucleus disappears at high spin [12]. In order to describe the fusion dynamics as a diffusion process along proton and neutron degrees of freedom, the fusion probability is obtained by solving a set of master equations numerically in the potential energy surface of the DNS. The time evolution of the distribution probability function $P(Z_{1},N_{1},E_{1},t)$ for fragment 1 with proton number $Z_{1}$ and neutron number $N_{1}$ with excitation energy $E_{1}$ is described by the following master equations [13], $\displaystyle\frac{dP(Z_{1},N_{1},E_{1},t)}{dt}=\sum_{Z_{1}^{\prime}}W_{Z_{1},N_{1};Z_{1}^{\prime},N_{1}}(t)\left[d_{Z_{1},N_{1}}P(Z_{1}^{\prime},N_{1},E_{1}^{\prime},t)-d_{Z_{1}^{\prime},N_{1}}P(Z_{1},N_{1},E_{1},t)\right]+$ $\displaystyle\sum_{N_{1}^{\prime}}W_{Z_{1},N_{1};Z_{1},N_{1}^{\prime}}(t)\left[d_{Z_{1},N_{1}}P(Z_{1},N_{1}^{\prime},E_{1}^{\prime},t)-d_{Z_{1},N_{1}^{\prime}}P(Z_{1},N_{1},E_{1},t)\right]-$ $\displaystyle\left[\Lambda^{qf}(\Theta(t))+\Lambda^{fis}(\Theta(t))\right]P(Z_{1},N_{1},E_{1},t).$ (2) Here $W_{Z_{1},N_{1};Z_{1}^{\prime},N_{1}}$ ($W_{Z_{1},N_{1};Z_{1},N_{1}^{\prime}}$) is the mean transition probability from the channel $(Z_{1},N_{1},E_{1})$ to $(Z_{1}^{\prime},N_{1},E_{1}^{\prime})$ (or $(Z_{1},N_{1},E_{1})$ to $(Z_{1},N_{1}^{\prime},E_{1}^{\prime})$) , and $d_{Z_{1},N_{1}}$ denotes the microscopic dimension corresponding to the macroscopic state $(Z_{1},N_{1},E_{1})$. The sum is taken over all possible proton and neutron numbers that fragment $Z_{1}^{\prime},N_{1}^{\prime}$ may take, but only one nucleon transfer is considered in the model with $Z_{1}^{\prime}=Z_{1}\pm 1$ and $N_{1}^{\prime}=N_{1}\pm 1$. The excitation energy $E_{1}$ is determined by the dissipation energy from the relative motion and the potential energy surface of the DNS. The motion of nucleons in the interacting potential is governed by the single-particle Hamiltonian [9, 10]. The evolution of the DNS along the variable R leads to the quasi-fission of the DNS. The quasi-fission rate $\Lambda^{qf}$ and the fission rate $\Lambda^{fis}$ can be estimated with the one-dimensional Kramers formula [10, 11]. In the relaxation process of the relative motion, the DNS will be excited by the dissipation of the relative kinetic energy. The local excitation energy is determined by the excitation energy of the composite system and the potential energy surface of the DNS. The potential energy surface (PES) of the DNS is given by $\displaystyle U(Z_{1},N_{1},Z_{2},N_{2};J,\textbf{R};\beta_{1},\beta_{2},\theta_{1},\theta_{2})=B(Z_{1},N_{1})+B(Z_{2},N_{2})-\left[B(Z,N)+V^{CN}_{rot}(J)\right]+$ $\displaystyle V(Z_{1},N_{1},Z_{2},N_{2};J,\textbf{R};\beta_{1},\beta_{2},\theta_{1},\theta_{2})$ (3) with $Z_{1}+Z_{2}=Z$ and $N_{1}+N_{2}=N$. Here $B(Z_{i},N_{i})(i=1,2)$ and $B(Z,N)$ are the negative binding energies of the fragment $(Z_{i},N_{i})$ and the compound nucleus $(Z,N)$, respectively, in which the shell and the pairing corrections are included reasonably. The $V^{CN}_{rot}$ is the rotation energy of the compound nucleus. The $\beta_{i}$ represent the quadrupole deformations of the two fragments. The $\theta_{i}$ denote the angles between the collision orientations and the symmetry axes of deformed nuclei. The interaction potential between fragment $(Z_{1},N_{1})$ and $(Z_{2},N_{2})$ includes the nuclear, Coulomb and centrifugal parts, the details are given in Ref. [10]. In the calculation, the distance R between the centers of the two fragments is chosen to be the value which gives the minimum of the interaction potential, in which the DNS is considered to be formed. So the PES depends on the proton and neutron numbers of the fragment. In Fig.1 we give the potential energy surface in the reaction 30Si+252Cf as functions of the protons and neutrons of the fragments in the left panel. The incident point is shown by the solid circle and the minimum way in the PES is added by the thick line. The driving potential as a function of the mass asymmetry that was calculated in Ref. [9, 10] is also given in the right panel and compared with the minimum way in the left panel. The driving potential at the incident point in 1D PES is located at the maximum value, so there is no the inner fusion barrier for the system, which results in a too large fusion probability. Therefore, we solve the master equations within the 2D PES to get the fusion probability for the systems with larger mass asymmetries. The formation probability of the compound nucleus at the Coulomb barrier $B$ (here a barrier distribution $f(B)$ is considered) and for angular momentum $J$ is given by[9, 10] $P_{CN}(E_{c.m.},J,B)=\sum_{Z_{1}=1}^{Z_{BG}}\sum_{N_{1}=1}^{N_{BG}}P(Z_{1},N_{1},E_{1},\tau_{int}(E_{c.m.},J,B)).$ (4) We obtain the fusion probability as $P_{CN}(E_{c.m.},J)=\int f(B)P_{CN}(E_{c.m.},J,B)dB,$ (5) where the barrier distribution function is taken in asymmetric Gaussian form. The survival probability of the excited compound nucleus cooled by the neutron evaporation in competition with fission is expressed as follows: $W_{sur}(E_{CN}^{\ast},x,J)=P(E_{CN}^{\ast},x,J)\prod\limits_{i=1}^{x}\left(\frac{\Gamma_{n}(E_{i}^{\ast},J)}{\Gamma_{n}(E_{i}^{\ast},J)+\Gamma_{f}(E_{i}^{\ast},J)}\right)_{i},$ (6) where the $E_{CN}^{\ast},J$ are the excitation energy and the spin of the compound nucleus, respectively. The $E_{i}^{\ast}$ is the excitation energy before evaporating the $i$th neutron, which has the relation $E_{i+1}^{\ast}=E_{i}^{\ast}-B_{i}^{n}-2T_{i},$ (7) with the initial condition $E_{1}^{\ast}=E_{CN}^{\ast}$. The energy $B_{i}^{n}$ is the separation energy of the $i$th neutron. The nuclear temperature $T_{i}$ is given as $E_{i}^{\ast}=aT_{i}^{2}-T_{i}$ with the level density parameter $a$. $P(E_{CN}^{\ast},x,J)$ is the realization probability of emitting $x$ neutrons. The widths of neutron evaporation and fission are calculated using the statistical model. The details can be found in Refs. [9, 11]. With this procedure introduced above, we calculated the evaporation residue excitation functions using the 1D and 2D master equations in the reaction 48Ca+238U as shown in Fig.2 represented by dashed and solid lines, respectively, and compared them with the experimental data performed in Dubna [14] and at GSI [15]. The GSI results show that the formation cross sections in the 3n channel at the same excitation energy with 35 MeV have a slight decrease, which are in a good agreement with our 1D calculations. In the whole range, the 2D calculations give smaller cross sections than 1D master equations owing to the decrease of the fusion probability. For the considered system, the value of the PES at the incident point is located at the line of the minimum way. So the 1D master equations can give reasonable results. However, for the systems with larger mass asymmetries and larger quadrupole deformation parameters, e.g. 16O+238U, 22Ne+244Pu, etc, the 1D master equations give too large fusion probabilities. The synthesis of heavy or superheavy nuclei through fusing two stable nuclei is inhibited by the so-called quasi-fission process. The entrance channel combinations of projectile and target will influence the fusion dynamics. The suppression of the evaporation residue cross sections for less fissile compound systems such as 216Ra and 220Th when reactions are involved in projectiles heavier than 12C and 16O was observed in Refs. [16]. The wider width of the mass distributions for the fission-like fragments was also reported in Ref. [17]. In Fig.3 we calculated the transmission and fusion probabilities using the 2D master equations for the reactions 34S+238U, 64Fe+208Pb and 136Xe+136Xe which lead to the same compound nucleus 272Hs formation. The larger transmission probabilities were found in the reactions 64Fe+208Pb and 136Xe+136Xe owing to the larger Q values (absolute values). Smaller mass asymmetries of the two systems result in a decrease of the fusion probabilities. The evaporation residue excitation functions in 1n-5n channels are shown in Fig.4. The competition of the capture and the fusion process of the three systems leads to different trends of the evaporation channels. The 3n and 4n channels in the reaction 34S+238U, 1n and 2n channels in the reaction 64Fe+208Pb are favorable to produce the isotopes 269,268Hs and 271,270Hs. Although the system 136Xe+136Xe consists of two magic nuclei, the higher inner fusion barrier decreases the fusion probabilities and enhances the quasi-fission rate of the DNS, hence leads to the smaller cross sections of the Hs isotopes. The upper limit cross sections for evaporation residues $\sigma_{(1-3)n}\leq$4 pb were observed in a recent experiment [18], which are much lower than the ones predicted by the fusion by diffusion model [19]. In the DNS model, the larger mass asymmetry favors the nucleon transfer from the light projectile to heavy target, and therefore enhances the fusion probability of two colliding nuclei. The superheavy element Z=112 was synthesized at GSI with the new isotope 277112 in cold fusion reaction 70Zn+208Pb [20] and also fabricated with more neutron-rich isotopes 282,283112 in 48Ca induced reaction 48Ca+238U. We analyzed the combinations 30Si+252Cf, 36S+250Cm, 40Ar+244Pu and 48Ca+238U which lead to the production of new isotopes of the element Z=112 between the cold fusion reactions and the 48Ca induced reactions as shown in Fig.5. The 2n, 3n and 4n channels in the reaction 30Si+252Cf, and the 4n channel in the reaction 36S+250Cm have larger cross section to produce new isotopes due to the larger fusion probabilities of the two colliding nuclei. In summary, we systematically analyzed the entrance channel effects of synthesizing SHN using the DNS model. The systems with larger entrance mass asymmetry and larger reaction Q value can enhance the capture and fusion probabilities of two colliding nuclei. Calculations were carried out for the reactions 34S+238U, 64Fe+208Pb and 136Xe+136Xe which lead to the same compound nucleus formation. The 2n, 3n and 4n channels in the reaction 30Si+252Cf, and the 4n channel in the reaction 36S+250Cm are favorable to synthesize new isotopes of the element Z=112 at the stated excitation energies. Acknowledgements We would like to thank Prof. Werner Scheid for carefully reading the manuscript. This work was supported by the National Natural Science Foundation of China under Grant No. 10805061, the special foundation of the president fellowship, the west doctoral project of Chinese Academy of Sciences, and major state basic research development program under Grant No. 2007CB815000. ## References * [1] S. Hofmann, G. Münzenberg, Rev. Mod. Phys. 72 (2000) 733; S. Hofmann, Rep. Prog. Phys. 61 (1998) 639. * [2] Yu.Ts. Oganessian, J. Phys. G 34 (2007) R165; Nucl. Phys. A 787 (2007) 343c. * [3] G. Münzenberg, J. Phys. G 25 (1999) 717. * [4] K. Morita, K. Morimoto, D. Kaji, et al., J. Phys. Soc. Jpn. 73 (2004) 2593. * [5] Yu.Ts. Oganessian, A.G. Demin, A.S. Iljnov, et al., Nature 400 (1999) 242; Yu.Ts. Oganessian, V.K. Utyonkov, Yu.V. Lobanov, et al., Phys. Rev. C 62 (2000) 041604(R). * [6] Yu.Ts. Oganessian, V.K. Utyonkov, Yu.V. Lobanov, et al., Phys. Rev. C 69 (2004) 021601(R). * [7] Yu.Ts. Oganessian, V.K. Utyonkov, Yu.V. Lobanov, et al., Phys. Rev. C 74 (2006) 044602. * [8] Z.G. Gan, Z. Qin, H.M. Fan, et al., Eur. Phys. J. A 10 (2001) 21; Z.G. Gan, J.S. Guo, X.L. Wu, et al., Eur. Phys. J. A 20 (2004) 385. * [9] Z.Q. Feng, G.M. Jin, F. Fu, J.Q. Li, Nucl. Phys. A 771 (2006) 50. * [10] Z.Q. Feng, G.M. Jin, J.Q. Li, W. Scheid, Phys. Rev. C 76 (2007) 044606. * [11] Z.Q. Feng, G.M. Jin, J.Q. Li, W. Scheid, Nucl. Phys. A 816 (2009) 33. * [12] P. Reiter, T.L. Khoo, T. Lauritsen, et al., Phys. Rev. Lett. 84 (2000) 3542. * [13] M.H. Huang, Z.G. Gan, Z.Q. Feng, et al., Chin. Phys. Lett. 25 (2008) 1243. * [14] Yu.Ts. Oganessian, V.K. Utyonkov, Yu.V. Lobanov, et al., Phys. Rev. C 70 (2004) 064609. * [15] S. Hofmann, D. Ackermann, S. Antalic, et al., Eur. Phys. J. A 32 (2007) 251. * [16] A.C. Berriman, D.J. Hinde, M. Dasgupta, et al., Nature 413 (2001) 144; D.J. Hinde, M. Dasgupta, A. Mukherjee, Phys. Rev. Lett. 89 (2002) 282701. * [17] R.G. Thomas, D.J. Hinde, D. Duniec, et al., Phys. Rev. C 77 (2008) 034610. * [18] Yu.Ts. Oganessian, S.N. Dmitriev, A.V. Yeremin, et al., Phys. Rev. C 79 (2009) 024608. * [19] W.J. Swiatecki, K. Siwek-Wilczynska, J. Wilczynski, Int. J. Mod. Phys. E 13 (2004) 261. * [20] S. Hofmann, V. Ninov, F.P. Heßberger, et al., Z. Phys. A 350 (1995) 277. Figure 1: The potential energy surface of the DNS in the reaction 30Si+252Cf as functions of the protons and neutrons of the fragments (left panel) and the mass asymmetry coordinate (right panel). Figure 2: Comparison of the calculated evaporation residue excitation functions using the 1D and 2D master equations with the available experimental data in the reaction 48Ca+238U. Figure 3: Calculated transmission and fusion probabilities as functions of the excitation energies of the compound nucleus for the reactions 34S+238U, 64Fe+208Pb and 136Xe+136Xe. Figure 4: Comparison of the calculated evaporation residue cross sections in 1n-5n channels using the 2D master equations for the reactions 34S+238U, 64Fe+208Pb and 136Xe+136Xe. Figure 5: The same as in Fig.4, but for the reactions 30Si+252Cf, 36S+250Cm, 40Ar+244Pu and 48Ca+238U leading to the formation of the element Z=112.
arxiv-papers
2009-04-20T09:58:42
2024-09-04T02:49:02.021746
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zhao-Qing Feng, Jun-Qing Li, Gen-Ming Jin", "submitter": "Zhaoqing Feng", "url": "https://arxiv.org/abs/0904.2994" }
0904.2996
# Pion Production in Heavy-ion Collisions in the 1 A GeV region 111Supported by the National Natural Science Foundation of China under Grant No. 10805061, the special foundation of the president fellowship, the west doctoral project of Chinese Academy of Sciences, and major state basic research development program 2007CB815000. FENG Zhao-Qing1,2222Tel: 0931-4969215, 13893620698; Email: fengzhq@impcas.ac.cn, JIN Gen-Ming1,2 ###### Abstract Within the framework of the improved isospin dependent quantum molecular dynamics (ImIQMD) model, the pion emission in heavy-ion collisions in the region 1 A GeV is investigated systematically, in which the pion is considered to be mainly produced by the decay of resonances $\triangle$(1232) and N*(1440). The in-medium dependence and Coulomb effects of the pion production are included in the calculation. Total pion multiplicity and $\pi^{-}/\pi^{+}$ yields are calculated for the reaction 197Au+197Au in central collisions for selected Skyrme parameters SkP, SLy6, Ska, SIII and compared them with the measured data by the FOPI collaboration. 1 _Institute of Modern Physics, Chinese Academy of Sciences, Lanzhou 730000, China_ 2 _Center of Theoretical Nuclear Physics, National Laboratory of Heavy Ion Accelerator of Lanzhou, Lanzhou 730000, China_ _PACS_ : 25.75.-q, 13.75.Gx, 25.80.Ls Heavy-ion collisions at intermediate energies play a significant role to extract the information of the nuclear equation of state (EoS) under extreme conditions, i.e., at high densities and high temperature. Besides nucleonic observables such as rapidity distribution and flow, also mesons emitted from the reaction zone can be probes of the hot and dense nuclear matter, that are also the interest physics at the Cooling Storage Ring (CSR) energies in Lanzhou.${}^{\cite[cite]{[\@@bibref{}{Zh08}{}{}]}}$ The emission of pion in heavy-ion collisions in the region 1 A GeV is especially sensitive as probes of isospin asymmetric EoS at supra-saturation densities.${}^{\cite[cite]{[\@@bibref{}{Li08}{}{}]}}$ Spectra of the pion emission in heavy-ion collisions have been measured by the Kaos and FOPI collaborations and analyzed systematically by the present theoretical transport models.${}^{\cite[cite]{[\@@bibref{}{Re07,Mu95}{}{}]}}$ A comparison of the various transport approaches was made in Ref. [5]. The present theoretical models overpredict the total pion multiplicity if using free nucleon-nucleon (NN) cross sections below 2 A GeV region compared with experimental data. Further investigations of the pion emissions in the 1 A GeV region are still necessary by improving transport models or developing some new approaches. The improved isospin-dependent quantum molecular dynamics model has been successfully applied to treat fusion dynamics and reaction mechanism of two colliding nuclei near Coulomb barrier.${}^{\cite[cite]{[\@@bibref{}{Fe05,Fe08,Wa04}{}{}]}}$ To investigate the pion emission, we further include the inelastic channels in nucleon- nucleon collisions in the ImIQMD model. In the ImIQMD model, the time evolutions of the baryons and pions in the system under the self-consistently generated mean-field are governed by Hamilton’s equations of motion, which read as $\displaystyle\dot{\mathbf{p}}_{i}=-\frac{\partial H}{\partial\mathbf{r}_{i}},\quad\dot{\mathbf{r}}_{i}=\frac{\partial H}{\partial\mathbf{p}_{i}}.$ (1) Here we omit the shell correction part in the Hamiltonian $H$ as described in Ref. [7]. The Hamiltonian of baryons consists of the relativistic energy, the effective interaction potential and the momentum dependent part as follows: $H_{B}=\sum_{i}\sqrt{\textbf{p}_{i}^{2}+m_{i}^{2}}+U_{int}+U_{mom}.$ (2) Here the $\textbf{p}_{i}$ and $m_{i}$ represent the momentum and the mass of the baryons. The effective interaction potential is composed of the Coulomb interaction and the local interaction $U_{int}=U_{Coul}+U_{loc}.$ (3) The Coulomb interaction potential is written as $U_{Coul}=\frac{1}{2}\sum_{i,j,j\neq i}\frac{e_{i}e_{j}}{r_{ij}}erf(r_{ij}/\sqrt{4L})$ (4) where the $e_{j}$ is the charged number including protons and charged resonances. The $r_{ij}=|\mathbf{r}_{i}-\mathbf{r}_{j}|$ is the relative distance of two charged particles. The local interaction potential is derived directly from the Skyrme energy-density functional and expressed as $U_{loc}=\int V_{loc}(\rho(\mathbf{r}))d\mathbf{r}.$ (5) The local potential energy-density functional reads [7] $V_{loc}(\rho)=\frac{\alpha}{2}\frac{\rho^{2}}{\rho_{0}}+\frac{\beta}{1+\gamma}\frac{\rho^{1+\gamma}}{\rho_{0}^{\gamma}}+\frac{g_{sur}}{2\rho_{0}}(\nabla\rho)^{2}+\frac{g_{sur}^{iso}}{2\rho_{0}}[\nabla(\rho_{n}-\rho_{p})]^{2}+\frac{C_{sym}}{2\rho_{0}}\rho^{2}\delta^{2}+g_{\tau}\rho^{8/3}/\rho_{0}^{5/3},$ (6) where the $\rho$ is the baryon density and the $\delta=(\rho_{n}-\rho_{p})/(\rho_{n}+\rho_{p})$ is the isospin asymmetry with the proton density $\rho_{p}$ and the neutron density $\rho_{n}$. The momentum dependent part in the Hamiltonian is expressed as $U_{mom}=\frac{\delta}{2}\sum_{i,j,j\neq i}\frac{\rho_{ij}}{\rho_{0}}[\ln(\epsilon(\textbf{p}_{i}-\textbf{p}_{j})^{2}+1)]^{2},$ (7) with $\rho_{ij}=\frac{1}{(4\pi L)^{3/2}}\exp\left[-\frac{(\textbf{r}_{i}-\textbf{r}_{j})^{2}}{4L}\right].$ (8) Here the $L$ denotes the square of the pocket-wave width, which is dependent on the size of the nucleus. In Table 1 we list the ImIQMD parameters related to several typical Skyrme forces after including the momentum dependent interaction. The parameters $\alpha$, $\beta$, $\gamma$, $g_{\tau}$, $g_{sur}$, $g_{sur}^{iso}$, $\delta$ and $\epsilon$ are related to the Skyrme parameters $t_{0},t_{1},t_{2},t_{3}$ and $x_{0},x_{1},x_{2},x_{3}$, and determined in order to reproduce the binding energy ($E_{B}$=-16 MeV) of symmetric nuclear matter at saturation density for a given incompressibility as well as the correct momentum dependence of the real part of the proton-nucleus optical potential. In the following calculation we take the Skyrme parameter SLy6, which can give the good properties from finite nucleus to neutron star [9]. Analogously to baryons, the Hamiltonian of pions is represented as $H_{\pi}=\sum_{i=1}^{N_{\pi}}\left(\sqrt{\textbf{p}_{i}^{2}+m_{\pi}^{2}}+V_{i}^{Coul}\right),$ (9) where the $\textbf{p}_{i}$ and $m_{\pi}$ represent the momentum and the mass of the pions. The Coulomb interaction is given by $V_{i}^{Coul}=\sum_{j=1}^{N_{B}}\frac{e_{i}e_{j}}{r_{ij}},$ (10) where the $N_{\pi}$ and $N_{B}$ is the total number of pions and baryons including charged resonances. Thus, the pion propagation in the whole stage is guided essentially by the Coulomb effect. The in-medium pion potential in the mean field is not considered in the model. However, the inclusion of the pion optical potential based on the perturbation expansion of the $\Delta$-hole model gives negligible influence on the transverse momentum distribution.${}^{\cite[cite]{[\@@bibref{}{Fu97}{}{}]}}$ The pion is created by the decay of the resonances $\triangle$(1232) and N*(1440) which are produced in inelastic NN scattering. The direct pion production cross section is very small in the considered energies and not included in the model.${}^{\cite[cite]{[\@@bibref{}{Ba01}{}{}]}}$ The reaction channels are given as follows: $\displaystyle NN\leftrightarrow N\triangle,$ $\displaystyle NN\leftrightarrow NN^{\ast},$ $\displaystyle NN\leftrightarrow\triangle\triangle,$ $\displaystyle\Delta\leftrightarrow N\pi,$ $\displaystyle N^{\ast}\leftrightarrow N\pi.$ (11) The cross section of each channel to produce resonances are taken the values calculated with the one-boson exchange model.${}^{\cite[cite]{[\@@bibref{}{Hu94}{}{}]}}$ Transport models overpredicted the total pion production with the free cross section. In the ImIQMD model, we use the free elastic cross section and the in-medium inelastic cross section which is given by $\sigma^{inelastic}_{medium}=(\frac{\mu_{BB}^{\ast}}{\mu_{BB}})^{2}\sigma^{inelastic}_{free}$ with the free baryon-baryon (BB) inelastic cross section $\sigma^{inelastic}_{free}$ and the reduced effective mass $\mu_{BB}^{\ast}$ (free mass $\mu_{BB}$). The experimental data of total elastic and inelastic cross sections${}^{\cite[cite]{[\@@bibref{}{Ca93}{}{}]}}$ are parameterized in the ImIQMD model as shown in Fig.1. In the 1 A GeV region, there are mostly $\Delta$ resonances which disintegrate into a $\pi$ and a nucleon, however, the $N^{\ast}$ yet gives considerable contribution to the high energetic pion yield. The energy and momentum dependent decay width is used in the ImIQMD model and expressed as $\Gamma(|\textbf{p}|)=\frac{a_{1}|\textbf{p}|^{3}}{(1+a_{2}|\textbf{p}|^{2})(a_{3}+|\textbf{p}|^{2})}\Gamma_{0},$ (12) which originates from the p-wave resonances. The p is the momentum of the created pion (in GeV/c) in the resonance rest frame. The values $a_{1}=$22.48 (17.22), $a_{2}=$39.69 and $a_{3}=$0.04 (0.09) are used for the $\Delta$ ($N^{\ast}$) with bare decay width $\Gamma_{0}=$0.12 GeV (0.2 GeV).${}^{\cite[cite]{[\@@bibref{}{Hu94}{}{}]}}$ In Fig.2 we show a comparison of the time evolution of the $\pi$, $\Delta$ and $N^{\ast}$ production in the reaction 197Au+197Au for head on collisions at 1 A GeV for two cases of the bare decay and energy dependent decay widths. Both methods almost give the same yield of the pion production. In the following calculation, we use the energy and momentum dependent decay width. In Fig.3 we give the multiplicity of produced pion as a function of the impact parameter for the same system at 1 A GeV energy. The numbers of produced $\pi^{-}$, $\pi^{0}$and $\pi^{+}$ are reduced with increasing the impact parameter because of the decrease of the participants of the ’fire ball’ formed in the heavy-ion collisions. The emission of the produced pion is sensitive to the incident energy owing to the size of the compressed nuclear matter. We calculated the transverse momentum distribution of $\pi^{-}$, $\pi^{0}$and $\pi^{+}$ in central 197Au+197Au collisions at different incident energies as shown in Fig.4. The larger and wider distributions were found at the higher incident energies due to the larger participant numbers of the collision nucleons. The high energy pions originate from the early phase and the decay of the N*(1440) resonance also plays a significant role.${}^{\cite[cite]{[\@@bibref{}{Ma98}{}{}]}}$ In Fig.5 we compare the total pion number and the $\pi^{-}$/$\pi^{+}$ ratio with the FOPI data in central 197Au+197Au collisions${}^{\cite[cite]{[\@@bibref{}{Re07}{}{}]}}$ for the Skyrme parameters SkP, SLy6, Ska and SIII which correspond to the different incompressibility modulus as listed in table 1. The calculated value of the total pion number is related to the incompressibility modulus $K_{\infty}$ and the effective mass in nuclear medium. Over the whole domain, the force SLy6 is nice and can reproduce the experimental data. But the parameter slight overpredicts the total pion multiplicity at lower incident energies and underestimates the value at higher incident energies if using the above in- medium inelastic cross section. The in-medium elastic and inelastic cross sections are still open problems in transport model calculations, which should be calculated by microscopic many-body models and then parameterized to add into transport models. The $\pi^{-}$/$\pi^{+}$ ratio is interest for extracting the high density behavior of the symmetry energy per nucleon.${}^{\cite[cite]{[\@@bibref{}{Li08}{}{}]}}$ Using the isobar model, one gets the ratio $\pi^{-}$/$\pi^{+}$=1.95 for pions from the $\Delta$ resonance, and $\pi^{-}$/$\pi^{+}$=1.7 from the $N^{\ast}$ for the system 197Au+197Au.${}^{\cite[cite]{[\@@bibref{}{St86}{}{}]}}$ These relations are globally valid, i.e. independent of the pion energy. The observed energy dependence of the $\pi^{-}$/$\pi^{+}$ ratio is due to the influence of the Coulomb force and the symmetry energy interaction. The $\pi^{-}/\pi^{+}$ ratio is sensitive to the stiffness of the symmetry energy at the lower incident energies. Recently, a soft nuclear symmetry energy at supra-saturation densities was pointed out by fitting the FOPI data with the IBUU04 model.${}^{\cite[cite]{[\@@bibref{}{Xi09}{}{}]}}$ In the ImIQMD model, we only consider the linear dependence of the symmetry energy term on the baryon density as shown in Eq.(6). The inclusion of the density-dependent symmetry energy in the ImIQMD model is in progress. In summary, the pion production in heavy-ion collisions in the region 1 A GeV for the reaction 197Au+197 is investigated systematically by using the ImIQMD model. The distribution of the transverse momentum is calculated at different incident energies. The total number of produced pion and the $\pi^{-}/\pi^{+}$ ratio are calculated in central collisions for selected Skyrme parameters SkP, SLy6, Ska, SIII and compared them with the FOPI data. Deviations from the simple isobar model originate from the Coulomb and the symmetry interactions. The $\pi^{-}/\pi^{+}$ ratio is sensitive to the stiffness of the symmetry energy at the lower incident energies that may be further investigated at the CSR energies. We would like to thank Prof. Lie-Wen Chen, Prof. Wei Zuo and Dr. Gao-Chan Yong for fruitful discussions. ## References * [1] Zhan W L, Xia J W, Zhao H W et al (HIRFL-CSR Group) 2008 _Nucl. Phys. A_ 805 533c * [2] Li B A, Chen L W, Ko C M 2008 _Phys. Rep._ 464 113 * [3] Reisdorf W, Stockmeier M, Andronic A et al (FOPI collaboration) 2007 _Nucl. Phys. A_ 781 459 * [4] C. Müntz et al (KaoS collaboration) 1995 _Z. Phys. A_ 352 175 * [5] Kolomeitsev E E, Hartnack C, Barz H W et al 2005 _J. Phys. G_ 31 S741 * [6] Feng Z Q, Zhang F S, Jin G M, Huang X 2005 _Nucl. Phys. A_ 750 232 * [7] Feng Z Q, Jin G M, Zhang F S 2008 _Nucl. Phys. A_ 802 91 * [8] Wang N, Li Z X, Wu X Z et al 2004 _Phys. Rev. C_ 69 034608\. * [9] Chabanat E, Bonche P, Haensel P et al 1997 _Nucl. Phys. A_ 627 710 * [10] Fuchs C, Sehn L, Lehmann E et al 1997 _Phys. Rev. C_ 55 411\. * [11] Li B A, Sustich A T, Zhang B, Ko C M 2001 _Int. J Mod. Phys. E_ 10 1 * [12] Catherine L-L, François L 1993 _Rev. Mod. Phys._ 65 47 * [13] Huber S, Aichelin J 1994 _Nucl. Phys. A_ 573 587 * [14] Maheswari V S, Fuchs C, Faessler A et al 1998 _Nucl. Phys. A_ 628 669 * [15] Stock R 1986 _Phys. Rep._ 135 259 * [16] Xiao Z G, Li B A, Chen L W et al 2009 _Phys. Rev. Lett._ 102 062502 Table 1: ImIQMD parameters and properties of symmetric nuclear matter for Skyrme effective interactions after the inclusion of the momentum dependent interaction with parameters $\delta$=1.57 MeV and $\epsilon$=500 c2/GeV2 Parameters SkM* Ska SIII SVI SkP RATP SLy6 $\alpha$ (MeV) -325.1 -179.3 -128.1 -123.0 -357.7 -250.3 -296.7 $\beta$ (MeV) 238.3 71.9 42.2 51.6 286.3 149.6 199.3 $\gamma$ 1.14 1.35 2.14 2.14 1.15 1.19 1.14 $g_{sur}$(MeV fm2) 21.8 26.5 18.3 14.1 19.5 25.6 22.9 $g_{sur}^{iso}$(MeV $fm^{2}$) -5.5 -7.9 -4.9 -3.0 -11.3 0.0 -2.7 $g_{\tau}$ (MeV) 5.9 13.9 6.4 1.1 0.0 11.0 9.9 $C_{sym}$ (MeV) 30.1 33.0 28.2 27.0 30.9 29.3 32.0 $\rho_{\infty}$ (fm-3) 0.16 0.155 0.145 0.144 0.162 0.16 0.16 $m_{\infty}^{\ast}/m$ 0.639 0.51 0.62 0.73 0.77 0.56 0.57 $K_{\infty}$ (MeV) 215 262 353 366 200 239 230 Figure 1: Comparison of nucleon-nucleon cross sections parameterized in ImIQMD and the experimental data.${}^{\cite[cite]{[\@@bibref{}{Ca93}{}{}]}}$ Figure 2: Production of pion, delta and N* for head-on collisions in the reaction 197Au+197Au at 1 A GeV as functions of evolution time with the energy dependent decay width (left panel) and fixed width (right panel). Figure 3: Final multiplicities of $\pi^{-}$, $\pi^{0}$ and $\pi^{+}$ as a function of impact parameter for head-on collisions in the reaction 197Au+197Au at 1 A GeV. Figure 4: Final transverse momentum distribution in central 197Au+197Au collisions at different incident energies. Figure 5: Calculated excitation functions of the total pion multiplicity (left panel) and the ratio $\pi^{-}$/$\pi^{+}$ (right panel) in central 197Au+197Au collisions and compared with the FOPI data.${}^{\cite[cite]{[\@@bibref{}{Re07}{}{}]}}$
arxiv-papers
2009-04-20T10:10:25
2024-09-04T02:49:02.026331
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Zhao-Qing Feng, Gen-Ming Jin", "submitter": "Zhaoqing Feng", "url": "https://arxiv.org/abs/0904.2996" }
0904.3171
# Spectral theory for a mathematical model of the weak interaction: The decay of the intermediate vector bosons $\textbf{{W}}^{\pm}$. I. J.-M. Barbaroux Centre de Physique Théorique, Luminy Case 907, 13288 Marseille Cedex 9, France and Département de Mathématiques, Université du Sud Toulon-Var, 83957 La Garde Cedex, France barbarou@univ-tln.fr and J.-C. Guillot Centre de Mathématiques Appliquées, UMR 7641, École Polytechnique - C.N.R.S, 91128 Palaiseau Cedex, France Jean-Claude.Guillot@polytechnique.edu ###### Abstract. We consider a Hamiltonian with cutoffs describing the weak decay of spin $1$ massive bosons into the full family of leptons. The Hamiltonian is a self- adjoint operator in an appropriate Fock space with a unique ground state. We prove a Mourre estimate and a limiting absorption principle above the ground state energy and below the first threshold for a sufficiently small coupling constant. As a corollary, we prove absence of eigenvalues and absolute continuity of the energy spectrum in the same spectral interval. ## 1\. Introduction In this article, we consider a mathematical model of the weak interaction as patterned according to the Standard Model in Quantum Field Theory (see [18, 31]). We choose the example of the weak decay of the intermediate vector bosons $W^{\pm}$ into the full family of leptons. The mathematical framework involves fermionic Fock spaces for the leptons and bosonic Fock spaces for the vector bosons. The interaction is described in terms of annihilation and creation operators together with kernels which are square integrable with respect to momenta. The total Hamiltonian, which is the sum of the free energy of the particles and antiparticles and of the interaction, is a self-adjoint operator in the Fock space for the leptons and the vector bosons and it has an unique ground state in the Fock space for a sufficiently small coupling constant. The weak interaction is one of the four fundamental interactions known up to now. But the weak interaction is the only one which does not generate bound states. As it is well known it is not the case for the strong, electromagnetic and gravitational interactions. Thus we are expecting that the spectrum of the Hamiltonian associated with every model of weak decays is absolutely continuous above the energy of the ground state and this article is a first step towards a proof of such a statement. Moreover a scattering theory has to be established for every such Hamiltonian. In this paper we establish a Mourre estimate and a limiting absorption principle for any spectral interval above the energy of the ground state and below the mass of the electron for a small coupling constant. Our study of the spectral analysis of the total Hamiltonian is based on the conjugate operator method with a self-adjoint conjugate operator. The methods used in this article are taken largely from [4] and [13] and are based on [3] and [25]. Some of the results of this article has been announced in [8]. For other applications of the conjugate operator method see [1, 5, 6, 9, 10, 11, 12, 14, 15, 17, 21, 26]. For related results about models in Quantum Field Theory see [7] and [28] in the case of the Quantum Electrodynamics and [2] in the case of the weak interaction. The paper is organized as follows. In section 2, we give a precise definition of the model we consider. In section 3, we state our main results and in the following sections, together with the appendix, detailed proofs of the results are given. Acknowledgments. One of us (J.-C. G) wishes to thank Laurent Amour and Benoît Grébert for helpful discussions. The authors also thank Walter Aschbacher for valuable remarks. The work was done partially while J.M.-B. was visiting the Institute for Mathematical Sciences, National University of Singapore in 2008. The visit was supported by the Institute. ## 2\. The model The weak decay of the intermediate bosons $W^{+}$ and $W^{-}$ involves the full family of leptons together with the bosons themselves, according to the Standard Model (see [18, Formula (4.139)] and [31]). The full family of leptons involves the electron $e^{-}$ and the positron $e^{+}$, together with the associated neutrino $\nu_{e}$ and antineutrino $\bar{\nu}_{e}$, the muons $\mu^{-}$ and $\mu^{+}$ together with the associated neutrino $\nu_{\mu}$ and antineutrino $\bar{\nu}_{\mu}$ and the tau leptons $\tau^{-}$ and $\tau^{+}$ together with the associated neutrino $\nu_{\tau}$ and antineutrino $\bar{\nu}_{\tau}$. It follows from the Standard Model that neutrinos and antineutrinos are massless particles. Neutrinos are left-handed, i.e., neutrinos have helicity $-1/2$ and antineutrinos are right handed, i.e., antineutrinos have helicity $+1/2$. In what follows, the mathematical model for the weak decay of the vector bosons $W^{+}$ and $W^{-}$ that we propose is based on the Standard Model, but we adopt a slightly more general point of view because we suppose that neutrinos and antineutrinos are both massless particles with helicity $\pm 1/2$. We recover the physical situation as a particular case. We could also consider a model with massive neutrinos and antineutrinos built upon the Standard Model with neutrino mixing [27]. Let us sketch how we define a mathematical model for the weak decay of the vector bosons $W^{\pm}$ into the full family of leptons. The energy of the free leptons and bosons is a self-adjoint operator in the corresponding Fock space (see below) and the main problem is associated with the interaction between the bosons and the leptons. Let us consider only the interaction between the bosons and the electrons, the positrons and the corresponding neutrinos and antineutrinos. Other cases are strictly similar. In the Schrödinger representation the interaction is given by (see [18, p159, (4.139)] and [31, p308, (21.3.20)]) (2.1) $I=\int\mathrm{d}^{3}\\!x\,\overline{\Psi_{e}}(x)\gamma^{\alpha}(1-\gamma_{5})\Psi_{\nu_{e}}(x)W_{\alpha}(x)+\int\mathrm{d}^{3}\\!x\,\overline{\Psi_{\nu_{e}}}(x)\gamma^{\alpha}(1-\gamma_{5})\Psi_{e}(x)W_{\alpha}(x)^{*}\ ,$ where $\gamma^{\alpha}$, $\alpha=0,1,2,3$ and $\gamma_{5}$ are the Dirac matrices and $\Psi_{.}(x)$ and $\overline{\Psi_{.}}(x)$ are the Dirac fields for $e_{-}$, $e_{+}$, $\nu_{e}$ and $\bar{\nu}_{e}$. We have $\begin{split}&\Psi_{e}(x)=\big{(}\frac{1}{2\pi}\big{)}^{\frac{3}{2}}\sum_{s=\pm\frac{1}{2}}\int\mathrm{d}^{3}\\!p\,(b_{e,+}(p,s)\frac{u(p,s)}{\sqrt{p_{0}}}\mathrm{e}^{ip.x}+b_{e,-}^{*}(p,s)\frac{v(p,s)}{\sqrt{p_{0}}}\mathrm{e}^{-ip.x})\ ,\\\ &\overline{\Psi_{e}}(x)=\Psi_{e}(x)^{\dagger}\gamma^{0}\ .\end{split}$ Here $p_{0}=(|p|^{2}+m_{e}^{2})^{\frac{1}{2}}$ where $m_{e}>0$ is the mass of the electron and $u(p,s)$ and $v(p,s)$ are the normalized solutions to the Dirac equation (see [18, Appendix]). The operators $b_{e,+}(p,s)$ and $b_{e,+}^{*}(p,s)$ (respectively $b_{e,-}(p,s)$ and $b_{e,-}^{*}(p,s)$) are the annihilation and creation operators for the electrons (respectively the positrons) satisfying the anticommutation relations (see below). Similarly we define $\Psi_{\nu_{e}}(x)$ and $\overline{\Psi_{\nu_{e}}}(x)$ by substituting the operators $c_{\nu_{e},\pm}(p,s)$ and $c_{\nu_{e},\pm}^{*}(p,s)$ for $b_{e,\pm}(p,s)$ and $b_{e,\pm}^{*}(p,s)$ with $p_{0}=|p|$. The operators $c_{\nu_{e},+}(p,s)$ and $c_{\nu_{e},+}^{*}(p,s)$ (respectively $c_{\nu_{e},-}(p,s)$ and $c_{\nu_{e},-}^{*}(p,s)$) are the annihilation and creation operators for the neutrinos associated with the electrons (respectively the antineutrinos). For the $W_{\alpha}$ fields we have (see [30, §5.3]). $W_{\alpha}(x)=\big{(}\frac{1}{2\pi}\big{)}^{\frac{3}{2}}\sum_{\lambda=-1,0,1}\int\frac{\mathrm{d}^{3}\\!k}{\sqrt{2k_{0}}}(\epsilon_{\alpha}(k,\lambda)a_{+}(k,\lambda)\mathrm{e}^{ik.x}+\epsilon_{\alpha}^{*}(k,\lambda)a_{-}^{*}(k,\lambda)\mathrm{e}^{-ik.x})\ .$ Here $k_{0}=(|k|^{2}+m_{W}^{2})^{\frac{1}{2}}$ where $m_{W}>0$ is the mass of the bosons $W^{\pm}$. $W^{+}$ is the antiparticule of $W^{-}$. The operators $a_{+}(k,\lambda)$ and $a_{+}^{*}(k,\lambda)$ (respectively $a_{-}(k,\lambda)$ and $a_{-}^{*}(k,\lambda)$) are the annihilation and creation operators for the bosons $W^{-}$ (respectively $W^{+}$) satisfying the canonical commutation relations. The vectors $\epsilon_{\alpha}(k,\lambda)$ are the polarizations of the massive spin 1 bosons $W^{\pm}$ (see [30, Section 5.2]). The interaction (2.1) is a formal operator and, in order to get a well defined operator in the Fock space, one way is to adapt what Glimm and Jaffe have done in the case of the Yukawa Hamiltonian (see [16]). For that sake, we have to introduce a spatial cutoff $g(x)$ such that $g\in L^{1}({\mathbb{R}}^{3})$, together with momentum cutoffs $\chi(p)$ and $\rho(k)$ for the Dirac fields and the $W_{\mu}$ fields respectively. Thus when one develops the interaction $I$ with respect to products of creation and annihilation operators, one gets a finite sum of terms associated with kernels of the form $\chi(p_{1})\,\chi(p_{2})\,\rho(k)\,\hat{g}(p_{1}+p_{2}-k)\ ,$ where $\hat{g}$ is the Fourier transform of $g$. These kernels are square integrable. In what follows, we consider a model involving terms of the above form but with more general square integrable kernels. We follow the convention described in [30, section 4.1] that we quote: “The state-vector will be taken to be symmetric under interchange of any bosons with each other, or any bosons with any fermions, and antisymmetric with respect to interchange of any two fermions with each other, in all cases, wether the particles are of the same species or not”. Thus, as it follows from section 4.2 of [30], fermionic creation and annihilation operators of different species of leptons will always anticommute. Concerning our notations, from now on, $\ell\in\\{1,2,3\\}$ denotes each species of leptons. $\ell=1$ denotes the electron $e^{-}$ the positron $e^{+}$ and the neutrinos $\nu_{e}$, $\bar{\nu}_{e}$. $\ell=2$ denotes the muons $\mu^{-}$, $\mu^{+}$ and the neutrinos $\nu_{\mu}$ and $\bar{\nu}_{\mu}$, and $\ell=3$ denotes the tau-leptons and the neutrinos $\nu_{\tau}$ and $\bar{\nu}_{\tau}$. Let $\xi_{1}=(p_{1},\ s_{1})$ be the quantum variables of a massive lepton, where $p_{1}\in{\mathbb{R}}^{3}$ and $s_{1}\in\\{-1/2,\ 1/2\\}$ is the spin polarization of particles and antiparticles. Let $\xi_{2}=(p_{2},\ s_{2})$ be the quantum variables of a massless lepton where $p_{2}\in{\mathbb{R}}^{3}$ and $s_{2}\in\\{-1/2,\ 1/2\\}$ is the helicity of particles and antiparticles and, finally, let $\xi_{3}=(k,\ \lambda)$ be the quantum variables of the spin $1$ bosons $W^{+}$ and $W^{-}$ where $k\in{\mathbb{R}}^{3}$ and $\lambda\in\\{-1,\ 0,\ 1\\}$ is the polarization of the vector bosons (see [30, section 5]). We set $\Sigma_{1}={\mathbb{R}}^{3}\times\\{-1/2,\ 1/2\\}$ for the leptons and $\Sigma_{2}={\mathbb{R}}^{3}\times\\{-1,\ 0,\ 1\\}$ for the bosons. Thus $L^{2}(\Sigma_{1})$ is the Hilbert space of each lepton and $L^{2}(\Sigma_{2})$ is the Hilbert space of each boson. The scalar product in $L^{2}(\Sigma_{j})$, $j=1,2$ is defined by (2.2) $(f,\ g)=\int_{\Sigma_{j}}\overline{f(\xi)}g(\xi)\mathrm{d}\xi,\quad j=1,2\ .$ Here $\int_{\Sigma_{1}}\mathrm{d}\xi=\sum_{s=+\frac{1}{2},-\frac{1}{2}}\int\mathrm{d}p\quad\mbox{and}\quad\int_{\Sigma_{2}}\mathrm{d}\xi=\sum_{\lambda=0,1,-1}\int\mathrm{d}k,\quad(p,k\in{\mathbb{R}}^{3})\ .$ The Hilbert space for the weak decay of the vector bosons $W^{+}$ and $W^{-}$ is the Fock space for leptons and bosons that we now describe. Let ${\mathfrak{S}}$ be any separable Hilbert space. Let $\otimes_{a}^{n}{\mathfrak{S}}$ (resp. $\otimes_{s}^{n}{\mathfrak{S}}$) denote the antisymmetric (resp. symmetric) $n$-th tensor power of ${\mathfrak{S}}$. The fermionic (resp. bosonic) Fock space over ${\mathfrak{S}}$, denoted by ${\mathfrak{F}}_{a}({\mathfrak{S}})$ (resp. ${\mathfrak{F}}_{s}({\mathfrak{S}}))$, is the direct sum (2.3) ${\mathfrak{F}}_{a}({\mathfrak{S}})=\bigoplus_{n=0}^{\infty}\bigotimes_{a}^{n}{\mathfrak{S}}\quad(\mbox{resp. }{\mathfrak{F}}_{s}({\mathfrak{S}})=\bigoplus_{n=0}^{\infty}\bigotimes_{s}^{n}{\mathfrak{S}})\ ,$ where $\otimes_{a}^{0}{\mathfrak{S}}=\otimes_{s}^{0}{\mathfrak{S}}\equiv{\mathbb{C}}$. The state $\Omega=(1,0,0,\ldots,0,\ldots)$ denotes the vacuum state in ${\mathfrak{F}}_{a}({\mathfrak{S}})$ and in ${\mathfrak{F}}_{s}({\mathfrak{S}})$. For every $\ell$, ${\mathfrak{F}}_{\ell}$ is the fermionic Fock space for the corresponding species of leptons including the massive particle and antiparticle together with the associated neutrino and antineutrino, i.e., (2.4) ${\mathfrak{F}}_{\ell}=\bigotimes^{4}{\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}))\,\quad\ell=1,2,3\ .$ We have (2.5) ${\mathfrak{F}}_{\ell}=\bigoplus_{q_{\ell}\geq 0,\bar{q}_{\ell}\geq 0,r_{\ell}\geq 0,\bar{r}_{\ell}\geq 0}{\mathfrak{F}}_{\ell}^{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}\ ,$ with (2.6) ${\mathfrak{F}}_{\ell}^{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}=(\otimes_{a}^{q_{\ell}}L^{2}(\Sigma_{1}))\otimes(\otimes_{a}^{\bar{q}_{\ell}}L^{2}(\Sigma_{1}))\otimes(\otimes_{a}^{r_{\ell}}L^{2}(\Sigma_{1}))\otimes(\otimes_{a}^{\bar{r}_{\ell}}L^{2}(\Sigma_{1}))\ .$ Here $q_{\ell}$ (resp. $\bar{q}_{\ell}$) is the number of massive particle (resp. antiparticles) and $r_{\ell}$ (resp. $\bar{r}_{\ell}$) is the number of neutrinos (resp. antineutrinos). The vector $\Omega_{\ell}$ is the associated vacuum state. The fermionic Fock space denoted by ${\mathfrak{F}}_{L}$ for the leptons is then (2.7) ${\mathfrak{F}}_{L}=\otimes_{\ell=1}^{3}{\mathfrak{F}}_{\ell}\ ,$ and $\Omega_{L}=\otimes_{\ell=1}^{3}\Omega_{\ell}$ is the vacuum state. The bosonic Fock space for the vector bosons $W^{+}$ and $W^{-}$, denoted by ${\mathfrak{F}}_{W}$, is then (2.8) ${\mathfrak{F}}_{W}={\mathfrak{F}}_{s}(L^{2}(\Sigma_{2}))\otimes{\mathfrak{F}}_{s}(L^{2}(\Sigma_{2}))\simeq{\mathfrak{F}}_{s}(L^{2}(\Sigma_{2})\oplus L^{2}(\Sigma_{2}))\ .$ We have ${\mathfrak{F}}_{W}=\bigoplus_{t\geq 0,\bar{t}\geq 0}{\mathfrak{F}}_{W}^{(t,\bar{t})}\ ,$ where ${\mathfrak{F}}_{W}^{(t,\bar{t})}=(\otimes_{s}^{t}L^{2}(\Sigma_{2}))\otimes(\otimes_{s}^{\bar{t}}L^{2}(\Sigma_{2}))$. Here $t$ (resp. $\bar{t}$) is the number of bosons $W^{-}$ (resp. $W^{+}$). The vector $\Omega_{W}$ is the corresponding vacuum. The Fock space for the weak decay of the vector bosons $W^{+}$ and $W^{-}$, denoted by ${\mathfrak{F}}$, is thus ${\mathfrak{F}}={\mathfrak{F}}_{L}\otimes{\mathfrak{F}}_{W}$ and $\Omega=\Omega_{L}\otimes\Omega_{W}$ is the vacuum state. For every $\ell\in\\{1,2,3\\}$ let ${\mathfrak{D}}_{\ell}$ denote the set of smooth vectors $\psi_{\ell}\in{\mathfrak{F}}_{\ell}$ for which $\psi_{\ell}^{{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}}$ has a compact support and $\psi_{\ell}^{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}=0$ for all but finitely many ${(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}$. Let ${\mathfrak{D}}_{L}=\widehat{\bigotimes}_{\ell=1}^{3}{\mathfrak{D}}_{\ell}\ .$ Here $\hat{\otimes}$ is the algebraic tensor product. Let ${\mathfrak{D}}_{W}$ denote the set of smooth vectors $\phi\in{\mathfrak{F}}_{W}$ for which $\phi^{(t,\bar{t})}$ has a compact support and $\phi^{(t,\bar{t})}=0$ for all but finitely many $(t,\bar{t})$. Let ${\mathfrak{D}}={\mathfrak{D}}_{L}\hat{\otimes}\,{\mathfrak{D}}_{W}\ .$ The set ${\mathfrak{D}}$ is dense in ${\mathfrak{F}}$. Let $A_{\ell}$ be a self-adjoint operator in ${\mathfrak{F}}_{\ell}$ such that ${\mathfrak{D}}_{\ell}$ is a core for $A_{\ell}$. Its extension to ${\mathfrak{F}}_{L}$ is, by definition, the closure in ${\mathfrak{F}}_{L}$ of the operator $A_{1}\otimes{\mathbf{1}}_{2}\otimes{\mathbf{1}}_{3}$ with domain ${\mathfrak{D}}_{L}$ when $\ell=1$, of the operator ${\mathbf{1}}_{1}\otimes A_{2}\otimes{\mathbf{1}}_{3}$ with domain ${\mathfrak{D}}_{L}$ when $\ell=2$, and of the operator ${\mathbf{1}}_{1}\otimes{\mathbf{1}}_{2}\otimes A_{3}$ with domain ${\mathfrak{D}}_{L}$ when $\ell=3$. Here ${\mathbf{1}}_{\ell}$ is the operator identity on ${\mathfrak{F}}_{\ell}$. The extension of $A_{\ell}$ to ${\mathfrak{F}}_{L}$ is a self-adjoint operator for which ${\mathfrak{D}}_{L}$ is a core and it can be extended to ${\mathfrak{F}}$. The extension of $A_{\ell}$ to ${\mathfrak{F}}$ is, by definition, the closure in ${\mathfrak{F}}$ of the operator $\tilde{A}_{\ell}\otimes{\mathbf{1}}_{W}$ with domain ${\mathfrak{D}}$, where $\tilde{A}_{\ell}$ is the extension of $A_{\ell}$ to ${\mathfrak{F}}_{L}$. The extension of $A_{\ell}$ to ${\mathfrak{F}}$ is a self-adjoint operator for which ${\mathfrak{D}}$ is a core. Let $B$ be a self-adjoint operator in ${\mathfrak{F}}_{W}$ for which ${\mathfrak{D}}_{W}$ is a core. The extension of the self-adjoint operator $A_{\ell}\otimes B$ is, by definition, the closure in ${\mathfrak{F}}$ of the operator $A_{1}\otimes{\mathbf{1}}_{2}\otimes{\mathbf{1}}_{3}\otimes B$ with domain ${\mathfrak{D}}$ when $\ell=1$, of the operator ${\mathbf{1}}_{1}\otimes A_{2}\otimes{\mathbf{1}}_{3}\otimes B$ with domain ${\mathfrak{D}}$ when $\ell=2$, and of the operator ${\mathbf{1}}_{1}\otimes{\mathbf{1}}_{2}\otimes A_{3}\otimes B$ with domain ${\mathfrak{D}}$ when $\ell=3$. The extension of $A_{\ell}\otimes B$ to ${\mathfrak{F}}$ is a self-adjoint operator for which ${\mathfrak{D}}$ is a core. We now define the creation and annihilation operators. For each $\ell=1,2,3$, $b_{\ell,\epsilon}(\xi_{1})$ (resp. $b^{*}_{\ell,\epsilon}(\xi_{1})$) is the annihilation (resp. creation) operator for the corresponding species of massive particle when $\epsilon=+$ and for the corresponding species of massive antiparticle when $\epsilon=-$. Similarly, for each $\ell=1,2,3$, $c_{\ell,\epsilon}(\xi_{2})$ (resp. $c^{*}_{\ell,\epsilon}(\xi_{2})$) is the annihilation (resp. creation) operator for the corresponding species of neutrino when $\epsilon=+$ and for the corresponding species of antineutrino when $\epsilon=-$. The operator ${a_{\epsilon}}(\xi_{3})$ (resp. ${a^{*}_{\epsilon}}(\xi_{3})$) is the annihilation (resp. creation) operator for the boson $W^{-}$ when $\epsilon=+$ and for the boson $W^{+}$ when $\epsilon=-$. Let $\Psi\in{\mathfrak{D}}$ be such that $\Psi=\left(\Psi^{(Q)}\right)_{Q}\ ,$ with $Q=\Big{(}{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}_{\ell=1,2,3},\,(t,\bar{t})\Big{)}$, and $\Psi^{(Q)}=\left(\otimes_{\ell=1}^{3}\Psi^{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}\right)\otimes\varphi^{(t,\bar{t})}\ ,$ where $(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell},t,\bar{t})\in{\mathbb{N}}^{6}$. Here, $(\Psi^{(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})})_{q_{\ell}\geq 0,\bar{q}_{\ell}\geq 0,r_{\ell}\geq 0,\bar{r}_{\ell}\geq 0}\in{\mathfrak{D}}_{\ell}$, and $(\varphi^{(t,\bar{t})})_{t\geq 0,\bar{t}\geq 0}\in{\mathfrak{D}}_{W}$. Let $\begin{split}Q_{\ell,+}&=\Big{(}(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}<\ell},\,(q_{\ell}+1,\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell}),\,(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}>\ell},\,(t,\bar{t})\Big{)}\ ,\\\ Q_{\ell,-}&=\Big{(}(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}<\ell},\,(q_{\ell},\bar{q}_{\ell}+1,r_{\ell},\bar{r}_{\ell}),\,(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}>\ell},\,(t,\bar{t})\Big{)}\ ,\\\ \tilde{Q}_{\ell,+}&=\Big{(}(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}<\ell},\,(q_{\ell},\bar{q}_{\ell},r_{\ell}+1,\bar{r}_{\ell}),\,(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}>\ell},\,(t,\bar{t})\Big{)}\ ,\\\ \tilde{Q}_{\ell,-}&=\Big{(}(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}<\ell},\,(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell}+1),\,(q_{\ell^{\prime}},\bar{q}_{\ell^{\prime}},r_{\ell^{\prime}},\bar{r}_{\ell^{\prime}})_{\ell^{\prime}>\ell},\,(t,\bar{t})\Big{)}\ ,\end{split}$ and $\begin{split}Q_{b,+}&=\Big{(}(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})_{\ell=1,2,3},\,(t+1,\bar{t})\Big{)}\ ,\\\ Q_{b,-}&=\Big{(}(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})_{\ell=1,2,3},\,(t,\bar{t}+1)\Big{)}\ .\end{split}$ We define $\begin{split}&(b_{\ell,+}(\xi_{1})\Psi)^{(Q)}(\,.\,;\,\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\xi_{1}^{(q_{\ell})};\,.\,)\\\ &=\sqrt{q_{\ell}+1}\,\Pi_{\ell^{\prime}<\ell}\ (-1)^{q_{\ell^{\prime}}+\bar{q}_{\ell^{\prime}}}\Psi^{(Q_{\ell,+})}(\,.\,;\xi_{1},\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\xi_{1}^{(q_{\ell})};\,.\,)\\\ &(b_{\ell,-}(\xi_{1})\Psi)^{(Q)}(\,.\,;\,\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\xi_{1}^{(\bar{q}_{\ell})};\,.\,)\\\ &=\sqrt{\bar{q}_{\ell}+1}\,(-1)^{q_{\ell}}\Pi_{\ell^{\prime}<\ell}\ (-1)^{q_{\ell^{\prime}}+\bar{q}_{\ell^{\prime}}}\Psi^{(Q_{\ell,-})}(\,.\,;\xi_{1},\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\xi_{1}^{(\bar{q}_{\ell})};\,.\,)\ ,\end{split}$ $\begin{split}&(c_{\ell,+}(\xi_{2})\Psi)^{(Q)}(\,.\,;\,\xi_{2}^{(1)},\xi_{2}^{(2)},\ldots,\xi_{2}^{(r_{\ell})};\,.\,)\\\ &=\sqrt{r_{\ell}+1}\,(-1)^{q_{\ell}+\bar{q}_{\ell}}\Pi_{\ell^{\prime}<\ell}\ (-1)^{q_{\ell^{\prime}}+\bar{q}_{\ell^{\prime}}+r_{\ell^{\prime}}+\bar{r}_{\ell^{\prime}}}\Psi^{(\tilde{Q}_{\ell,+})}(\,.\,;\xi_{2},\xi_{2}^{(1)},\xi_{2}^{(2)},\ldots,\xi_{2}^{(r_{\ell})};\,.\,)\\\ &(c_{\ell,-}(\xi_{2})\Psi)^{(Q)}(\,.\,;\,\xi_{2}^{(1)},\xi_{2}^{(2)},\ldots,\xi_{2}^{(\bar{r}_{\ell})};\,.\,)\\\ &=\sqrt{\bar{r}_{\ell}+1}\,(-1)^{q_{\ell}+\bar{q}_{\ell}+r_{\ell}}\Pi_{\ell^{\prime}<\ell}\ (-1)^{q_{\ell^{\prime}}+\bar{q}_{\ell^{\prime}}+r_{\ell^{\prime}}+\bar{r}_{\ell^{\prime}}}\Psi^{(\tilde{Q}_{\ell,-})}(\,.\,;\xi_{2},\xi_{2}^{(1)},\xi_{2}^{(2)},\ldots,\xi_{2}^{(\bar{r}_{\ell})};\,.\,)\ ,\end{split}$ and $\begin{split}&(a_{+}(\xi_{3})\Psi)^{(Q)}(\,.\,;\,\xi_{3}^{(1)},\xi_{3}^{(2)},\ldots,\xi_{3}^{(t)};\,.\,)\\\ &=\sqrt{t+1}\Psi^{(Q_{b,+})}(\,.\,;\,\xi_{3},\xi_{3}^{(1)},\xi_{3}^{(2)},\ldots,\xi_{3}^{(t)};\,.\,)\ ,\\\ &(a_{-}(\xi_{3})\Psi)^{(Q)}(\,.\,;\,\xi_{3}^{(1)},\xi_{3}^{(2)},\ldots,\xi_{3}^{(\bar{t})};\,.\,)\\\ &=\sqrt{\bar{t}+1}\Psi^{(Q_{b,-})}(\,.\,;\,\xi_{3},\xi_{3}^{(1)},\xi_{3}^{(2)},\ldots,\xi_{3}^{(\bar{t})};\,.\,)\ .\end{split}$ As usual, $b^{*}_{\ell,\epsilon}(\xi_{1})$ (resp. $c^{*}_{\ell,\epsilon}(\xi_{2})$) is the formal adjoint of $b_{\ell,\epsilon}(\xi_{1})$ (resp. $c_{\ell,\epsilon}(\xi_{2})$). For example, we have $\begin{split}&(b^{*}_{\ell,\epsilon}(\xi_{1})\Psi)^{(Q_{\ell,+})}(\,.\,;\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\xi_{1}^{(q_{\ell})},\xi_{1}^{(q_{\ell}+1)};\,.\,)\\\ &=\frac{1}{\sqrt{q_{\ell}+1}}\prod_{\ell^{\prime}<\ell}(-1)^{q_{\ell^{\prime}}+\bar{q}_{\ell^{\prime}}}\\\ &\sum_{i=1}^{q_{\ell}+1}(-1)^{i+1}\delta(\xi_{1}-\xi_{1}^{(i)})\Psi^{(Q)}(\,.\,;\xi_{1}^{(1)},\xi_{1}^{(2)},\ldots,\widehat{\xi_{1}^{(i)}},\ldots,\xi_{1}^{(q_{\ell}+1)};\,.\,)\ ,\end{split}$ where $\widehat{.}$ denotes that the $i$-th variable has to be omitted, and $\delta(\xi_{1}-\xi_{1}^{(i)})=\delta_{s_{1}s_{1}^{(i)}}\delta(p_{1}-p_{1}^{(i)})$. The operator $a^{*}_{\epsilon}(\xi_{3})$ is the formal adjoint of $a_{\epsilon}(\xi_{3})$ and we have $\begin{split}&(a^{*}_{+}(\xi_{3})\Psi)^{(Q_{b,+})}(\,.\,;\xi_{3}^{(1)},\xi_{3}^{(2)},\ldots,\xi_{3}^{(t+1)};.)\\\ &=\frac{1}{\sqrt{t+1}}\sum_{i=1}^{t+1}\delta(\xi_{3}-\xi_{3}^{(i)})\Psi^{(Q)}(\,.\,;\xi_{3}^{(1)},\ldots,\widehat{\xi_{3}^{(i)}},\ldots,\xi_{3}^{(t+1)};\,.\,)\end{split}$ where $\delta(\xi_{3}-\xi_{3}^{(i)})=\delta_{\lambda\lambda^{(i)}}\delta(k-k^{(i)})$. The following canonical anticommutation and commutation relations hold. $\begin{split}&\\{b_{\ell,\epsilon}(\xi_{1}),b^{*}_{\ell^{\prime},\epsilon^{\prime}}(\xi_{1}^{\prime})\\}=\delta_{\ell\ell^{\prime}}\delta_{\epsilon\epsilon^{\prime}}\delta(\xi_{1}-\xi_{1}^{\prime})\ ,\\\ &\\{c_{\ell,\epsilon}(\xi_{2}),c^{*}_{\ell^{\prime},\epsilon^{\prime}}(\xi_{2}^{\prime})\\}=\delta_{\ell\ell^{\prime}}\delta_{\epsilon\epsilon^{\prime}}\delta(\xi_{2}-\xi_{2}^{\prime})\ ,\\\ &[a_{\epsilon}(\xi_{3}),a^{*}_{\epsilon^{\prime}}(\xi_{3}^{\prime})]=\delta_{\epsilon\epsilon^{\prime}}\delta(\xi_{3}-\xi_{3}^{\prime})\ ,\\\ &\\{b_{\ell,\epsilon}(\xi_{1}),b_{\ell^{\prime},\epsilon^{\prime}}(\xi_{1}^{\prime})\\}=\\{c_{\ell,\epsilon}(\xi_{2}),c_{\ell^{\prime},\epsilon^{\prime}}(\xi_{2}^{\prime})\\}=0\ ,\\\ &[a_{\epsilon}(\xi_{3}),a_{\epsilon^{\prime}}(\xi_{3}^{\prime})]=0\ ,\\\ &\\{b_{\ell,\epsilon}(\xi_{1}),c_{\ell^{\prime},\epsilon^{\prime}}(\xi_{2})\\}=\\{b_{\ell,\epsilon}(\xi_{1}),c^{*}_{\ell^{\prime},\epsilon^{\prime}}(\xi_{2})\\}=0\ ,\\\ &[b_{\ell,\epsilon}(\xi_{1}),a_{\epsilon^{\prime}}(\xi_{3})]=[b_{\ell,\epsilon}(\xi_{1}),a^{*}_{\epsilon^{\prime}}(\xi_{3})]=[c_{\ell,\epsilon}(\xi_{2}),a_{\epsilon^{\prime}}(\xi_{3})]=[c_{\ell,\epsilon}(\xi_{2}),a^{*}_{\epsilon^{\prime}}(\xi_{3})]=0\ .\end{split}$ Here, $\\{b,b^{\prime}\\}=bb^{\prime}+b^{\prime}b$, $[a,a^{\prime}]=aa^{\prime}-a^{\prime}a$. We recall that the following operators, with $\varphi\in L^{2}(\Sigma_{1})$, $\begin{split}&b_{\ell,\epsilon}(\varphi)=\int_{\Sigma_{1}}b_{\ell,\epsilon}(\xi)\overline{\varphi(\xi)}\mathrm{d}\xi,\quad c_{\ell,\epsilon}(\varphi)=\int_{\Sigma_{1}}c_{\ell,\epsilon}(\xi)\overline{\varphi(\xi)}\mathrm{d}\xi\ ,\\\ &b^{*}_{\ell,\epsilon}(\varphi)=\int_{\Sigma_{1}}b^{*}_{\ell,\epsilon}(\xi){\varphi(\xi)}\mathrm{d}\xi,\quad c^{*}_{\ell,\epsilon}(\varphi)=\int_{\Sigma_{1}}c^{*}_{\ell,\epsilon}(\xi){\varphi(\xi)}\mathrm{d}\xi\end{split}$ are bounded operators in ${\mathfrak{F}}$ such that (2.9) $\|b^{\sharp}_{\ell,\epsilon}(\varphi)\|=\|c^{\sharp}_{\ell,\epsilon}(\varphi)\|=\|\varphi\|_{L^{2}}\ ,$ where $b^{\sharp}$ (resp. $c^{\sharp}$) is b (resp. $c$) or $b^{*}$ (resp. $c^{*}$). The operators $b^{\sharp}_{\ell,\epsilon}(\varphi)$ and $c^{\sharp}_{\ell,\epsilon}(\varphi)$ satisfy similar anticommutaion relations (see e.g. [29]). The free Hamiltonian $H_{0}$ is given by $\begin{split}H_{0}&=H_{0}^{(1)}+H_{0}^{(2)}+H_{0}^{(3)}\\\ &=\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int w_{\ell}^{(1)}(\xi_{1})b^{*}_{\ell,\epsilon}(\xi_{1})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}+\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int w_{\ell}^{(2)}(\xi_{2})c^{*}_{\ell,\epsilon}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\\\ &+\sum_{\epsilon=\pm}\int w^{(3)}(\xi_{3})a^{*}_{\epsilon}(\xi_{3})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\ ,\end{split}$ where $\begin{split}&w_{\ell}^{(1)}(\xi_{1})=(|p_{1}|^{2}+m_{\ell}^{2})^{\frac{1}{2}},\quad\mbox{with}\ 0<m_{1}<m_{2}<m_{3}\ ,\\\ &w_{\ell}^{(2)}(\xi_{2})=|p_{2}|\ ,\\\ &w^{(3)}(\xi_{3})=(|k|^{2}+m^{2}_{W})^{\frac{1}{2}}\ ,\end{split}$ where $m_{W}$ is the mass of the bosons $W^{+}$ and $W^{-}$ such that $m_{W}>m_{3}$. The spectrum of $H_{0}$ is $[0,\,\infty)$ and $0$ is a simple eigenvalue with $\Omega$ as eigenvector. The set of thresholds of $H_{0}$, denoted by $T$, is given by $T=\\{p\,m_{1}+q\,m_{2}+r\,m_{3}+s\,m_{W};(p,\,q,\,r,\,s)\in{\mathbb{N}}^{4}\mbox{ and }p+q+r+s\geq 1\\}\ ,$ and each set $[t,\infty)$, $t\in T$, is a branch of absolutely continuous spectrum for $H_{0}$. The interaction, denoted by $H_{I}$, is given by (2.10) $H_{I}=\sum_{\alpha=1}^{2}H_{I}^{(\alpha)}\ ,$ where (2.11) $\begin{split}H_{I}^{(1)}=&\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\\\ &+\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int\overline{G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}a^{*}_{\epsilon}(\xi_{3})c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\ ,\end{split}$ (2.12) $\begin{split}H_{I}^{(2)}=&\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\\\ &+\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int\overline{G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}a_{\epsilon}(\xi_{3})c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\ .\end{split}$ The kernels $G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(.,.,.)$, $\alpha=1,2$, are supposed to be functions. The total Hamiltonian is then (2.13) $H=H_{0}+gH_{I},\quad g>0\ ,$ where $g$ is a coupling constant. The operator $H_{I}^{(1)}$ describes the decay of the bosons $W^{+}$ and $W^{-}$ into leptons. Because of $H_{I}^{(2)}$ the bare vacuum will not be an eigenvector of the total Hamiltonian for every $g>0$ as we expect from the physics. Every kernel $G_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})$, computed in theoretical physics, contains a $\delta$-distribution because of the conservation of the momentum (see [18] [30, section 4.4]). In what follows, we approximate the singular kernels by square integrable functions. Thus, from now on, the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ are supposed to satisfy the following hypothesis . ###### Hypothesis 2.1. For $\alpha=1,2$, $\ell=1,2,3$, $\epsilon,\epsilon^{\prime}=\pm$, we assume (2.14) $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})\in L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})\ .$ ###### Remark 2.2. A similar model can be written down for the weak decay of pions $\pi^{-}$ and $\pi^{+}$ (see [18, section 6.2]). ###### Remark 2.3. The total Hamiltonian is more general than the one involved in the theory of weak interaction because, in the Standard Model, neutrinos have helicity $-1/2$ and antineutrinos have helicity $1/2$. In the physical case, the Fock space, denoted by ${\mathfrak{F}}^{\prime}$, is isomorphic to ${\mathfrak{F}}_{L}^{\prime}\otimes{\mathfrak{F}}_{W}$, with ${\mathfrak{F}}_{L}^{\prime}=\bigotimes_{\ell=1}^{3}{\mathfrak{F}}_{\ell}^{\prime}\ ,$ and ${\mathfrak{F}}_{\ell}^{\prime}=(\otimes_{a}^{2}L^{2}(\Sigma_{1}))\otimes(\otimes_{a}^{2}L^{2}({\mathbb{R}}^{3}))\ .$ The free Hamiltonian, now denoted by $H_{0}^{\prime}$, is then given by $\begin{split}H_{0}^{\prime}=&\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int w_{\ell}^{(1)}(\xi_{1})b^{*}_{\ell,\epsilon}(\xi_{1})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}+\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int_{{\mathbb{R}}^{3}}|p_{2}|c^{*}_{\ell,\epsilon}(p_{2})c_{\ell,\epsilon}(p_{2})\mathrm{d}p_{2}\\\ &+\sum_{\epsilon=\pm}\int w^{(3)}(\xi_{3})a^{*}_{\epsilon}(\xi_{3})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\ ,\end{split}$ and the interaction, now denoted by $H_{I}^{\prime}$, is the one obtained from $H_{I}$ by supposing that $G^{(\alpha)}(\xi_{1},(p_{2},s_{2}),\xi_{3})=0$ if $s_{2}=\epsilon\frac{1}{2}$. The total Hamiltonian, denoted by $H^{\prime}$, is then given by $H^{\prime}=H_{0}^{\prime}+g\,H_{I}^{\prime}$. The results obtained in this paper for $H$ hold true for $H^{\prime}$ with obvious modifications. Under Hypothesis 2.1 a well defined operator on ${\mathfrak{D}}$ corresponds to the formal interaction $H_{I}$ as it follows. The formal operator $\int G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}$ is defined as a quadratic form on $({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})\times({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})$ as $\int(c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})\psi,\ G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}a_{\epsilon}(\xi_{3})\phi)\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\ ,$ where $\psi$, $\phi\in{\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}$. By mimicking the proof of [24, Theorem X.44], we get a closed operator, denoted by $H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}}$, associated with the quadratic form such that it is the unique operator in ${\mathfrak{F}}_{\ell}\otimes{\mathfrak{F}}_{W}$ such that ${\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}\subset\ {\mathcal{D}}(H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}})$ is a core for $H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}}=\int G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}$ as quadratic forms on $({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})\times({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})$. The formal operator $\int\overline{G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}$ is similarly associated with $(H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ and $(H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}=\int\overline{G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}$ as quadratic forms on $({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})\times({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})$. Moreover, ${\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}\subset{\mathcal{D}}((H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*})$ is a core for $(H^{(1)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$. Again, there exists two closed operators $H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $(H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ such that ${\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}\subset{\mathcal{D}}(H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})$, ${\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}\subset{\mathcal{D}}((H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*})$ and ${\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W}$ is a core for $H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $(H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ and such that $H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}}=\int G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\ ,$ $(H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}=\int G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})a_{\epsilon}(\xi_{3})c_{\ell,\epsilon^{\prime}}(\xi_{2})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}$ as quadratic forms on $({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})\times({\mathfrak{D}}_{\ell}\otimes{\mathfrak{D}}_{W})$. We shall still denote $H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ ($\alpha=1,2$) their extensions to ${\mathfrak{F}}$. The set ${\mathfrak{D}}$ is then a core for $H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ Thus $H=H_{0}+g\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}}+(H^{(2)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*})$ is a symmetric operator defined on ${\mathfrak{D}}$. We now want to prove that $H$ is essentially self-adjoint on ${\mathfrak{D}}$ by showing that $H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}}$ and $(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*}$ are relatively $H_{0}$-bounded. Once again, as above, for almost every $\xi_{3}\in\Sigma_{2}$, there exists closed operators in ${\mathfrak{F}}_{L}$, denoted by $B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})$ and $(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}$ such that $B^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})=-\int\overline{G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}b_{\ell,\epsilon}(\xi_{1})c_{\ell,\epsilon^{\prime}}(\xi_{2})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ ,$ $(B^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}=\int G^{(1)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ ,$ $B^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})=\int G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})b^{*}_{\ell,\epsilon}(\xi_{1})c^{*}_{\ell,\epsilon^{\prime}}(\xi_{2})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ ,$ $(B^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}=-\int\overline{G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})}b_{\ell,\epsilon}(\xi_{1})c_{\ell,\epsilon^{\prime}}(\xi_{2})\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ \,$ as quadratic forms on ${\mathfrak{D}}_{\ell}\times{\mathfrak{D}}_{\ell}$. We have that ${\mathfrak{D}}_{\ell}\subset{\mathcal{D}}(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))$ (resp. ${\mathfrak{D}}_{\ell}\subset{\mathcal{D}}((B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*})$ is a core for $B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})$ (resp. for $(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}$). We still denote by $B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))$ and $(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*})$ their extensions to ${\mathfrak{F}}_{L}$. It then follows that the operator $H_{I}$ with domain ${\mathfrak{D}}$ is symmetric and can be written in the following form $\begin{split}&H_{I}=\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}}+(H^{(\alpha)}_{I,\ell,\epsilon,\epsilon^{\prime}})^{*})\\\ &\\!=\\!\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}+\\!\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\otimes a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\,.\end{split}$ Let $N_{\ell}$ denote the operator number of massive leptons $\ell$ in ${\mathfrak{F}}_{\ell}$, i.e., (2.15) $N_{\ell}=\sum_{\epsilon}\int b_{\ell,\epsilon}^{*}(\xi_{1})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}\ .$ The operator $N_{\ell}$ is a positive self-adjoint operator in ${\mathfrak{F}}_{\ell}$. We still denote by $N_{\ell}$ its extension to ${\mathfrak{F}}_{L}$. The set ${\mathfrak{D}}_{L}$ is a core for $N_{\ell}$. We then have ###### Proposition 2.4. For a.e. $\xi_{3}\in\Sigma_{2}$, ${\mathcal{D}}(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))$, ${\mathcal{D}}((B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*})\supset{\mathcal{D}}(N_{\ell}^{\frac{1}{2}})$, and for $\Phi\in{\mathcal{D}}(N_{\ell}^{\frac{1}{2}})\subset{\mathfrak{F}}_{L}$ we have (2.16) $\|B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\Phi\|_{{\mathfrak{F}}_{L}}\leq\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(.,.,\xi_{3})\|_{L^{2}(\Sigma_{1}\times\Sigma_{1})}\|N_{\ell}^{\frac{1}{2}}\Phi\|_{{\mathfrak{F}}_{L}}\ ,$ (2.17) $\|(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\Phi\|_{{\mathfrak{F}}_{L}}\leq\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(.,.,\xi_{3})\|_{L^{2}(\Sigma_{1}\times\Sigma_{1})}\|N_{\ell}^{\frac{1}{2}}\Phi\|_{{\mathfrak{F}}_{L}}\ .$ ###### Proof. The estimates (2.16) and (2.17) are examples of $N_{\tau}$ estimates (see [16]). We give a proof for sake of completeness. We only consider $B^{(1)}_{1,+,-}$. The other cases are quite similar. Let $\Phi=(\Phi^{(Q)})_{Q}$ and $\Psi=(\Psi^{(Q^{\prime})})_{Q^{\prime}}$ be two vectors in ${\mathfrak{D}}_{L}$, where we use the notations $Q={(q_{\ell},\bar{q}_{\ell},r_{\ell},\bar{r}_{\ell})}_{\ell=1,2,3}$, and $Q^{\prime}=(q_{\ell}^{\prime},\bar{q}_{\ell}^{\prime},r_{\ell}^{\prime},\bar{r}_{\ell}^{\prime})_{\ell=1,2,3}$. We have (2.18) $\begin{split}&(\Psi^{(Q^{\prime})},B^{(1)}_{1,+,-}(\xi_{3})\Phi^{(Q)})_{{\mathfrak{F}}_{L}}=-\delta_{q^{\prime}_{1}\,q_{1}-1}\delta_{\bar{q}_{1}^{\prime}\,\bar{q}_{1}}\delta_{r^{\prime}_{1}\,r_{1}}\delta_{\bar{r}_{1}^{\prime}\,\bar{r}_{1}-1}\prod_{\ell=2}^{3}\delta_{q_{\ell}^{\prime}q_{\ell}}\delta_{\bar{q}_{\ell}^{\prime}\bar{q}_{\ell}}\delta_{r_{\ell}^{\prime}r_{\ell}}\delta_{\bar{r}_{\ell}^{\prime}\bar{r}_{\ell}}\\\ &\int_{\Sigma_{1}\times\Sigma_{1}}(\Psi^{(\tilde{Q})},b_{1,+}(\xi_{1})c_{1,-}(\xi_{2})\Phi^{(Q)})_{{\mathfrak{F}}_{L}}\overline{G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ .\end{split}$ Here $\tilde{Q}=(q_{1}-1,\bar{q}_{1},r_{1},\bar{r}_{1}-1,q_{2},\bar{q}_{2},r_{2},\bar{r}_{2},q_{3},\bar{q}_{3},r_{3},\bar{r}_{3})$. For each $Q$, (2.19) $B^{(1)}_{1,+,-}(\xi_{3})\Phi^{(Q)}\in{\mathfrak{F}}_{1}^{(q_{1}-1,\bar{q}_{1},r_{1},\bar{r}_{1}-1)}\otimes{\mathfrak{F}}_{2}^{(q_{2},\bar{q}_{2},r_{2},\bar{r}_{2})}\otimes{\mathfrak{F}}_{3}^{(q_{3},\bar{q}_{3},r_{3},\bar{r}_{3})}.$ By the Fubini theorem we have $\begin{split}&\left|(\Psi^{(\tilde{Q})},B^{(1)}_{1,+,-}(\xi_{3})\Psi^{(Q)})_{{\mathfrak{F}}_{L}}\right|\\\ &=\left|\int_{\Sigma_{1}}\left(\int_{\Sigma_{1}}G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})c_{1,-}^{*}(\xi_{2})\Psi^{(\tilde{Q})}\mathrm{d}\xi_{2},b_{1,+}(\xi_{1})\Phi^{(Q)}\right)_{{\mathfrak{F}}_{L}}\mathrm{d}\xi_{1}\right|\ .\end{split}$ By (2.9), and the Cauchy-Schwarz inequality we get $\begin{split}&\left|(\Psi^{(\tilde{Q})},B^{(1)}_{1,+,-}(\xi_{3})\Psi^{(Q)})_{{\mathfrak{F}}_{L}}\right|^{2}\\\ &\leq\left(\int_{\Sigma_{1}}\|b_{1,+}(\xi_{1})\Phi^{(Q)}\|\left(\int_{\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{2}\right)^{\frac{1}{2}}\mathrm{d}\xi_{1}\right)^{2}\|\Psi^{(\tilde{Q})}\|^{2}\ .\end{split}$ By the definition of $b_{1,+}(\xi_{1})\Phi^{(Q)}$ and the Cauchy-Schwarz inequality we get $\begin{split}&|(\Psi^{(\tilde{Q})},B^{(1)}_{1,+,-}(\xi_{3})\Phi^{(Q)})_{{\mathfrak{F}}_{L}}|^{2}\\\ &\leq q_{1}\left(\int_{\Sigma_{1}}\int_{\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\right)\|\Psi^{(\tilde{Q})}\|^{2}_{{\mathfrak{F}}_{L}}\|\Phi^{(Q)}\|^{2}_{{\mathfrak{F}}_{L}}\\\ &=\left(\int_{\Sigma_{1}}\int_{\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\right)\|\Psi^{(\tilde{Q})}\|^{2}_{{\mathfrak{F}}_{L}}\|N_{1}^{\frac{1}{2}}\Phi^{(Q)}\|^{2}_{{\mathfrak{F}}_{L}}\ .\end{split}$ By (2.19) we have $\begin{split}|(\Psi,B^{(1)}_{1,+,-}(\xi_{3})\Phi^{(Q)})_{{\mathfrak{F}}_{L}}|^{2}\leq\|\Psi\|_{{\mathfrak{F}}_{L}}^{2}\|N_{1}^{\frac{1}{2}}\Phi^{(Q)}\|^{2}_{{\mathfrak{F}}_{L}}\int_{\Sigma_{1}\times\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\ ,\end{split}$ for every $\Psi\in{\mathfrak{D}}_{L}$. Therefore we get $\|B^{(1)}_{1,+,-}(\xi_{3})\Phi^{(Q)}\|^{2}_{{\mathfrak{F}}_{L}}\leq\left(\int_{\Sigma_{1}\times\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\right)\|N_{1}^{\frac{1}{2}}\Phi^{(Q)}\|^{2}_{{\mathfrak{F}}_{L}}\ ,$ and by (2.19) we finally obtain $\|B^{(1)}_{1,+,-}(\xi_{3})\Phi\|^{2}_{{\mathfrak{F}}_{L}}\leq\left(\int_{\Sigma_{1}\times\Sigma_{1}}|G^{(1)}_{1,+,-}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\right)\|N_{1}^{\frac{1}{2}}\Phi\|^{2}_{{\mathfrak{F}}_{L}}\ ,$ for every $\Phi\in{\mathfrak{D}}$. Since ${\mathfrak{D}}_{L}$ is a core for $N_{1}^{\frac{1}{2}}$ and $B^{(1)}_{1,+,-}$ with domain ${\mathfrak{D}}_{L}$ is closable, ${\mathcal{D}}(B^{(1)}_{1,+,-}(\xi_{3}))\supset{\mathcal{D}}(N_{1}^{\frac{1}{2}})$, and (2.16) is satisfied for every $\Phi\in{\mathcal{D}}(N_{1}^{\frac{1}{2}})$. ∎ Let $H^{(3)}_{0,\epsilon}=\int w^{(3)}(\xi_{3})a_{\epsilon}^{*}(\xi_{3})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\ .$ Then $H^{(3)}_{0,\epsilon}$ is a self-adjoint operator in ${\mathfrak{F}}_{W}$, and ${\mathfrak{D}}_{W}$ is a core for $H^{(3)}_{0,\epsilon}$. We get ###### Proposition 2.5. (2.20) $\begin{split}&\|\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\otimes a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\Psi\|^{2}\\\ &\leq(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3})\ \|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H_{0,\epsilon}^{(3)})^{\frac{1}{2}}\Psi\|^{2}\end{split}$ and (2.21) $\begin{split}&\|\int B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes a^{*}_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\Psi\|^{2}\\\ &\leq(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3})\ \|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H_{0,\epsilon}^{(3)})^{\frac{1}{2}}\Psi\|^{2}\\\ &+(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3})\ (\eta\|(N_{\ell}+1)^{\frac{1}{2}}\otimes{\mathbf{1}}\ \Psi\|^{2}+\frac{1}{4\eta}\|\Psi\|^{2})\ ,\end{split}$ for every $\Psi\in{\mathcal{D}}(H_{0})$ and every $\eta>0$. ###### Proof. Suppose that $\Psi\in{\mathcal{D}}(N_{\ell}^{\frac{1}{2}})\hat{\otimes}{\mathcal{D}}((H_{0,\epsilon}^{(3)})^{\frac{1}{2}})$. Let $\Psi_{\epsilon}(\xi_{3})=w^{(3)}(\xi_{3})^{\frac{1}{2}}((N_{\ell}+1)^{\frac{1}{2}}\otimes a_{\epsilon}(\xi_{3}))\Phi\ .$ We have $\int_{\Sigma_{2}}\|\Psi_{\epsilon}(\xi_{3})\|^{2}\mathrm{d}\xi_{3}=\|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H_{0,\epsilon}^{(3)})^{\frac{1}{2}}\Psi\|^{2}\ .$ We get $\begin{split}&\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\otimes a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\Psi\\\ &=\int_{\Sigma_{2}}\frac{1}{(w^{(3)}(\xi_{3}))^{\frac{1}{2}}}((B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}(N_{\ell}+1)^{-\frac{1}{2}}\otimes{\mathbf{1}})\Psi_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\ .\end{split}$ Therefore (2.22) $\begin{split}&\|\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\otimes a_{\epsilon}(\xi_{3})\,\Psi\mathrm{d}\xi_{3}\|^{2}_{\mathfrak{F}}\\\ &\leq(\int_{\Sigma_{2}}\frac{1}{w^{(3)}(\xi_{3})}\|(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}(N_{\ell}+1)^{-\frac{1}{2}}\|_{{\mathfrak{F}}_{L}}\|\Psi_{\epsilon}(\xi_{3})\|_{{\mathfrak{F}}}\mathrm{d}\xi_{3})^{2}\\\ &\leq(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{2},\xi_{2},\xi 3)|^{2}}{w^{(3)}(\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3})\|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H^{(3)}_{0,\epsilon})^{\frac{1}{2}}\Psi\|_{\mathfrak{F}}^{2}\ ,\end{split}$ as it follows from Proposition 2.4. We now have $\begin{split}&\|\int B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes a_{\epsilon}^{*}(\xi_{3})\,\Psi\mathrm{d}\xi_{3}\|^{2}_{\mathfrak{F}}\\\ &=\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes a_{\epsilon}(\xi_{3}^{\prime})\Psi,\ B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}^{\prime})\otimes a_{\epsilon}(\xi_{3})\,\Psi)\mathrm{d}\xi_{3}\mathrm{d}\xi_{3}^{\prime}+\int\|(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\otimes{\mathbf{1}})\Psi\|^{2}\mathrm{d}\xi_{3}\ ,\end{split}$ and (2.23) $\begin{split}&\int_{\Sigma_{2}\times\Sigma_{2}}(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes a_{\epsilon}(\xi_{3}^{\prime})\Psi,B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}^{\prime})\otimes a_{\epsilon}(\xi_{3})\Psi)\mathrm{d}\xi_{3}\mathrm{d}\xi_{3}^{\prime}\\\ &=\int_{\Sigma_{2}\times\Sigma_{2}}\frac{1}{w^{(3)}(\xi_{3})^{\frac{1}{2}}w^{(3)}(\xi_{3}^{\prime})^{\frac{1}{2}}}\Big{(}(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})(N_{\ell}+1)^{-\frac{1}{2}}\otimes{\mathbf{1}})\Psi_{\epsilon}(\xi_{3}^{\prime}),\\\ &(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}^{\prime})(N_{\ell}+1)^{-\frac{1}{2}}\otimes{\mathbf{1}})\Psi_{\epsilon}(\xi_{3})\Big{)}\mathrm{d}\xi_{3}\mathrm{d}\xi_{3}^{\prime}\\\ &\leq(\int_{\Sigma_{2}}\frac{1}{w^{(3)}(\xi_{3})^{\frac{1}{2}}}\|B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})(N_{\ell}+1)^{-\frac{1}{2}}\|_{{\mathfrak{F}}_{L}}\|\Psi_{\epsilon}(\xi_{3})\|\mathrm{d}\xi_{3})^{2}\\\ &\leq(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3})\|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H_{0,\epsilon}^{(3)})^{\frac{1}{2}}\Psi\|^{2}\ .\end{split}$ Furthermore (2.24) $\begin{split}&\int_{\Sigma_{2}}\|B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})\otimes{\mathbf{1}})\Psi\|^{2}\mathrm{d}\xi_{3}\\\ &=\int_{\Sigma_{2}}\|B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3})(N_{\ell}+1)^{-\frac{1}{2}}\otimes{\mathbf{1}})((N_{\ell}+1)^{\frac{1}{2}}\otimes{\mathbf{1}})\Psi\|^{2}\mathrm{d}\xi_{3}\\\ &\leq\left(\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\right)\,(\eta\|(N_{\ell}+1)\Psi\|^{2}+\frac{1}{4\eta}\|\Psi\|^{2})\ ,\end{split}$ for every $\eta>0$. By (2.22), (2.23), and (2.24), we finally get (2.20) and (2.21) for every $\Psi\in{\mathcal{D}}(N_{\ell}^{\frac{1}{2}})\hat{\otimes}{\mathcal{D}}(H_{0,\epsilon}^{(3)})$. The set ${\mathcal{D}}(N_{\ell}^{\frac{1}{2}})\hat{\otimes}{\mathcal{D}}(H_{0,\epsilon}^{(3)})$ is a core for $N_{\ell}^{\frac{1}{2}}\otimes H_{0,\epsilon}^{(3)}$ and ${\mathcal{D}}(H_{0})\subset{\mathcal{D}}(N_{\ell}^{\frac{1}{2}}\otimes H_{0,\epsilon}^{(3)})$. It then follows that (2.20) and (2.21) are verified for every $\Psi\in{\mathcal{D}}(H_{0})$. ∎ We now prove that $H$ is a self-adjoint operator in ${\mathfrak{F}}$ for $g$ sufficiently small. ###### Theorem 2.6. Let $g_{1}>0$ be such that $\frac{3g_{1}^{2}}{m_{W}}(\frac{1}{m_{1}^{2}}+1)\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2}_{L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})}<1\ .$ Then for every $g$ satisfying $g\leq g_{1}$, $H$ is a self-adjoint operator in ${\mathfrak{F}}$ with domain ${\mathcal{D}}(H)={\mathcal{D}}(H_{0})$, and ${\mathfrak{D}}$ is a core for $H$. ###### Proof. Let $\Psi$ be in ${\mathfrak{D}}$. We have (2.25) $\begin{split}\|H_{I}\Psi\|^{2}\leq&12\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\Big{\\{}\left\|\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))^{*}\otimes a_{\epsilon}(\xi_{3})\,\Psi\mathrm{d}\xi_{3}\right\|^{2}\\\ &+\left\|\int(B^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{3}))\otimes a^{*}_{\epsilon}(\xi_{3})\,\Psi\mathrm{d}\xi_{3}\right\|^{2}\Big{\\}}\ .\end{split}$ Note that $\|H_{0,\epsilon}^{(3)}\Psi\|\leq\|H_{0}^{(3)}\Psi\|\leq\|H_{0}\Psi\|\ ,$ and $\|N_{\ell}\Psi\|\leq\frac{1}{m_{\ell}}\|H_{0,\ell}\Psi\|\leq\frac{1}{m_{1}}\|H_{0,\ell}\Psi\|\leq\frac{1}{m_{1}}\|H_{0}\Psi\|\ ,$ where (2.26) $H_{0,\ell}=\sum_{\epsilon}\int w_{\ell}^{(1)}(\xi_{1})b_{\ell,\epsilon}^{*}(\xi_{1})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}+\sum_{\epsilon}\int w_{\ell}^{(2)}(\xi_{2})c_{\ell,\epsilon}^{*}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ .$ We further note that (2.27) $\|(N_{\ell}+1)^{\frac{1}{2}}\otimes(H^{(3)}_{0,\epsilon})^{\frac{1}{2}}\Psi\|^{2}\leq\frac{1}{2}(\frac{1}{m_{1}^{2}}+1)\|H_{0}\Psi\|^{2}+\frac{\beta}{2m_{1}^{2}}\|H_{0}\Psi\|^{2}+(\frac{1}{2}+\frac{1}{8\beta})\|\Psi\|^{2},$ for $\beta>0$, and (2.28) $\eta\|((N_{\ell}+1)\otimes{\mathbf{1}})\Psi\|^{2}+\frac{1}{4\eta}\|\Psi\|^{2}\leq\frac{\eta}{m_{1}^{2}}\|H_{0}\Psi\|^{2}+\frac{\eta\beta}{m_{1}^{2}}\|H_{0}\Psi\|^{2}+\eta(1+\frac{1}{4\beta})\|\Psi\|^{2}+\frac{1}{4\eta}\|\Psi\|^{2}.$ Combining (2.25) with (2.20), (2.21), (2.27) and (2.28) we get for $\eta>0$, $\beta>0$ (2.29) $\begin{split}&\|H_{I}\Psi\|^{2}\leq 6(\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2})\\\ &\Big{(}\frac{1}{2m_{W}}(\frac{1}{m_{1}^{2}}+1)\|H_{0}\Psi\|^{2}+\frac{\beta}{2m_{W}m_{1}^{2}}\|H_{0}\Psi\|^{2}+\frac{1}{2m_{W}}(1+\frac{1}{4\beta})\|\Psi\|^{2}\Big{)}\\\ &+12(\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2})(\frac{\eta}{m_{1}^{2}}(1+\beta)\|H_{0}\Psi\|^{2}+(\eta(1+\frac{1}{4\beta})+\frac{1}{4\eta})\|\Psi\|^{2}),\end{split}$ by noting (2.30) $\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\leq\frac{1}{m_{W}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2}.$ By (2.29) the theorem follows from the Kato-Rellich theorem. ∎ ## 3\. Main results In the sequel, we shall make the following additional assumptions on the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$. ###### Hypothesis 3.1. $(i)$ For $\alpha=1,2,\ \ell=1,2,3,\ \epsilon,\epsilon^{\prime}=\pm$, $\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{|p_{2}|^{2}}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}<\infty,\quad$ $(ii)$ There exists $C>0$ such that for $\alpha=1,2,\ \ell=1,2,3,\ \epsilon,\epsilon^{\prime}=\pm$, $\left(\int_{\Sigma_{1}\times\\{|p_{2}|\leq\sigma\\}\times\Sigma_{2}}|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\right)^{\frac{1}{2}}\leq C\sigma^{2}.$ $(iii)$ For $\alpha=1,2,\ \ell=1,2,3,\ \epsilon,\epsilon^{\prime}=\pm$, and $i,j=1,2,3$ $(iii.a)\quad\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\left|[(p_{2}\cdot\nabla_{p_{2}})G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}](\xi_{1},\xi_{2},\xi_{3})\right|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}<\infty\ ,$ and $(iii.b)\quad\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}p_{2,i}^{2}\,p_{2,j}^{2}\left|\frac{\partial^{2}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}}{\partial p_{2,i}\partial p_{2,j}}(\xi_{1},\xi_{2},\xi_{3})\right|^{2}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}<\infty\ .$ $(iv)$ There exists $\Lambda>m_{1}$ such, that for $\alpha=1,2$, $\ell=1,2,3$, $\epsilon,\epsilon^{\prime}=\pm$, $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})=0\quad\mbox{if}\quad|p_{2}|\geq\Lambda\ .$ ###### Remark 3.2. Hypothesis 3.1 (ii) is nothing but an infrared regularization of the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$. In order to satisfy this hypothesis it is, for example, sufficient to suppose $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})=|p_{2}|^{\frac{1}{2}}\tilde{G}^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})\ ,$ where $\tilde{G}^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ is a smooth function of $(p_{1},p_{2},p_{3})$ in the Schwartz space. The Hypothesis 3.1 (iv), which is a sharp ultraviolet cutoff, is actually not necessary, and can be removed at the expense of some additional technicalities in Appendix A. However, in order to simplify the proof of Proposition 3.5, we shall leave it. Our first result is devoted to the existence of a ground state for $H$ together with the location of the spectrum of $H$ and of its absolutely continuous spectrum when $g$ is sufficiently small. ###### Theorem 3.3. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and Hypothesis 3.1 (i). Then there exists $0<g_{2}\leq g_{1}$ such that $H$ has a unique ground state for $g\leq g_{2}$. Moreover $\sigma(H)=\sigma_{\rm{ac}}(H)=[\inf\sigma(H),\infty)\ ,$ with $\inf\sigma(H)\leq 0$. According to Theorem 3.3 the ground state energy $E=\inf\sigma(H)$ is a simple eigenvalue of $H$ and our main results are concerned with a careful study of the spectrum of $H$ above the ground state energy. The spectral theory developed in this work is based on the conjugated operator method as described in [23], [3] and [25]. Our choice of the conjugate operator denoted by $A$ is the second quantized dilation generator for the neutrinos. Let $a$ denote the following operator in $L^{2}(\Sigma_{1})$ $a=\frac{1}{2}(p_{2}\cdot i\nabla_{p_{2}}+i\nabla_{p_{2}}\cdot p_{2})\ .$ The operator $a$ is essentially self-adjoint on $C_{0}^{\infty}({\mathbb{R}}^{3},{\mathbb{C}}^{2})$. Its second quantized version $\mathrm{d}\Gamma(a)$ is a self-adjoint operator in ${\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}))$. From the definition (2.4) of the space ${\mathfrak{F}}_{\ell}$, the following operator in ${\mathfrak{F}}_{\ell}$ $A_{\ell}={\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a)\otimes{\mathbf{1}}+{\mathbf{1}}\otimes{\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a)$ is essentially self-adjoint on ${\mathfrak{D}}_{L}$. Let now $A$ be the following operator in ${\mathfrak{F}}_{L}$ $A=A_{1}\otimes{\mathbf{1}}_{2}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes A_{2}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes{\mathbf{1}}_{2}\otimes A_{3}\ .$ Then $A$ is essentially self-adjoint on ${\mathfrak{D}}_{L}$. We shall denote again by $A$ its extension to ${\mathfrak{F}}$. Thus $A$ is essentially self-adjoint on ${\mathfrak{D}}$ and we still denote by $A$ its closure. We also set $\langle A\rangle=(1+A^{2})^{\frac{1}{2}}\ .$ We then have ###### Theorem 3.4. Suppose that the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}$ satisfy Hypothesis 2.1 and 3.1. For any $\delta>0$ satisfying $0<\delta<m_{1}$ there exists $0<g_{\delta}\leq g_{2}$ such that, for $0<g\leq g_{\delta}$, $(i)$ The spectrum of $H$ in $(\inf\sigma(H),\,m_{1}-\delta]$ is purely absolutely continuous. $(ii)$ Limiting absorption principle. For every $s>1/2$ and $\varphi$, $\psi$ in ${\mathfrak{F}}$, the limits $\lim_{\varepsilon\rightarrow 0}(\varphi,\ \langle A\rangle^{-s}(H-\lambda\pm i\varepsilon)\langle A\rangle^{-s}\psi)$ exist uniformly for $\lambda$ in any compact subset of $(\inf\sigma(H),\,m_{1}-\delta]$. $(iii)$ Pointwise decay in time. Suppose $s\in(\frac{1}{2},1)$ and $f\in C_{0}^{\infty}({\mathbb{R}})$ with $\mathrm{supp}f\subset(\inf\sigma(H),\,m_{1}-\delta)$. Then $\|\langle A\rangle^{-s}\mathrm{e}^{-itH}f(H)\langle A\rangle^{-s}\|=\mathcal{O}({t^{\frac{1}{2}-s}})\ ,$ as $t\rightarrow\infty$. The proof of Theorem 3.4 is based on a positive commutator estimate, called the Mourre estimate and on a regularity property of $H$ with respect to $A$ (see [23], [3] and [25]). According to [13], the main ingredient of the proof are auxiliary operators associated with infrared cutoff Hamiltonians with respect to the momenta of the neutrinos that we now introduce. Let $\chi_{0}(.)$, $\chi_{\infty}(.)\in C^{\infty}({\mathbb{R}},[0,1])$ with $\chi_{0}=1$ on $(-\infty,1]$, $\chi_{\infty}=1$ on $[2,\infty)$ and $\chi_{0}{}^{2}+\chi_{\infty}{}^{2}=1$. For $\sigma>0$ we set (3.1) $\begin{split}&\chi_{\sigma}(p)=\chi_{0}(|p|/\sigma)\ ,\\\ &\chi^{\sigma}(p)=\chi_{\infty}(|p|/\sigma)\ ,\\\ &\tilde{\chi}^{\sigma}(p)=1-\chi_{\sigma}(p)\ ,\end{split}$ where $p\in{\mathbb{R}}^{3}$. The operator $H_{I,\sigma}$ is the interaction given by (2.10), (2.11) and (2.12) and associated with the kernels $\tilde{\chi}^{\sigma}(p_{2})G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})$. We then set $H_{\sigma}:=H_{0}+gH_{I,\sigma}\ .$ Let $\displaystyle\Sigma_{1,\sigma}=\Sigma_{1}\cap\\{(p_{2},s_{2});\ |p_{2}|<\sigma\\}\ ,$ $\displaystyle\Sigma_{1}^{\ \sigma}=\Sigma_{1}\cap\\{(p_{2},s_{2});\ |p_{2}|\geq\sigma\\}$ $\displaystyle{\mathfrak{F}}_{\ell,2,\sigma}={\mathfrak{F}}_{a}(L^{2}(\Sigma_{1,\sigma}))\otimes{\mathfrak{F}}_{a}(L^{2}(\Sigma_{1,\sigma}))\ ,$ $\displaystyle{\mathfrak{F}}_{\ell,2}^{\ \sigma}={\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}^{\ \sigma}))\otimes{\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}^{\ \sigma}))\ ,$ $\displaystyle{\mathfrak{F}}_{\ell,2}={\mathfrak{F}}_{\ell,2,\sigma}\otimes{\mathfrak{F}}_{\ell,2}^{\ \sigma}\ ,$ $\displaystyle{\mathfrak{F}}_{\ell,1}=\bigotimes^{2}{\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}))\ .$ The space ${\mathfrak{F}}_{\ell,1}$ is the Fock space for the massive leptons $\ell$ and ${\mathfrak{F}}_{\ell,2}$ is the Fock space for the neutrinos and antineutrinos $\ell$. Set $\displaystyle{\mathfrak{F}}_{\ell}^{\ \sigma}={\mathfrak{F}}_{\ell,1}\otimes{\mathfrak{F}}_{\ell,2}^{\ \sigma}\ ,$ $\displaystyle{\mathfrak{F}}_{\ell,\sigma}={\mathfrak{F}}_{\ell,2,\sigma}\ .$ We have ${\mathfrak{F}}_{\ell}\simeq{\mathfrak{F}}_{\ell}^{\ \sigma}\otimes{\mathfrak{F}}_{\ell,\sigma}\ .$ Set $\begin{split}&{\mathfrak{F}}_{L}^{\ \sigma}=\bigotimes_{\ell=1}^{3}{\mathfrak{F}}_{\ell}^{\ \sigma}\ ,\\\ &{\mathfrak{F}}_{L,\sigma}=\bigotimes_{\ell=1}^{3}{\mathfrak{F}}_{\ell,\sigma}\ .\end{split}$ We have ${\mathfrak{F}}_{L}\simeq{\mathfrak{F}}_{L}^{\ \sigma}\otimes{\mathfrak{F}}_{L,\sigma}\ .$ Set $\begin{split}&{\mathfrak{F}}^{\ \sigma}={\mathfrak{F}}_{L}^{\ \sigma}\otimes{\mathfrak{F}}_{W}\ ,\\\ \end{split}$ We have ${\mathfrak{F}}\simeq{\mathfrak{F}}_{L,\sigma}\otimes{\mathfrak{F}}^{\ \sigma}\ .$ Set $\begin{split}&H_{0}^{(1)}=\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int w_{\ell}^{(1)}(\xi_{1})\,b^{*}_{\ell,\epsilon}(\xi_{1})b_{\ell,\epsilon}(\xi_{1})\mathrm{d}\xi_{1}\ ,\\\ &H_{0}^{(2)}=\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int w_{\ell}^{(2)}(\xi_{2})\,c^{*}_{\ell,\epsilon}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ ,\\\ &H_{0}^{(3)}=\sum_{\epsilon=\pm}\int w^{(3)}(\xi_{3})a^{*}_{\epsilon}(\xi_{3})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{3}\ ,\\\ \end{split}$ and $\begin{split}&H_{0}^{(2){\ \sigma}}=\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int_{|p_{2}|>\sigma}w_{\ell}^{(2)}(\xi_{2})\,c^{*}_{\ell,\epsilon}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ ,\\\ &H_{0,\sigma}^{(2)}=\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int_{|p_{2}|\leq\sigma}w_{\ell}^{(2)}(\xi_{2})\,c^{*}_{\ell,\epsilon}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ .\end{split}$ We have on ${\mathfrak{F}}^{\ \sigma}\otimes{\mathfrak{F}}_{\sigma}$ $H_{0}^{(2)}=H_{0}^{(2)\sigma}\otimes{\mathbf{1}}_{\sigma}+{\mathbf{1}}^{\ \sigma}\otimes H_{0,\sigma}^{(2)}\ .$ Here, ${\mathbf{1}}^{\sigma}$ (resp. ${\mathbf{1}}_{\sigma}$) is the identity operator on ${\mathfrak{F}}^{\sigma}$ (resp. ${\mathfrak{F}}_{\sigma}$). Define (3.2) $H^{\sigma}=H_{\sigma}|_{{\mathfrak{F}}^{\,\sigma}}\quad\mbox{and}\quad H_{0}^{\,\sigma}=H_{0}|_{{\mathfrak{F}}^{\sigma}}\ .$ We get $H^{\sigma}=H_{0}^{(1)}+H_{0}^{(2)\,\sigma}+H_{0}^{(3)}+gH_{I,\sigma}\quad\mbox{on}\ {\mathfrak{F}}^{\,\sigma}\ ,$ and $H_{\sigma}=H^{\sigma}\otimes{\mathbf{1}}_{\sigma}+{\mathbf{1}}^{\,\sigma}\otimes H_{0,\sigma}^{(2)}\quad\mbox{on}\ {\mathfrak{F}}^{\,\sigma}\otimes{\mathfrak{F}}_{\sigma}\ .$ In order to implement the conjugate operator theory we have to show that $H^{\,\sigma}$ has a gap in its spectrum above its ground state. We now set, for $\beta>0$ and $\eta>0$, (3.3) $C_{\beta\,\eta}=\left(\frac{3}{m_{W}}(1+\frac{1}{m_{1}{}^{2}})+\frac{3\beta}{m_{W}m_{1}{}^{2}}+\frac{12\,\eta}{m_{1}{}^{2}}(1+\beta)\right)^{\frac{1}{2}}\ ,$ and (3.4) $B_{\beta\,\eta}=\left(\frac{3}{m_{W}}(1+\frac{1}{4\beta})+12(\,\eta(1+\frac{1}{4\beta})+\frac{1}{4\eta}\,)\right)^{\frac{1}{2}}\ .$ Let (3.5) $G=\left(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(.,.,.)\right)_{\alpha=1,2;\ell=1,2,3;\epsilon,\epsilon^{\prime}=\pm,\epsilon\neq\epsilon^{\prime}}$ and set (3.6) $K(G)=\left(\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2}_{L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})}\right)^{\frac{1}{2}}\ .$ Let (3.7) $\tilde{C}_{\beta\eta}=C_{\beta\eta}\left(1+\frac{g_{1}K(G)C_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\right),$ (3.8) $\tilde{B}_{\beta\eta}=\Big{(}\,1+\frac{g_{1}\,K(G)C_{\beta\eta}}{1-g_{1}\,K(G)\,C_{\beta\eta}}(\,2+\frac{g_{1}K(G)B_{\beta\eta}C_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\,)\,\Big{)}B_{\beta\eta}\ .$ Let $\tilde{K}(G)=\left(\sum_{\alpha=1,2}\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int_{\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2}}\frac{|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})|^{2}}{|p_{2}|^{2}}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\right)^{\frac{1}{2}}\ .$ Let $\delta\in{\mathbb{R}}$ be such that $0<\delta<m_{1}\ .$ We set (3.9) $\tilde{D}=\,\sup(\frac{4\Lambda\gamma}{2m_{1}-\delta},\,1)\,\tilde{K}(G)\,(\,2m_{1}\,\tilde{C}_{\beta\eta}+\tilde{B}_{\beta\eta}\,)\ ,$ where $\Lambda>m_{1}$ has been introduced in Hypothesis 3.1(iv). Let us define the sequence $(\sigma_{n})_{n\geq 0}$ by $\begin{split}&\sigma_{0}=\Lambda\ ,\\\ &\sigma_{1}=m_{1}-\frac{\delta}{2}\ ,\\\ &\sigma_{2}=m_{1}-\delta=\gamma\sigma_{1}\ ,\\\ &\sigma_{n+1}=\gamma\sigma_{n},\ n\geq 1\ ,\end{split}$ where $\gamma=1-\delta/(2m_{1}-\delta)$. Let $g_{\delta}^{(1)}$ be such that $0<g^{(1)}_{\delta}<\inf(1,g_{1},\frac{\gamma-\gamma^{2}}{3\tilde{D}})\ .$ For $0<g\leq g_{\delta}^{(1)}$ we have $0<\gamma<(1-\frac{3g\tilde{D}}{\gamma})\ ,$ and (3.10) $0<\sigma_{n+1}<(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n},\quad n\geq 1\ .$ Set $\begin{split}&H^{n}=H^{\sigma_{n}};\quad H_{0}^{n}=H_{0}^{\sigma_{n}},\quad n\geq 0\,\\\ &E^{n}=\inf\sigma(H^{n})\,,\quad n\geq 0\ .\end{split}$ We then get ###### Proposition 3.5. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1, Hypothesis 3.1(i) and 3.1(iv). Then there exists $0<\tilde{g}_{\delta}\leq g^{(1)}_{\delta}$ such that, for $g\leq\tilde{g}_{\delta}$ and $n\geq 1$, $E^{n}$ is a simple eigenvalue of $H^{n}$ and $H^{n}$ does not have spectrum in $(\,E^{n},\,E^{n}+(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n}\,)$. The proof of Proposition 3.5 is given in Appendix A. We now introduce the positive commutator estimates and the regularity property of $H$ with respect to $A$ in order to prove Theorem 3.4 The operator $A$ has to be split into two pieces depending on $\sigma$. Let $\displaystyle\eta_{\sigma}(p_{2})=\chi_{2\sigma}(p_{2})\ ,$ $\displaystyle\eta^{\sigma}(p_{2})=\chi^{2\sigma}(p_{2})\ ,$ $\displaystyle a_{\sigma}=\eta_{\sigma}(p_{2})\,a\,\eta_{\sigma}(p_{2})\ ,$ $\displaystyle a^{\sigma}=\eta^{\sigma}(p_{2})\,a\,\eta^{\sigma}(p_{2})\ .$ Since $\eta_{\sigma}^{2}+(\eta^{\sigma})^{2}=1$, and $[\eta_{\sigma},\,[\eta_{\sigma},\,a]\,]=0=[\eta^{\sigma},\,[\eta^{\sigma},\,a]\,]$, we obtain (see [13]) $a=a^{\sigma}+a_{\sigma}\ .$ Note that we also have $\displaystyle a_{\sigma}=\frac{1}{2}\left(\eta_{\sigma}(p_{2})^{2}p_{2}\cdot i\nabla p_{2}+i\nabla p_{2}.\eta_{\sigma}(p_{2})^{2}p_{2}\right)\ ,$ $\displaystyle a^{\sigma}=\frac{1}{2}\left(\eta^{\sigma}(p_{2})^{2}p_{2}\cdot i\nabla p_{2}+i\nabla p_{2}.\eta^{\sigma}(p_{2})^{2}p_{2}\right)\ .$ The operators $a$, $a_{\sigma}$ and $a^{\sigma}$ are essentially self-adjoint on $C_{0}^{\infty}({\mathbb{R}}^{3},\,{\mathbb{C}}^{2})$ (see [3, Proposition 4.2.3]). We still denote by $a$, $a_{\sigma}$ and $a^{\sigma}$ their closures. If $\tilde{a}$ denotes any of the operator $a$, $a_{\sigma}$ and $a^{\sigma}$, we have ${\mathcal{D}}(\tilde{a})=\\{\ u\in L^{2}(\Sigma_{1});\ \tilde{a}u\in L^{2}(\Sigma_{1})\ \\}\ .$ The operators $\mathrm{d}\Gamma(a)$, $\mathrm{d}\Gamma(a^{\sigma})$, $\mathrm{d}\Gamma(a_{\sigma})$ are self-adjoint operators in ${\mathfrak{F}}_{a}(L^{2}(\Sigma_{1}))$ and we have $\mathrm{d}\Gamma(a)=\mathrm{d}\Gamma(a^{\sigma})+\mathrm{d}\Gamma(a_{\sigma})\ .$ By (2.4), the following operators in ${\mathfrak{F}}_{\ell}$, denoted by $A_{\ell}^{\,\sigma}$ and $A_{\sigma\ell}$ respectively, $A_{\ell}^{\,\sigma}={\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a^{\sigma})\otimes{\mathbf{1}}+{\mathbf{1}}\otimes{\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a^{\sigma})\ ,$ $A_{\sigma\ell}={\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a_{\sigma})\otimes{\mathbf{1}}+{\mathbf{1}}\otimes{\mathbf{1}}\otimes{\mathbf{1}}\otimes\mathrm{d}\Gamma(a_{\sigma})\ ,$ are essentially self-adjoint on ${\mathfrak{D}}_{\ell}$. Let $A^{\sigma}$ and $A_{\sigma}$ be the following two operators in ${\mathfrak{F}}_{L}$, $A^{\sigma}=A_{1}^{\,\sigma}\otimes{\mathbf{1}}_{2}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes A_{2}^{\,\sigma}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes{\mathbf{1}}_{2}\otimes A_{3}^{\,\sigma}\ ,$ $A_{\sigma}=A_{\sigma 1}\otimes{\mathbf{1}}_{2}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes A_{\sigma 2}\otimes{\mathbf{1}}_{3}+{\mathbf{1}}_{1}\otimes{\mathbf{1}}_{2}\otimes A_{\sigma 3}.$ The operators $A^{\sigma}$ and $A_{\sigma}$ are essentially self-adjoint on ${\mathfrak{D}}_{L}$. Still denoting by $A^{\sigma}$ and $A_{\sigma}$ their extensions to ${\mathfrak{F}}$, $A^{\sigma}$ and $A_{\sigma}$ are essentially self-adjoint on ${\mathfrak{D}}$ and we still denote by $A^{\sigma}$ and $A_{\sigma}$ their closures. We have $A=A^{\sigma}+A_{\sigma}\ .$ The operators $a$, $a^{\sigma}$ and $a_{\sigma}$ are associated to the following $C^{\infty}$-vector fields in ${\mathbb{R}}^{3}$ respectively, (3.11) $\begin{split}&v(p_{2})=p_{2}\ ,\\\ &v^{\sigma}(p_{2})=\eta^{\sigma}(p_{2})^{2}p_{2}\ ,\\\ &v_{\sigma}(p_{2})=\eta_{\sigma}(p_{2})^{2}p_{2}\ .\end{split}$ Let ${\mathcal{V}}(p)$ be any of these vector fields. We have $|{\mathcal{V}}(p)|\leq\Gamma\,|p|\ ,$ for some $\Gamma>0$ and we also have (3.12) ${\mathcal{V}}(p)=\tilde{v}(|p|)p\ ,$ where the $\tilde{v}$’s are defined by (3.11) and (3.12), and fulfill $|p|^{\alpha}\frac{\mathrm{d}^{\alpha}}{\mathrm{d}|p|^{\alpha}}\tilde{v}(|p|)$ bounded for $\alpha=0,1,2$. Let $\psi_{t}(.):\,{\mathbb{R}}^{3}\rightarrow{\mathbb{R}}^{3}$ be the corresponding flow generated by ${\mathcal{V}}$: $\begin{split}&\frac{\mathrm{d}}{\mathrm{d}t}\psi_{t}(p)={\mathcal{V}}(\psi_{t}(p))\ ,\\\ &\psi_{0}(p)=p\ .\end{split}$ $\psi_{t}(p)$ is a $C^{\infty}$-flow and we have (3.13) $\mathrm{e}^{-\Gamma|t|}\,|p|\leq|\psi_{t}(p)|\leq\mathrm{e}^{\Gamma|t|}\,|p|\ .$ $\psi_{t}(p)$ induces a one-parameter group of unitary operators $U(t)$ in $L^{2}(\Sigma_{1})\simeq L^{2}({\mathbb{R}}^{3},\,{\mathbb{C}}^{2})$ defined by $(U(t)f)(p)=f(\psi_{t}(p))(\det\nabla\psi_{t}(p))^{\frac{1}{2}}$ Let $\phi_{t}(.)$, $\phi^{\,\sigma}_{t}(.)$ and $\phi_{\sigma t}(.)$ be the flows associated with the vector fields $v(.)$, $v^{\sigma}(.)$ and $v_{\sigma}(.)$ respectively. Let $U(t)$, $U^{\sigma}(t)$ and $U_{\sigma}(t)$ be the corresponding one- parameter groups of unitary operators in $L^{2}(\Sigma_{1})$. The operators $a$, $a^{\sigma}$, and $a_{\sigma}$ are the generators of $U(t)$, $U^{\sigma}(t)$ and $U_{\sigma}(t)$ respectively, i.e., $\begin{split}&U(t)=\mathrm{e}^{-iat}\ ,\\\ &U^{\sigma}(t)=\mathrm{e}^{-ia^{\sigma}t}\ ,\\\ &U_{\sigma}(t)=\mathrm{e}^{-ia_{\sigma}t}\ .\end{split}$ Let $w^{(2)}(\xi_{2})=(w^{(2)}_{\ell}(\xi_{2}))_{\ell=1,2,3}$ and $\mathrm{d}\Gamma(w^{(2)})=\sum_{\ell=1}^{3}\sum_{\epsilon}\int w^{(2)}_{\ell}(\xi_{2})c_{\ell,\epsilon}^{*}(\xi_{2})c_{\ell\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ .$ Let $V(t)$ be any of the one-parameter groups $U(t)$, $U^{\sigma}(t)$ and $U_{\sigma}(t)$. We set $V(t)w^{(2)}V(t)^{*}=(V(t)w_{\ell}^{(2)}V(t)^{*})_{\ell=1,2,3}\ ,$ and we have $V(t)w^{(2)}V(t)^{*}=w^{(2)}(\psi_{t})\ .$ Here $\psi_{t}$ is the flow associated to $V(t)$. This yields, for any $\varphi\in{\mathfrak{D}}$, (see [9, Lemma 2.8]) (3.14) $\begin{split}\mathrm{e}^{-iAt}H_{0}\mathrm{e}^{iAt}\varphi- H_{0}\varphi&=(\mathrm{d}\Gamma(\mathrm{e}^{-iat}w^{(2)}\mathrm{e}^{iat})-\mathrm{d}\Gamma(w^{(2)}))\varphi\\\ &=(\mathrm{d}\Gamma(w^{(2)}\circ\phi_{t}-w^{(2)}))\varphi\ ,\end{split}$ (3.15) $\begin{split}\mathrm{e}^{-iA^{\sigma}t}H_{0}\mathrm{e}^{iA^{\sigma}t}\varphi- H_{0}\varphi&=(\mathrm{d}\Gamma(\mathrm{e}^{-ia^{\sigma}t}w^{(2)}\mathrm{e}^{ia^{\sigma}t})-\mathrm{d}\Gamma(w^{(2)}))\varphi\\\ &=(\mathrm{d}\Gamma(w^{(2)}\circ\phi_{t}^{\,\sigma}-w^{(2)}))\varphi\ ,\end{split}$ (3.16) $\begin{split}\mathrm{e}^{-iA_{\sigma}t}H_{0}\mathrm{e}^{iA_{\sigma}t}\varphi- H_{0}\varphi&=(\mathrm{d}\Gamma(\mathrm{e}^{-ia_{\sigma}t}w^{(2)}\mathrm{e}^{ia_{\sigma}t})-\mathrm{d}\Gamma(w^{(2)}))\varphi\\\ &=(\mathrm{d}\Gamma(w^{(2)}\circ\phi_{\sigma t}-w^{(2)}))\varphi\ .\end{split}$ ###### Proposition 3.6. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1. For every $t\in{\mathbb{R}}$ we have, for $g\leq g_{1}$, $\begin{split}(i)&\quad\mathrm{e}^{itA}{\mathcal{D}}(H_{0})=\mathrm{e}^{itA}{\mathcal{D}}(H)\subset{\mathcal{D}}(H_{0})={\mathcal{D}}(H)\ ,\\\ (ii)&\quad\mathrm{e}^{itA^{\sigma}}{\mathcal{D}}(H_{0})=\mathrm{e}^{itA^{\sigma}}{\mathcal{D}}(H)\subset{\mathcal{D}}(H_{0})={\mathcal{D}}(H)\ ,\\\ (iii)&\quad\mathrm{e}^{itA_{\sigma}}{\mathcal{D}}(H_{0})=\mathrm{e}^{itA_{\sigma}}{\mathcal{D}}(H)\subset{\mathcal{D}}(H_{0})={\mathcal{D}}(H)\ .\end{split}$ ###### Proof. We only prove $i)$, since $ii)$ and $iii)$ can be proved similarly. By (3.14) we have, for $\varphi\in{\mathfrak{D}}$, (3.17) $\mathrm{e}^{-itA}H_{0}\mathrm{e}^{itA}\varphi=(H_{0}^{(1)}+H_{0}^{(3)}+\mathrm{d}\Gamma(w^{(2)}\circ\phi_{t}))\varphi\ .$ It follows from (3.13) and (3.17) that $\|H_{0}\mathrm{e}^{itA}\varphi\|\leq\mathrm{e}^{\Gamma|t|}\|H_{0}\varphi\|\ .$ This yields $i)$ because ${\mathfrak{D}}$ is a core for $H_{0}$. Moreover we get $\|H_{0}\mathrm{e}^{itA}(H_{0}+1)^{-1}\|\leq\mathrm{e}^{\Gamma|t|}\ .$ In view of ${\mathfrak{D}}(H_{0})={\mathfrak{D}}(H)$, the operators $H_{0}(H+i)^{-1}$ and $H(H_{0}+i)^{-1}$ are bounded and there exists a constant $C>0$ such that $\|H\mathrm{e}^{itA}(H+i)^{-1}\|\leq C\mathrm{e}^{\Gamma|t|}\ .$ Similarly, we also get $\begin{split}&\|H_{0}\mathrm{e}^{itA^{\sigma}}(H_{0}+1)^{-1}\|\leq\mathrm{e}^{\Gamma|t|}\ ,\\\ &\|H_{0}\mathrm{e}^{itA_{\sigma}}(H_{0}+1)^{-1}\|\leq\mathrm{e}^{\Gamma|t|}\ ,\\\ &\|H\mathrm{e}^{itA^{\sigma}}(H+i)^{-1}\|\leq C\mathrm{e}^{\Gamma|t|}\ ,\\\ &\|H\mathrm{e}^{itA_{\sigma}}(H+i)^{-1}\|\leq C\mathrm{e}^{\Gamma|t|}\ .\end{split}$ ∎ Let $H_{I}(G)$ be the interaction associated with the kernels $G=(G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)})_{\alpha=1,2;\ \ell=1,2,3;\ \epsilon\neq\epsilon^{\prime}=\pm}$, where the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)})$ satisfy Hypothesis 2.1 We set $V(t)G=(V(t)G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)})_{\alpha=1,2;\ \ell=1,2,3;\ \epsilon\neq\epsilon^{\prime}=\pm}$ We have for $\varphi\in{\mathfrak{D}}$ (see [9, Lemma 2.7]), (3.18) $\begin{split}&\mathrm{e}^{-iAt}H_{I}(G)\mathrm{e}^{iAt}\varphi=H_{I}(\mathrm{e}^{-iat}G)\varphi\ ,\\\ &\mathrm{e}^{-iA^{\sigma}t}H_{I}(G)\mathrm{e}^{iA^{\sigma}t}\varphi=H_{I}(\mathrm{e}^{-ia^{\sigma}t}G)\varphi\ ,\\\ &\mathrm{e}^{-iA_{\sigma}t}H_{I}(G)\mathrm{e}^{iA_{\sigma}t}\varphi=H_{I}(\mathrm{e}^{-ia_{\sigma}t}G)\varphi\ .\end{split}$ According to [3] and [25], in order to prove Theorem 3.4 we must prove that $H$ is locally of class $C^{2}(A^{\sigma})$, $C^{2}(A_{\sigma})$ and $C^{2}(A)$ in $(-\infty,m_{1}-\frac{\delta}{2})$ and that $A$ and $A_{\sigma}$ are locally strictly conjugate to $H$ in $(E,m_{1}-\frac{\delta}{2})$. Recall that $H$ is locally of class $C^{2}(A)$ in $(-\infty,m_{1}-\frac{\delta}{2})$ if, for any $\varphi\in C_{0}^{\infty}((-\infty,m_{1}-\frac{\delta}{2}))$, $\varphi(H)$ is of class $C^{2}(A)$, i.e., $t\rightarrow\mathrm{e}^{-iAt}\varphi(H)\mathrm{e}^{itA}\psi$ is twice continuously differentiable for all $\varphi\in C_{0}^{\infty}((-\infty,m_{1}-\frac{\delta}{2})$ and all $\psi\in{\mathfrak{F}}$. Thus, one of our main results is the following one ###### Theorem 3.7. Suppose that the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}$ satisfy Hypothesis 2.1 and 3.1(i)-(iii). * (a) $H$ is locally of class $C^{2}(A)$, $C^{2}(A^{\sigma})$ and $C^{2}(A_{\sigma})$ in $(-\infty,m_{1}-{\delta}/{2})$. * (b) $H^{\sigma}$ is locally of class $C^{2}(A^{\sigma})$ in $(-\infty,m_{1}-{\delta}/{2})$. It follows from Theorem 3.7 that $[H,\,iA]$, $[H,\,iA_{\sigma}]$, $[H,\,iA^{\sigma}]$ and $[H^{\sigma},\,iA^{\sigma}]$ are defined as sesquilinear forms on $\cup_{K}E_{K}(H){\mathfrak{F}}$, where the union is taken over all the compact subsets $K$ of $(-\infty,m_{1}-\delta/2)$. Furthermore, by Proposition 3.6, Theorem 3.7 and [13, Lemma 29], we get for all $\varphi\in C_{0}^{\infty}((E,m_{1}-\delta/2))$ and all $\psi\in{\mathfrak{F}}$, (3.19) $\begin{split}&\varphi(H)\,[H,\,iA]\,\varphi(H)\,\psi=\lim_{t\rightarrow 0}\varphi(H)\,\big{[}H,\,\frac{\mathrm{e}^{itA}-1}{t}\big{]}\,\varphi(H)\,\psi\ ,\\\ &\varphi(H)\,[H,\,iA_{\sigma}]\,\varphi(H)\,\psi=\lim_{t\rightarrow 0}\varphi(H)\,\big{[}H,\,\frac{\mathrm{e}^{itA_{\sigma}}-1}{t}\big{]}\,\varphi(H)\,\psi\ ,\\\ &\varphi(H)\,[H,\,iA^{\sigma}]\,\varphi(H)\,\psi=\lim_{t\rightarrow 0}\varphi(H)\,\big{[}H,\,\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}\,\varphi(H)\,\psi\ ,\\\ &\varphi(H^{\sigma})\,[H^{\sigma},\,iA^{\sigma}]\,\varphi(H^{\sigma})\,\psi=\lim_{t\rightarrow 0}\varphi(H^{\sigma})\,\big{[}H^{\sigma},\,\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}\,\varphi(H^{\sigma})\,\psi\ .\\\ \end{split}$ The following proposition allows us to compute $[H,\,iA]$, $[H,\,iA^{\sigma}]$, $[H,\,iA_{\sigma}]$ and $[H^{\sigma},\,iA^{\sigma}]$ as sesquilinear forms. By Hypothesis 2.1 and 3.1 (iii.a), the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}(\xi_{1},.,\xi_{3})$ belong to the domains of $a$, $a^{\sigma}$, and $a_{\sigma}$. ###### Proposition 3.8. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and 3.1 (iii.a). Then * (a) For all $\psi\in{\mathcal{D}}(H)$ we have * $(i)$ $\lim_{t\rightarrow 0}\big{[}H,\frac{\mathrm{e}^{itA}-1}{t}\big{]}\psi=\big{(}\,\mathrm{d}\Gamma(w^{(2)})+gH_{I}(-iaG)\,\big{)}\psi$, * $(ii)$ $\lim_{t\rightarrow 0}\big{[}H,\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}\psi=\big{(}\,\mathrm{d}\Gamma((\eta^{\sigma})^{2}w^{(2)})+gH_{I}(-ia^{\sigma}G)\,\big{)}\psi$, * $(iii)$ $\lim_{t\rightarrow 0}\big{[}H,\frac{\mathrm{e}^{itA_{\sigma}}-1}{t}\big{]}\psi=\big{(}\,\mathrm{d}\Gamma((\eta_{\sigma})^{2}w^{(2)})+gH_{I}(-ia_{\sigma}G)\,\big{)}\psi$, * $(iv)$ $\lim_{t\rightarrow 0}\big{[}H^{\sigma},\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}\psi=\big{(}\,\mathrm{d}\Gamma((\eta^{\sigma})^{2}w^{(2)})+gH_{I}(-ia^{\sigma}(\tilde{\chi}^{\sigma}(p_{2})G))\,\big{)}\psi$. * (b) * $(i)$ $\sup_{0<|t|\leq 1}\big{\|}\big{[}H,\frac{\mathrm{e}^{itA}-1}{t}\big{]}(H+i)^{-1}\big{\|}<\infty$, * $(ii)$ $\sup_{0<|t|\leq 1}\big{\|}\big{[}H,\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}(H+i)^{-1}\big{\|}<\infty$, * $(iii)$ $\sup_{0<|t|\leq 1}\big{\|}\big{[}H,\frac{\mathrm{e}^{itA_{\sigma}}-1}{t}\big{]}(H+i)^{-1}\big{\|}<\infty$, * $(iv)$ $\sup_{0<|t|\leq 1}\big{\|}\big{[}H^{\sigma},\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}(H+i)^{-1}\big{\|}<\infty$. ###### Proof. Part $\mathrm{(b)}$ follows from part $\mathrm{(a)}$ by the uniform boundedness principle. For part $\mathrm{(a)}$, we only prove $\mathrm{(a)}$(i), since other statements can be proved similarly. By (3.13), we obtain $\frac{1}{|t|}\big{|}w_{\ell}^{(2)}(\phi_{t}(p_{2}))-w_{\ell}^{(2)}(p_{2})\big{|}\leq\frac{1}{|t|}\big{(}\mathrm{e}^{\Gamma\,|t|}-1\big{)}w_{\ell}^{(2)}(p_{2})\ ,$ for $\ell=1,2,3$. By (3.14)-(3.16) and the Lebesgue’s Theorem we then get for all $\psi\in{\mathcal{D}}(H_{0})$ $\begin{split}&\lim_{t\rightarrow 0}\big{[}H_{0},\frac{\mathrm{e}^{itA}-1}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA}H_{0}\mathrm{e}^{itA}-H_{0}\big{]}\psi=\mathrm{d}\Gamma(w^{(2)})\psi\ ,\\\ &\lim_{t\rightarrow 0}\big{[}H_{0},\frac{\mathrm{e}^{itA^{\sigma}}-1}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA^{\sigma}}H_{0}\mathrm{e}^{itA^{\sigma}}-H_{0}\big{]}\psi=\mathrm{d}\Gamma((\eta^{\sigma})^{2}w^{(2)})\psi\ ,\\\ &\lim_{t\rightarrow 0}\big{[}H_{0},\frac{\mathrm{e}^{itA_{\sigma}}-1}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA_{\sigma}}H_{0}\mathrm{e}^{itA_{\sigma}}-H_{0}\big{]}\psi=\mathrm{d}\Gamma((\eta_{\sigma})^{2}w^{(2)})\psi\ .\end{split}$ By (3.18), we obtain for all $\psi\in{\mathcal{D}}(H)$, $\begin{split}&\lim_{t\rightarrow 0}\big{[}H_{I}(G),\frac{\mathrm{e}^{itA}\\!-1\\!}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA}H_{I}(G)\mathrm{e}^{itA}-H_{I}(G)\big{]}\psi=H_{I}(-i(a\,G))\psi,\\\ &\lim_{t\rightarrow 0}\big{[}H_{I}(G),\frac{\mathrm{e}^{itA^{\sigma}}\\!-\\!1}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA^{\sigma}}H_{I}(G)\mathrm{e}^{itA^{\sigma}}-H_{I}(G)\big{]}\psi=H_{I}(-i(a^{\sigma}G))\psi,\\\ &\lim_{t\rightarrow 0}\big{[}H_{I}(G),\frac{\mathrm{e}^{itA_{\sigma}}\\!-\\!1}{t}\big{]}\psi=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA_{\sigma}}H_{I}(G)\mathrm{e}^{itA_{\sigma}}-H_{I}(G)\big{]}\psi=H_{I}(-i(a_{\sigma}G))\psi,\\\ &\lim_{t\rightarrow 0}\big{[}H_{I}(\tilde{\chi}^{\sigma}(p_{2})G),\frac{\mathrm{e}^{itA^{\sigma}}\\!-\\!1}{t}\big{]}\psi\\\ &=\lim_{t\rightarrow 0}\frac{1}{t}\big{[}\mathrm{e}^{-itA^{\sigma}}H_{I}(\tilde{\chi}^{\sigma}(p_{2})G)\mathrm{e}^{itA^{\sigma}}-H_{I}(\tilde{\chi}^{\sigma}(p_{2})G)\big{]}\psi=H_{I}(-i(a^{\sigma}(\tilde{\chi}^{\sigma}(p_{2})G)))\psi\ .\end{split}$ This concludes the proof of Proposition 3.8. ∎ Combining (3.19) with Proposition 3.8, we finally get for every $\varphi\in C_{0}^{\infty}((-\infty,m_{1}-\delta/2))$ and every $\psi\in{\mathfrak{F}}$ (3.20) $\varphi(H)\big{[}H,\,iA\big{]}\varphi(H)\psi=\varphi(H)\big{[}\mathrm{d}\Gamma(w^{(2)})+gH_{I}(-i(a\,G))\big{]}\varphi(H)\psi\ ,$ (3.21) $\varphi(H)\big{[}H,\,iA^{\sigma}\big{]}\varphi(H)\psi=\varphi(H)\big{[}\mathrm{d}\Gamma((\eta^{\sigma})^{2}w^{(2)})+gH_{I}(-i(a^{\sigma}G))\big{]}\varphi(H)\psi\ ,$ (3.22) $\varphi(H)\big{[}H,\,iA_{\sigma}\big{]}\varphi(H)\psi=\varphi(H)\big{[}\mathrm{d}\Gamma((\eta_{\sigma})^{2}w^{(2)})+gH_{I}(-i(a_{\sigma}G))\big{]}\varphi(H)\psi\ ,$ and (3.23) $\varphi(H^{\sigma})\big{[}H^{\sigma},\,iA^{\sigma}\big{]}\varphi(H^{\sigma})\psi=\varphi(H^{\sigma})\big{[}\mathrm{d}\Gamma((\eta^{\sigma})^{2}w^{(2)})+gH_{I}(-i(a^{\sigma}(\tilde{\chi}^{\sigma}G)))\big{]}\varphi(H^{\sigma})\psi\ .$ We now introduce the Mourre inequality. Let $N$ be the smallest integer such that $N\gamma\geq 1.$ We have, for $g\leq g^{(1)}_{\delta}$, (3.24) $\begin{split}&\gamma<\gamma+\frac{1}{N}(1-\frac{3g\tilde{D}}{\gamma}-\gamma)<1-\frac{3g\tilde{D}}{\gamma}\ ,\\\ &\frac{\gamma}{N}\leq\gamma-\frac{1}{N}(1-\frac{3g\tilde{D}}{\gamma}-\gamma)<\gamma\ .\end{split}$ Let $\epsilon_{\gamma}=\frac{1}{2N}(1-\frac{3g_{\delta}^{(1)}\tilde{D}}{\gamma}-\gamma)\ .$ We choose $f\in C_{0}^{\infty}({\mathbb{R}})$ such that $1\geq f\geq 0$ and (3.25) $f(\lambda)=\left\\{\begin{array}[]{ll}1&\mbox{ if }\lambda\in[(\gamma-\epsilon_{\gamma})^{2},\gamma+\epsilon_{\gamma}]\ ,\\\ 0&\mbox{ if }\lambda>\gamma+\frac{1}{N}(1-\frac{3g_{\delta}^{(1)}\tilde{D}}{\gamma}-\gamma)=\gamma+2\epsilon_{\gamma}\ ,\\\ 0&\mbox{ if }\lambda<(\gamma-\frac{1}{N}(1-\frac{3g_{\delta}^{(1)}\tilde{D}}{\gamma}-\gamma))^{2}=(\gamma-2\epsilon_{\gamma})^{2}\ .\end{array}\right.$ Note that $\gamma+2\epsilon_{\gamma}<1-3g\tilde{D}/\gamma$ for $g\leq g_{\delta}^{(1)}$ and $\gamma-\epsilon_{\gamma}>\gamma/N$. We set, for $n\geq 1$, $f_{n}(\lambda)=f\left(\frac{\lambda}{\sigma_{n}}\right)\ .$ Let $\begin{split}&H_{n}=H_{\sigma_{n}}\ ,\\\ &E_{n}=\inf\sigma(H_{n})\ ,\\\ &H_{0\,n}^{(2)}=H_{0\,\sigma_{n}}^{(2)}\ .\end{split}$ Let $P^{n}$ denote the ground state projection of $H^{n}$. It follows from proposition 3.5 that, for $n\geq 1$ and $g\leq\tilde{g}_{\delta}\leq g_{\delta}^{(1)}$, (3.26) $f_{n}(H_{n}-E_{n})=P^{n}\otimes f_{n}(H_{0,\,n}^{(2)})\ .$ Note that (3.27) $E_{n}=E^{n}=\inf\sigma(H^{n})\ .$ Set $\begin{split}&a^{n}=a^{\sigma_{n}}\ ,\\\ &a_{n}=a_{\sigma_{n}}\ ,\\\ &A^{n}=A^{\sigma_{n}}\ ,\\\ &A_{n}=A_{\sigma_{n}}\ ,\\\ &{\mathfrak{F}}^{n}={\mathfrak{F}}^{\sigma_{n}}\ ,\\\ &{\mathfrak{F}}_{n}={\mathfrak{F}}_{\sigma_{n}}\ .\end{split}$ We have $\begin{split}&{\mathfrak{F}}\simeq{\mathfrak{F}}^{n}\otimes{\mathfrak{F}}_{n}\ ,\\\ &A=A^{n}+A_{n}\ .\end{split}$ We further note that (3.28) $a^{n}\tilde{\chi}^{\sigma_{n}}(p_{2})=a^{n}\ .$ By (3.21), (3.23) and (3.28), we obtain $[H,iA^{n}]=[H^{n},iA^{n}]\otimes{\mathbf{1}}\ ,$ as sesquilinear forms with respect to ${\mathfrak{F}}={\mathfrak{F}}^{n}\otimes{\mathfrak{F}}_{n}$. Furthermore, it follows from the virial Theorem (see [25, Proposition 3.2] and Proposition 6.1) that (3.29) $P^{n}[H^{n},iA^{n}]P^{n}=0\ .$ By (3.26) and (3.29) we then get, for $g\leq\tilde{g}_{\delta}\leq g_{\delta}^{(1)}$, $f_{n}(H_{n}-E_{n})[H,iA^{n}]f_{n}(H_{n}-E_{n})=0\ .$ We then have ###### Proposition 3.9. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and 3.1. Then there exists $\tilde{C}_{\delta}>0$ and $\tilde{g}_{\delta}^{(1)}>0$ such that $\tilde{g}_{\delta}^{(1)}\leq\tilde{g}_{\delta}$ and $f_{n}(H_{n}-E_{n})[H,iA_{n}]f_{n}(H_{n}-E_{n})\geq\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}f_{n}(H_{n}-E_{n})^{2}$ for $n\geq 1$ and $g\leq\tilde{g}_{\delta}^{(1)}$. Let $E_{\Delta}(H-E)$ be the spectral projection for the operator $H-E$ associated with the interval $\Delta$, and let (3.30) $\Delta_{n}=[(\gamma-\epsilon_{\gamma})^{2}\sigma_{n},\,(\gamma+\epsilon_{\gamma})\sigma_{n}],\ n\geq 1\ .$ Note that (3.31) $[\sigma_{n+2},\sigma_{n+1}]\subset\left((\gamma-\epsilon_{\gamma})^{2}\sigma_{n},\,(\gamma+\epsilon_{\gamma})\sigma_{n}\right),\ n\geq 1\ .$ ###### Theorem 3.10. Suppose that the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}$ satisfy Hypothesis 2.1 and 3.1. Then there exists $C_{\delta}>0$ and $\tilde{g}_{\delta}^{(2)}>0$ such that $\tilde{g}_{\delta}^{(2)}\leq\tilde{g}_{\delta}^{(1)}$ and $E_{\Delta_{n}}(H-E)[H,\,iA]E_{\Delta_{n}}(H-E)\geq C_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}E_{\Delta_{n}}(H-E)\ ,$ for $n\geq 1$ and $g\leq\tilde{g}_{\delta}^{(2)}$. ## 4\. Existence of a ground state and location of the absolutely continuous spectrum We now prove Theorem 3.3. The scheme of the proof is quite well known (see [5], [20]). It follows from Proposition 3.5 that $H^{n}$ has an unique ground state, denoted by $\phi^{n}$, in ${\mathfrak{F}}^{n}$, $H^{n}\phi^{n}=E^{n}\phi^{n},\quad\phi^{n}\in{\mathcal{D}}(H^{n}),\quad\|\phi^{n}\|=1,\quad n\geq 1\ .$ Therefore $H_{n}$ has an unique normalized ground state in ${\mathfrak{F}}$, given by $\tilde{\phi}_{n}=\phi^{n}\otimes\Omega_{n}$, where $\Omega_{n}$ is the vacuum state in ${\mathfrak{F}}_{n}$, $H_{n}\tilde{\phi}_{n}=E^{n}\tilde{\phi}_{n},\quad\tilde{\phi}_{n}\in{\mathcal{D}}(H_{n}),\quad\|\tilde{\phi}_{n}\|=1,\quad n\geq 1\ .$ Since $\|\tilde{\phi}_{n}\|=1$, there exists a subsequence $(n_{k})_{k\geq 1}$, converging to $\infty$ such that $(\tilde{\phi}_{n_{k}})_{k\geq 1}$ converges weakly to a state $\tilde{\phi}\in{\mathfrak{F}}$. We have to prove that $\tilde{\phi}\neq 0$. By adapting the proof of Theorem 4.1 in [2] (see also [7]), the key point is to estimate $\|c_{\ell,\epsilon}(\xi_{2})\tilde{\Phi}_{n}\|_{{\mathfrak{F}}}$ in order to show that (4.1) $\sum_{\ell=1}^{3}\sum_{\epsilon}\int\|c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}\|^{2}\mathrm{d}\xi_{2}=\mathcal{O}(g^{2})\ ,$ uniformly with respect to $n$. The estimate (4.1) is a consequence of the so-called “pull-through” formula as it follows. Let $H_{I_{,}n}$ denote the interaction $H_{I}$ associated with the kernels ${\mathbf{1}}_{\\{|p_{2}|\geq\sigma_{n}\\}}(p_{2})G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$. We thus have $\begin{split}&H_{0}c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}=c_{\ell,\epsilon}(\xi_{2})H_{0}\tilde{\phi}_{n}-w_{\ell}^{(2)}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}\\\ &gH_{I,n}c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}=c_{\ell,\epsilon}(\xi_{2})gH_{I,n}\tilde{\phi}_{n}+gV_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{2})\tilde{\phi}_{n}\ ,\end{split}$ with $\begin{split}V_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{2})=&g\int G^{(1)}_{\ell,\epsilon^{\prime}\epsilon}(\xi_{2},\xi_{2},\xi_{3})b_{\ell,\epsilon^{\prime}}^{*}(\xi_{1})a_{\epsilon}(\xi_{3})\mathrm{d}\xi_{1}\,\mathrm{d}\xi_{3}\\\ &+g\int G^{(2)}_{\ell,\epsilon^{\prime}\epsilon}(\xi_{2},\xi_{2},\xi_{3})b_{\ell,\epsilon^{\prime}}^{*}(\xi_{1})a_{\epsilon}^{*}(\xi_{3})\mathrm{d}\xi_{1}\,\mathrm{d}\xi_{3}\ .\end{split}$ This yields (4.2) $\left(H_{n}-E_{n}+w_{\ell}^{(2)}(\xi_{2})\right)c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}=V_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{2})\tilde{\phi}_{n}\ .$ By adapting the proof of Propositions 2.4 and 2.5 we easily get (4.3) $\begin{split}\|V_{\ell,\epsilon,\epsilon^{\prime}}\psi\|_{{\mathfrak{F}}}&\leq\frac{g}{m_{W}{}^{\frac{1}{2}}}\left(\sum_{\alpha=1,2}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(.,\xi_{2},.)\|_{L^{2}(\Sigma_{1}\times\Sigma_{2})}\right)\|H_{0}^{\frac{1}{2}}\psi\|\\\ &+g\,\|G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(.,\xi_{2},.)\|_{L^{2}(\Sigma_{1}\times\Sigma_{2})}\|\psi\|\ ,\end{split}$ where $\psi\in{\mathcal{D}}(H_{0})$. Let us estimate $\|H_{0}\tilde{\phi}_{n}\|$. By (2.29), (2.30), (3.3), (3.4) and (3.6) we have $g\|H_{I,n}\tilde{\phi}_{n}\|\leq gK(G)(C_{\beta\eta}\|H_{0}\tilde{\phi}_{n}\|+B_{\beta\eta})$ and $\|H_{0}\tilde{\phi}_{n}\|\leq|E_{n}|+g\|H_{I,n}\tilde{\phi}_{n}\|\ .$ Therefore (4.4) $\|H_{0}\tilde{\phi}_{n}\|\leq\frac{|E_{n}|}{1-g_{1}K(G)C_{\beta\eta}}+\frac{gK(G)B_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\ .$ By (3.27), (A.3) and (4.4), there exists $C>0$ such that (4.5) $\|H_{0}\tilde{\phi}_{n}\|\leq C\ ,$ uniformly in $n$ and $g\leq g_{1}$. By (4.2), (4.3) and (4.5) we get $\|c_{\ell,\epsilon}\tilde{\phi}_{n}\|\leq\frac{g}{|p_{2}|}\left(C^{\frac{1}{2}}\left(\sum_{\alpha=1}^{2}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(.,\xi_{2},.)\|_{L^{2}(\Sigma_{1}\times\Sigma_{2})}\right)+\|G^{(2)}_{\ell,\epsilon,\epsilon^{\prime}}(.,\xi_{2},.)\|_{L^{2}(\Sigma_{1}\times\Sigma_{2})}\right)$ By Hypothesis 3.1(i), there exists a constant $C(G)>0$ depending on the kernels $G=(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})_{\ell=1,2,3;\alpha=1,2;\epsilon\neq\epsilon^{\prime}=\pm}$ and such that $\sum_{\ell=1}^{3}\sum_{\epsilon}\int\|c_{\ell,\epsilon}(\xi_{2})\tilde{\phi}_{n}\|^{2}\mathrm{d}\xi_{2}\leq C(G)^{2}g^{2}\ .$ The existence of a ground state $\tilde{\phi}$ for $H$ follows by choosing $g$ sufficiently small, i.e. $g\leq g_{2}$, as in [2] and [7]. By adapting the method developed in [19] (see [19, Corollary 3.4]), one proves that the ground state of $H$ is unique. We omit here the details. Statements about $\sigma(H)$ are consequences of the existence of a ground state and follows from the existence of asymptotic Fock representations for the CAR associated with the $c_{\ell,\epsilon}^{\sharp}(\xi_{2})$’s. For $f\in L^{2}({\mathbb{R}}^{3},\,{\mathbb{C}}^{2})$, we define on ${\mathcal{D}}(H_{0})$ the operators $c_{\ell,\epsilon}^{\sharp\,t}(f)=\mathrm{e}^{itH}\mathrm{e}^{-itH_{0}}c_{\ell,\epsilon}^{\sharp}(f)\mathrm{e}^{itH_{0}}\mathrm{e}^{{}_{i}tH}\ .$ By mimicking the proof given in [20, 28] one proves, under the hypothesis of Theorem 3.3 and for $f\in C_{0}^{\infty}({\mathbb{R}}^{3}\,{\mathbb{C}}^{2})$, that the strong limits of $c_{\ell,\epsilon}^{\sharp\,t}(f)$ when $t\rightarrow\pm\infty$ exist for $\psi\in{\mathcal{D}}(H_{0})$, (4.6) $\lim_{t\rightarrow\pm\infty}c_{\ell,\epsilon}^{\sharp\,t}(f)\psi:=c_{\ell,\epsilon}^{\sharp\,\pm}(f)\psi\ .$ The operators $c_{\ell,\epsilon}^{\sharp\,\pm}(f)$ satisfy the CAR and we have (4.7) $c_{\ell,\epsilon}^{\,\pm}(f)\tilde{\phi}=0,\quad f\in C_{0}^{\infty}({\mathbb{R}}^{3}\,{\mathbb{C}}^{2})\,,$ where $\tilde{\phi}$ is the ground state of $H$. It then follows from (4.6) and (4.7) that the absolutely continuous spectrum of $H$ equals to $[\inf\sigma(H),\,\infty)$. We omit the details (see [20, 28]). ## 5\. Proof of the Mourre Inequality We first prove Proposition 3.9. In view of Proposition 3.8(a) (iii) and (3.22), we have, as sesquilinear forms, (5.1) $[H,\,iA_{\sigma}]=(1-g)\mathrm{d}\Gamma((\eta_{\sigma})^{2}w^{(2)})+g(\mathrm{d}\Gamma((\eta_{\sigma})^{2}w^{(2)})+gH_{I}(-i(a_{\sigma}G))\ .$ Let ${\mathfrak{F}}_{\ell}^{(1)}$ (respectively ${\mathfrak{F}}_{\ell}^{(2)}$) be the Fock space for the massive leptons $\ell$ (respectively the neutrinos and antineutrinos $\ell$). We have ${\mathfrak{F}}_{\ell}\simeq{\mathfrak{F}}_{\ell}^{(1)}\otimes{\mathfrak{F}}_{\ell}^{(2)}\ .$ Let ${\mathfrak{F}}^{(1)}={\mathfrak{F}}_{W}\otimes(\otimes_{\ell=1}^{3}\,{\mathfrak{F}}_{\ell}^{(1)})\quad\mbox{and}\quad{\mathfrak{F}}^{(2)}=\otimes_{\ell=1}^{3}{\mathfrak{F}}_{\ell}^{(2)}\ .$ We have (5.2) ${\mathfrak{F}}\simeq{\mathfrak{F}}^{(1)}\otimes{\mathfrak{F}}^{(2)}\ ,$ ${\mathfrak{F}}^{(1)}$ is the Fock space for the massive leptons and the bosons $W^{\pm}$, and ${\mathfrak{F}}^{(2)}$ is the Fock space for the neutrinos and antineutrinos. We have, as sesquilinear forms and with respect to (5.2), (5.3) $\begin{split}&\mathrm{d}\Gamma((\eta_{\sigma})^{2}(p_{2})w_{\ell}^{(2)})+H_{I}(-i(a_{\sigma}G))\\\ &=\sum_{\ell=1}^{3}\sum_{\epsilon}\int\eta_{\sigma}(p_{2})^{2}|p_{2}|c^{*}_{\ell,\epsilon}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\\\ &+\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int|p_{2}|\left({\mathbf{1}}_{1}\otimes\eta_{\sigma}(p_{2})c^{*}_{\ell,\epsilon}(\xi_{2})+\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)\,*}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|}\otimes{\mathbf{1}}_{2}\right)\\\ &\left({\mathbf{1}}_{1}\otimes\eta_{\sigma}(p_{2})c_{\ell,\epsilon}(\xi_{2})+\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|}\otimes{\mathbf{1}}_{2}\right)\mathrm{d}\xi_{2}\\\ &-\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\int\left(\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)\,*}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2}\right)\left(\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2}\right)\mathrm{d}\xi_{2}\ ,\end{split}$ where $\mathcal{M}_{\ell,\epsilon,\epsilon^{\prime},\sigma}^{(\alpha)}(\xi_{2})=i\int\left(\sum_{\alpha=1,2}(a\,\eta_{\sigma}(p_{2})G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}(\xi_{2},\xi_{2},\xi_{3}))\right)b^{*}_{\ell,\epsilon^{\prime}}(\xi_{1})a_{\epsilon^{\prime}}(\xi_{3})\mathrm{d}\xi_{1}\mathrm{d}\xi_{3}\ ,$ and where ${\mathbf{1}}_{j}$ is the identity operator in ${\mathfrak{F}}^{(j)}$. By mimicking the proofs of Proposition 2.4 and 2.5, we get, for every $\psi\in{\mathfrak{D}}$, $\begin{split}&\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\left(\psi,\,\int(\sum_{\alpha=1,2}\frac{\mathcal{M}_{\ell,\epsilon,\epsilon^{\prime},\sigma}^{(\alpha)\,*}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2})(\sum_{\alpha=1,2}\frac{\mathcal{M}_{\ell,\epsilon,\epsilon^{\prime},\sigma}^{(\alpha)}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2})\psi\,\mathrm{d}\xi_{2}\right)\\\ &=\sum_{\ell=1}^{3}\sum_{\epsilon\neq\epsilon^{\prime}}\left\|\int(\sum_{\alpha=1,2}\frac{\mathcal{M}_{\ell,\epsilon,\epsilon^{\prime},\sigma}^{\alpha}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2})\psi\,\mathrm{d}\xi_{2}\right\|^{2}\\\ &\leq\left(\int\frac{|\sum_{\alpha=1,2}|(a\,\eta_{\sigma}(p_{2})G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)})(\xi_{2},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})|p_{2}|}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\right)\,\|(H_{0}^{(3)})^{\frac{1}{2}}\psi\|\ .\end{split}$ Noting that $|(a\,\eta_{\sigma})(p_{2})|\leq C$ uniformly with respect to $\sigma$, it follows from hypothesis 2.1 and 3.1 that there exists a constant $C(G)>0$ such that $\int\frac{|\sum_{\alpha=1,2}(a\,\eta_{\sigma}(p_{2})G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})(\xi_{1},\xi_{2},\xi_{3})|^{2}}{w^{(3)}(\xi_{3})|p_{2}|}\mathrm{d}\xi_{1}\mathrm{d}\xi_{2}\mathrm{d}\xi_{3}\leq C(G)\sigma\ .$ This yields (5.4) $-\int(\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)\,*}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2})(\sum_{\alpha=1,2}\frac{\mathcal{M}^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime},\sigma}(\xi_{2})}{|p_{2}|^{\frac{1}{2}}}\otimes{\mathbf{1}}_{2})\mathrm{d}\xi_{2}\geq-C(G)\sigma\ .$ Combining (5.1), (5.3) with (5.4), we obtain (5.5) $[H,\,iA_{n}]\geq(1-g)\mathrm{d}\Gamma((\eta_{\sigma_{n}})^{2}w_{\ell}^{(2)})-gC(G)\sigma_{n}\ .$ We have (5.6) $\mathrm{d}\Gamma((\eta_{\sigma_{n}})^{2}w_{\ell}^{(2)})\geq H_{0\,n}^{(2)}\ .$ By (3.24), (3.26) and (5.6) we get $\begin{split}f_{n}(H_{n}-E_{n})\mathrm{d}\Gamma(\eta_{\sigma_{n}}{}^{2}w_{\ell}^{(2)})f_{n}(H_{n}-E_{n})&\geq P_{n}\otimes f_{n}(H_{0\,n}^{(2)})\,H_{0\,n}^{(2)}\,f_{n}(H_{0\,n}^{(2)})\\\ &\geq\frac{\gamma^{2}}{N^{2}}\sigma_{n}f_{n}(H_{n}-E_{n})^{2}\ ,\end{split}$ for $g\leq g_{\delta}^{(1)}$. This, together with (5.5), yields for $g\leq g_{\delta}^{(1)}$ $\begin{split}&f_{n}(H_{n}-E_{n})[H,\,iA_{n}]f_{n}(H_{n}-E_{n})\\\ &\geq(1-g_{\delta}^{(1)})\frac{\gamma^{2}}{N^{2}}\sigma_{n}f_{n}(H_{n}-E_{n})^{2}-g\,C(G)\,\sigma_{n}f_{n}(H_{n}-E_{n})^{2}\ .\end{split}$ Setting $g_{\delta}^{(2)}=\inf(g_{\delta}^{(1)},\,\frac{1-g_{\delta}^{(1)}}{2\,C(G)}\frac{\gamma^{2}}{N^{2}})\ ,$ we get $f_{n}(H_{n}-E_{n})[H,\,iA_{n}]f_{n}(H_{n}-E_{n})\geq\frac{1-g_{\delta}^{(1)}}{2}\frac{\gamma^{2}}{N^{2}}\,\sigma_{n}f_{n}(H_{n}-E_{n})^{2}\ ,$ for $g\leq g_{\delta}^{(2)}$. Proposition 3.9 is proved by setting $\tilde{g}_{\delta}^{(1)}=g_{\delta}^{(2)}$ and $\tilde{C}_{\delta}=\frac{1-g_{\delta}^{(1)}}{2}$. The proof of Theorem 3.10 is the consequence of the following two lemmata. ###### Lemma 5.1. Assume that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and 3.1(ii). Then there exists a constant $D>0$ such that $|E-E_{n}|\leq g\,D\,\sigma_{n}{}^{2}\ ,$ for $n\geq 1$ and $g\leq g^{(2)}$. ###### Proof. Let $\phi$ (respectively $\tilde{\phi}_{n}$) be the unique normalized ground state of $H$ (respectively $H_{n}$). We have (5.7) $\begin{split}&E-E_{n}\leq(\tilde{\phi}_{n},(H-H_{n})\tilde{\phi}_{n})\\\ &E_{n}-E\leq(\phi,(H_{n}-H)\phi)\ ,\end{split}$ with (5.8) $H-H_{n}=gH_{I}(\chi_{\sigma_{n}}(p_{2})G)\ .$ Combining (2.29) and (2.30) with (3.3)-(3.6) and (5.8), we get (5.9) $\|(H-H_{n})\tilde{\phi}_{n}\|\leq g\,K(\chi_{\sigma_{n}}(p_{2})G)\,(C_{\beta\eta}\|H_{0}\tilde{\phi}_{n}\|+B_{\beta\eta})$ and (5.10) $\|(H-H_{n})\phi\|\leq g\,K(\chi_{\sigma_{n}}(p_{2})G)\,(C_{\beta\eta}\|H_{0}\phi\|+B_{\beta\eta})$ It follows from Hypothesis 3.1(ii), (4.5), (5.9) and (5.10) that there exists a constant $D>0$ such that $\max(\|(H-H_{n})\tilde{\phi}_{n}\|,\,\|(H-H_{n})\phi\|\leq g\,D\,\sigma_{n}{}^{2}\ ,$ for $n\geq 1$ and $g\leq g^{(2)}$. By (5.7), this proves Lemma 5.1. ∎ ###### Lemma 5.2. Suppose that the kernels $G_{\ell,\epsilon,\epsilon^{\prime}}^{(\alpha)}$ satisfy Hypothesis 2.1 and 3.1(ii). Then there exists a constant $C>0$ such that (5.11) $\|f_{n}(H-E)-f_{n}(H_{n}-E_{n})\|\leq g\,C\,\sigma_{n}\ ,$ for $n\geq 1$ and $g\leq g^{(2)}$. ###### Proof. Let $\tilde{f}(.)$ be an almost analytic extension of $f(.)$ given by (3.25) satisfying (5.12) $\left|\partial_{\bar{z}}\tilde{f}(x+iy)\right|\leq Cy^{2}\ .$ Note that $\tilde{f}(x+iy)\in C_{0}^{\infty}({\mathbb{R}}^{2})$. We thus have (5.13) $f(s)=\int\frac{\mathrm{d}\tilde{f}(z)}{z-s},\quad\mathrm{d}\tilde{f}(z)=-\frac{1}{\pi}\frac{\partial\tilde{f}}{\partial\bar{z}}\,\mathrm{d}x\,\mathrm{d}y\ .$ Using the functional calculus based on this representation of $f(s)$, we get (5.14) $f_{n}(H-E)-f_{n}(H_{n}-E_{n})=\sigma_{n}\int\frac{1}{H-E-z\sigma_{n}}(H-H_{n}+E_{n}-E)\frac{1}{H_{n}-E_{n}-z\sigma_{n}}\mathrm{d}\tilde{f}(z)\ .$ Combining (2.29) and (2.30) with (3.3)-(3.6) and Hypothesis 3.1(ii), we get, for every $\psi\in{\mathcal{D}}(H_{0})$ and for $g\leq g^{(2)}$, (5.15) $g\|H_{I}(\chi_{\sigma_{n}}G)\psi\|\leq 2\,g\,C\,\sigma_{n}{}^{2}K(G)\,(C_{\beta\eta}\|(H_{0}+1)\psi\|+(C_{\beta\eta}+B_{\beta\eta})\|\psi\|)\ .$ This yields (5.16) $g\|H_{I}(\chi_{\sigma_{n}}(p_{2})G)(H_{0}+1)^{-1}\|\leq g\,C_{1}\,\sigma_{n}{}^{2}\ ,$ for some constant $C_{1}>0$ and for $g\leq g^{(2)}$. By mimicking the proof of (A.12) we show that there exists a constant $C_{2}>0$ such that (5.17) $\|(H_{0}+1)(H_{n}-E_{n}-z\sigma_{n})^{-1}\|\leq C_{2}(1+\frac{1}{|\mathrm{Im}z|\sigma_{n}})\ ,$ for $g\leq g^{(1)}$. Combining Lemma 5.1 and (5.14) with (5.15)-(5.17) we obtain $\|f_{n}(H-E)-f_{n}(H_{n}-E_{n})\|\leq g\,C\,\sigma_{n}\int\frac{|\frac{\partial\tilde{f}}{\partial\bar{z}}(x+iy)|}{y^{2}}\mathrm{d}x\mathrm{d}y\ ,$ for some constant $C>0$ and for $g\leq g^{(2)}$. Using (5.12) and $\tilde{f}(x+iy)\in C_{0}^{\infty}({\mathbb{R}}^{2})$ one concludes the proof of Lemma 5.2. ∎ We now prove Theorem 3.10. ###### Proof. It follows from Proposition 3.9 that $\begin{split}&f_{n}(H_{n}-E_{n})[H,\,iA]f_{n}(H_{n}-E_{n})\\\ &=f_{n}(H_{n}-E_{n})[H,\,iA_{n}]f_{n}(H_{n}-E_{n})\geq\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}\,f_{n}(H_{n}-E_{n})^{2}\ ,\end{split}$ for $n\geq 1$ and $g\leq\tilde{g}_{\delta}^{(1)}$. This yields $\begin{split}&f_{n}(H-E)[H,iA_{n}]f_{n}(H-E)\geq\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}\,f_{n}(H-E)^{2}\\\ &-f_{n}(H-E)[H,\,iA](f_{n}(H_{n}-E_{n})-f_{n}(H-E))\\\ &-(f_{n}(H_{n}-E_{n})-f_{n}(H-E))[H,\,iA]f_{n}(H_{n}-E_{n})\\\ &+\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}(f_{n}(H_{n}-E_{n})-f_{n}(H-E))^{2}\\\ &+\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}f_{n}(H-E)(f_{n}(H_{n}-E_{n})-f_{n}(H-E))\\\ &+\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}(f_{n}(H_{n}-E_{n})-f_{n}(H-E))f_{n}(H-E)\ .\end{split}$ Combining Proposition 3.8 (i) and (5.13) with (5.16) and (5.17) we show that $[H,\,iA]f_{n}(H_{n}-E_{n})$ and $f_{n}(H-E)[H,\,iA]$ are bounded operators uniformly with respect to $n$. This, together with Lemma 5.2, yields (5.18) $f_{n}(H-E)[H,\,iA]f_{n}(H-E)\geq\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}f_{n}(H-E)^{2}-\tilde{C}\,g\,\sigma_{n}\ ,$ for some constant $\tilde{C}>0$ and for $g\leq\inf(g^{(2)},\,\tilde{g}_{\delta}^{(1)})$. Multiplying both sides of (5.18) with $E_{\Delta_{n}}(H-E)$ we then get $E_{\Delta_{n}}(H-E)[H,\,iA]E_{\Delta_{n}}(H-E)\geq\tilde{C}_{\delta}\frac{\gamma^{2}}{N^{2}}\sigma_{n}E_{\Delta_{n}}(H-E)-\tilde{C}\,g\,\sigma_{n}E_{\Delta_{n}}(H-E)\ .$ Setting $\tilde{g}_{\delta}^{(2)}<\inf\left(\frac{\tilde{C}_{\delta}}{\tilde{C}}\frac{\gamma^{2}}{N^{2}},\,g^{(2)},\,\tilde{g}_{\delta}^{(1)}\right)\ ,$ Theorem 3.10 is proved with $C_{\delta}=\tilde{C}_{\delta}-\tilde{C}\frac{N^{2}}{\gamma^{2}}\tilde{g}_{\delta}^{(2)}>0$. ∎ ## 6\. Proof of Theorem 3.7 We set $\begin{split}&A_{t}=\frac{\mathrm{e}^{itA}-1}{t}\ ,\\\ &\mathrm{ad}_{A_{t}}\cdot=[A_{t},\,.\,]\ ,\\\ &A_{t}^{\sigma}=\frac{\mathrm{e}^{itA^{\sigma}-1}}{t}\ ,\\\ &A_{\sigma\,t}=\frac{\mathrm{e}^{itA_{\sigma}}-1}{t}\ .\end{split}$ The fact that $H$ is of class $C^{1}(A)$, $C^{1}(A^{\sigma})$ and $C^{1}(A_{\sigma})$ in $(-\infty,\,m_{1}-\frac{\delta}{2})$ is the consequence of the following proposition ###### Proposition 6.1. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and 3.1(iii.a). For every $\varphi\in C_{0}^{\infty}((-\infty,m_{1}-\frac{\delta}{2}))$ and $g\leq g_{1}$, we then have $\begin{split}&\sup_{0<|t|\leq 1}\|[\varphi(H),\,A_{t}]\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[\varphi(H),A_{t}^{\sigma}]\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[\varphi(H),\,A_{\sigma\,t}]\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[\varphi(H^{\sigma}),\,A_{t}^{\sigma}]\|<\infty\ .\end{split}$ ###### Proof. We use the representation $\varphi(H)=\int\mathrm{d}\phi(z)(z-H)^{-1}\ ,$ where $\phi(z)$ is an almost analytic extension of $\varphi$ with $|\partial_{\bar{z}}\phi(x+iy)|\leq C|y|^{2}\quad\mbox{and}\quad\mathrm{d}\phi(z)=-\frac{1}{\pi}\frac{\partial}{\partial\bar{z}}\phi(z)\mathrm{d}x\mathrm{d}y\ .$ Note that $\phi(x+iy)\in C_{0}^{\infty}({\mathbb{R}}^{2})$. We get $\mathrm{ad}_{A_{t}}\varphi(H)=\int\mathrm{d}\phi(z)(z-H)^{-1}[A_{t},\,H](z-H)^{-1}\ .$ This yields $\begin{split}&\|\mathrm{ad}_{A_{t}}\varphi(H)\|\\\ &\leq\sup_{0<|t|\leq 1}\|[A_{t},\,H](i-H)^{-1}\|\,\int|\mathrm{d}\phi(z)|\,\|(z-H)^{-1}\|\,\|(i-H)(z-H)^{-1}\|\ .\end{split}$ It is easy to prove that (6.1) $\int|\mathrm{d}\phi(z)|\,\|(z-H)^{-1}\|\,\|(i-H)(z-H)^{-1}\|\leq C\int\frac{|\mathrm{d}\phi(z)|}{|\mathrm{Im}z|^{2}}<\infty\ .$ By Proposition 3.8(b)$(i)$ and (6.1) we finally get, for $g\leq g_{1}$ $\sup_{0<|t|\leq 1}\|\mathrm{ad}_{A_{t}}\,\varphi(H)\|<\infty\ .$ In a similar way we obtain, for $g\leq g_{1}$ $\begin{split}\sup_{0<|t|\leq 1}\|[A_{t}^{\sigma},\,\varphi(H)]\|<\infty\,,\\\ \sup_{0<|t|\leq 1}\|[A_{\sigma\,t},\,\varphi(H)\|<\infty\,,\\\ \sup_{0<|t|\leq 1}\|[A_{t}^{\sigma},\,\varphi(H^{\sigma})]\|<\infty\ .\end{split}$ ∎ The proof of Theorem 3.7 is the consequence of the following proposition ###### Proposition 6.2. Suppose that the kernels $G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}$ satisfy Hypothesis 2.1 and 3.1 (i)-(iii). We then have, for $g\leq g_{1}$, $\begin{split}&\sup_{0<|t|\leq 1}\|[A_{t},\,[A_{t},\,H]](H+i)^{-1}\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[A_{t}^{\sigma},[A_{t}^{\sigma},\,H](H+i)^{-1}\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[A_{\sigma\,t},[A_{\sigma\,t},\,H](H+i)^{-1}\|<\infty\,,\\\ &\sup_{0<|t|\leq 1}\|[A_{t}^{\sigma},[A_{t}^{\sigma},\,H^{\sigma}](H^{\sigma}+i)^{-1}\|<\infty\,,\end{split}$ ###### Proof. We have, for every $\psi\in{\mathcal{D}}(H)$, (6.2) $[A_{t},[A_{t},H]]\psi=\frac{1}{t^{2}}\mathrm{e}^{2itA}(\mathrm{e}^{-2itA}H\mathrm{e}^{2itA}-2\mathrm{e}^{-itA}H\mathrm{e}^{itA}+H)\psi\ .$ By (3.14) we get (6.3) $[A_{t},[A_{t},H_{0}]]\psi=\frac{1}{t^{2}}\mathrm{e}^{2itA}(\mathrm{d}\Gamma(w^{(2)}\circ\phi_{2t}-2w^{(2)}\circ\phi_{t}+w^{(2)}))\psi\ ,$ where, for $\ell=1,2,3$, (6.4) $(w_{\ell}^{(2)}\circ\phi_{2t})(p_{2})-2(w_{\ell}^{(2)}\circ\phi_{t})(p_{2})+w_{\ell}^{(2)}(p_{2})=|\phi_{2t}(p_{2})|-2|\phi_{t}(p_{2})|+|p_{2}|\ .$ We further note that (6.5) $\frac{1}{t^{2}}\big{|}\,|\phi_{2t}(p_{2})|-2|\phi_{t}(p_{2})|+|p_{2}|\,\big{|}\leq\sup_{|s|\leq 2|t|}\left|\frac{\partial^{2}}{\partial s^{2}}|\phi_{s}(p_{2})|\,\right|\ ,$ and (6.6) $\frac{\partial^{2}}{\partial s^{2}}|\phi_{s}(p_{2})|=|\phi_{s}(p_{2})|\leq\mathrm{e}^{\Gamma|s|}|p_{2}|\ .$ Combining (6.3) with (6.4)-(6.6) we get $\|[A_{t},\,[A_{t},\,H_{0}]](H_{0}+1)^{-1}\|\leq\mathrm{e}^{2\Gamma|t|}\ ,$ and $\sup_{0<|t|\leq 1}\|[A_{t},\,[A_{t},\,H_{0}]](H_{0}+1)^{-1}\|\leq\mathrm{e}^{2\Gamma}\ .$ In a similar way we obtain $\sup_{0<|t|\leq 1}\|[A_{t}^{\sigma},\,[A_{t}^{\sigma},H_{0}]](H_{0}+1)^{-1}\|\leq C\mathrm{e}^{2\Gamma}\ ,$ $\sup_{0<|t|\leq 1}\|[A_{\sigma\,t},\,[A_{\sigma\,t},H_{0}]](H_{0}+1)^{-1}\|\leq C\mathrm{e}^{2\Gamma}\ .$ Here $C$ is a positive constant. Let us now prove that $\sup_{0<|t|\leq 1}\|[A_{t},\,[A_{t},\,H_{I}(G)]](H+i)^{-1}\|<\infty$ By (3.18) and (6.2) we get, for every $\psi\in{\mathcal{D}}(H)$, (6.7) $\begin{split}&[A_{t},\,[A_{t},\,H_{I}(G)]]\psi\\\ &=\sum_{\alpha=1,2}\sum_{\ell=1,2,3}\sum_{\epsilon\neq\epsilon^{\prime}}\frac{\mathrm{e}^{2itA}}{t^{2}}\Big{(}\mathrm{e}^{-2itA}H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\mathrm{e}^{2itA}-2\mathrm{e}^{-itA}H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\mathrm{e}^{itA}\\\ &+H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\Big{)}\psi\\\ &=\sum_{\alpha=1,2}\sum_{\ell=1,2,3}\sum_{\epsilon\neq\epsilon^{\prime}}\frac{\mathrm{e}^{2itA}}{t^{2}}\Big{(}H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};2t})-2H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};t})+H_{I}(G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};0})\Big{)}\psi\ ,\end{split}$ where $\begin{split}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};t}(\xi_{1},\xi_{2},\xi_{3})&=(D\phi_{t}(p_{2}))^{\frac{1}{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1};\,\phi_{t}(p_{2}),s_{2};\,\xi_{3})\\\ &=(e^{-ita}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})(\xi_{1},\xi_{2},\xi_{3})\ .\end{split}$ Combining (2.29) and (2.30) with (3.3)-(3.6) and (6.7) we get (6.8) $\|[A_{t},\,[A_{t},\,H_{I}(G)]]\psi\|\leq g\,K(G_{t})(C_{\beta\eta}\|(H_{0}+I)\psi\|+(C_{\beta\eta}+B_{\beta\eta})\|\psi\|)\ .$ Here $K(G_{t})>0$ and (6.9) $K(G_{t})^{2}=\sum_{\alpha=1,2}\sum_{\ell=1,2,3}\sum_{\epsilon\neq\epsilon^{\prime}}\frac{1}{t^{2}}\|G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};2t}-2G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};t}+G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\|^{2}_{L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})}\ .$ We further note that, for $0<|t|\leq 1$, (6.10) $K(G_{t})\leq\sup_{0<|s|\leq 2}\Big{(}\sum_{\alpha=1,2}\sum_{\ell=1,2,3}\sum_{\epsilon\neq\epsilon^{\prime}}\left\|\frac{\partial^{2}}{\partial s^{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};s}\right\|^{2}_{L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})}\Big{)}^{\frac{1}{2}}\ .$ We get (6.11) $\begin{split}&\left(\frac{\partial}{\partial t}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};t}\right)\\\ &=\frac{3}{2}(\mathrm{e}^{-ita}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})+(\mathrm{e}^{-ita}(p_{2}\cdot\nabla_{p_{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}))\,,\end{split}$ and (6.12) $\begin{split}&\left(\frac{\partial^{2}}{\partial t^{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime};t}\right)\\\ &=\frac{9}{4}(\mathrm{e}^{-ita}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})+\frac{7}{2}(\mathrm{e}^{-ita}(p_{2}\cdot\nabla_{p_{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}))+\\!\sum_{i,j=1,2,3}\mathrm{e}^{-ita}\big{(}p_{2,i}p_{2,j}\partial^{2}_{p_{2,i}p_{2,j}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}\big{)}.\end{split}$ Recall that $\mathrm{e}^{-ita}$ is an one parameter group of unitary operators in $L^{2}(\Sigma_{1}\times\Sigma_{1}\times\Sigma_{2})$. Combining Hypothesis 3.1(iii.a) and (iii.b), with (6.8)-(6.12) we finally get $\sup_{0<|t|\leq 1}\|[\,A_{t},\,[A_{t},\,H_{I}(G)]\,](H_{0}+1)^{-1}\|<\infty\ .$ In view of ${\mathcal{D}}(H)={\mathcal{D}}(H_{0})$ the operators $H_{0}(H+i)^{-1}$ and $H(H_{0}-1)^{-1}$ are bounded and we obtain $\sup_{0<|t|\leq 1}\|[\,A_{t},\,[A_{t},\,H_{0}]\,](H+i)^{-1}\|<\infty\ ,$ (6.13) $\sup_{0<|t|\leq 1}\|[\,A_{t},\,[A_{t},\,H_{I}(G)]\,](H+i)^{-1}\|<\infty\ .$ This yields (6.14) $\sup_{0<|t|\leq 1}\|[\,A_{t},\,[A_{t},\,H]\,](H+i)^{-1}\|<\infty\ ,$ for $g\leq g_{1}$. Let $V(p_{2})$ denote any of the two $C^{\infty}$-vector fields $v^{\sigma}(p_{2})$ and $v_{\sigma}(p_{2})$ and let $\tilde{a}$ denote the corresponding $a^{\sigma}$ and $a_{\sigma}$ operators. We get $\begin{split}&\left(\frac{\partial^{2}}{\partial t^{2}}(\mathrm{e}^{-i\tilde{a}t}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\\\ &=\frac{1}{4}\left(\mathrm{e}^{-i\tilde{a}t}((\mathrm{div}V(p_{2}))^{2}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\\\ &+\frac{1}{2}\left(\mathrm{e}^{-i\tilde{a}t}((\mathrm{div}V(p_{2}))V(p_{2})\cdot\nabla_{p_{2}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\\\ &+\frac{1}{2}\left(\mathrm{e}^{-i\tilde{a}t}(\sum_{i,j=1}^{3}(V_{i}(p_{2})(\partial^{2}_{p_{2,i}p_{2,j}}V_{j}(p_{2})))G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\\\ &+\frac{1}{2}\left(\mathrm{e}^{-i\tilde{a}t}(\sum_{i,j=1}^{3}V_{i}(p_{2})\frac{\partial V_{j}}{\partial p_{2,i}}(p_{2})\frac{\partial}{\partial p_{2,j}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\\\ &+\frac{1}{2}\left(\mathrm{e}^{-i\tilde{a}t}(\sum_{i,j=1}^{3}V_{i}(p_{2})V_{j}(p_{2})\frac{\partial^{2}}{\partial p_{2,i}\partial p_{2,j}}G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}})\right)(\xi_{1},\xi_{2},\xi_{3})\ .\end{split}$ Combining the properties of the $C^{\infty}$ fields $v^{\sigma}(p_{2})$ and $v_{\sigma}(p_{2})$ together with Hypothesis 2.1 and 3.1 we get, from (6.13) and by mimicking the proof of (6.14), (6.15) $\sup_{0<|t|\leq 1}\|\,[\,A_{t}^{\sigma},\,[A_{t}^{\sigma},\,H]\,](H+i)^{-1}\|<\infty\ ,$ $\sup_{0<|t|\leq 1}\|\,[\,A_{\sigma\,t},\,[A_{\sigma\,t},\,H]\,](H+i)^{-1}\|<\infty\ ,$ for $g\leq g_{1}$. Similarly, by mimicking the proof of (6.15), we easily get, for $g\leq g_{1}$, $\sup_{0<|t|\leq 1}\|\,[\,A_{t}^{\sigma},\,[A_{t}^{\sigma},\,H^{\sigma}]\,](H^{\sigma}+i)^{-1}\|<\infty\ .$ This concludes the proof of Proposition 6.2 ∎ We now prove Theorem 3.7. Proof of Theorem 3.7. In view of [3, Lemma 6.2.3] (see also [13, Proposition 28]), the proof of Theorem 3.7 will follow from Proposition 6.1 and the following estimates (6.16) $\sup_{0<|t|\leq 1}\|\,[\,A_{t},\,[A_{t},\,\varphi(H)]\,]\,\|<\infty\ ,$ (6.17) $\sup_{0<|t|\leq 1}\|\,[\,A_{t}^{\sigma},\,[A_{t}^{\sigma},\,\varphi(H)]\,]\,\|<\infty\ ,$ (6.18) $\sup_{0<|t|\leq 1}\|\,[\,A_{\sigma\,t},\,[A_{\sigma\,t},\,\varphi(H)]\,]\,\|<\infty\ ,$ (6.19) $\sup_{0<|t|\leq 1}\|\,[\,A_{t}^{\sigma},\,[A_{t}^{\sigma},\,\varphi(H^{\sigma})]\,]\,\|<\infty\ ,$ for every $\varphi\in C_{0}^{\infty}((-\infty,m_{1}-\delta/2))$ and for $g\leq g_{1}$. Let us prove (6.16). The inequalities (6.17)-(6.19) can be proved similarly. To this end, let $\phi$ be an almost analytic extension of $\varphi$ satisfying $|\partial_{\bar{z}}\phi(x+iy)|\leq C|y|^{3}\ ,$ and $\varphi(H)=\int(z-H)^{-1}\mathrm{d}\phi(z)\ ,\quad\mathrm{d}\phi(z)=-\frac{1}{\pi}\frac{\partial}{\partial\bar{z}}\phi(z)\mathrm{d}x\mathrm{d}y\ .$ It follows that $\begin{split}&[A_{t}\,[A_{t},\,\varphi(H)]\,]=\int\Big{(}(z-H)^{-1}[A_{t}\,[A_{t},\,H]\,](z-H)^{-1}\\\ &+2(z-H)^{-1}[A_{t},\,H](z-H)^{-1}[A_{t},\,H](z-H)^{-1}\Big{)}\mathrm{d}\phi(z)\end{split}$ We note that (6.20) $\|(H+i)(H-z)^{-1}\|\leq\frac{C}{|\mathrm{Im}z|},\quad\mbox{for }z\in\mathrm{supp}\phi\ .$ We also have (6.21) $\begin{split}&\sup_{0<|t|\leq 1}\|\int(z-H)^{-1}[A_{t}\,[A_{t},\,H]\,](z-H)^{-1}\mathrm{d}\phi(z)\|\\\ &\leq\sup_{0<|t|\leq 1}\int\|[A_{t}\,[A_{t},\,H]\,](H+i)^{-1}\|\,\|(H+i)(z-H)^{-1}\|\frac{|\mathrm{d}\phi(z)|}{|\mathrm{Im}z|}\\\ &\leq C\sup_{0<|t|\leq 1}\|\,\left[A_{t},\,[A_{t},H]\,\right](H+i)^{-1}\,\|\int\frac{|\mathrm{d}\phi(z)|}{|\mathrm{Im}z|^{2}}\ .\end{split}$ Therefore, combining Proposition 3.8 (b)(i) and (6.20) we obtain (6.22) $\begin{split}&\sup_{0<|t|\leq 1}\|\int\mathrm{d}\phi(z)(H-z)^{-1}[A_{t},\,H](H-z)^{-1}[A_{t},\,H](H-z)^{-1}\|\\\ &=\sup_{0<|t|\leq 1}\|\int(H-z)^{-1}[A_{t},\,H](H+i)^{-1}(H+i)(H-z)^{-1}\\\ &\quad\quad[A_{t},\,H](H+i)^{-1}(H+i)(H-z)^{-1}\|\mathrm{d}\phi(z)\\\ &\leq C\left(\int\frac{|\mathrm{d}\phi(z)|}{|y|^{3}}\right)\sup_{0<|t|\leq 1}\|\,[A_{t},\,H](H+i)^{-1}\|^{2}<\infty\ .\end{split}$ Inequality (6.22) together with (6.21) yields (6.16), and $H$ is locally of class $C^{2}(A)$ on $(-\infty,\,m_{1}-\delta/2)$ for $g\leq g_{1}$. In a similar way it follows from Proposition 3.8(b), Proposition 6.1 and Proposition 6.2 that $H$ is locally of class $C^{2}(A^{\sigma})$ and $C^{2}(A_{\sigma})$ in $(-\infty,m_{1}-\delta/2)$ and that $H^{\sigma}$ is locally of class $C^{2}(A^{\sigma})$ in $(-\infty,m_{1}-\delta/2)$, for $g\leq g_{1}$. This ends the proof of Theorem 3.7. ∎ ## 7\. Proof of Theorem 3.4 By (3.31), $\cup_{n\geq 1}\left((\gamma-\epsilon_{\gamma})^{2}\sigma_{n},\,(\gamma+\epsilon_{\gamma})\sigma_{n})\right)$ is a covering by open sets of any compact subset of $(E,\,m_{1}-\delta]$ and of the interval $(E,\,m_{1}-\delta]$ itself. Theorem 3.4 (i) and (ii) follow from Theorems 0.1 and 0.2 in [25] and Theorems 3.7 and 3.10 above with $g_{\delta}=\tilde{g}_{\delta}^{(2)}$, where $\tilde{g}_{\delta}^{(2)}$ is given in Theorem 3.10. Theorem 3.4 (iii) follows from Theorem 25 in [23]. ## Appendix A In this appendix, we will prove Proposition 3.5. We apply the method developed in [4] because every infrared cutoff Hamiltonian that one considers has a ground state energy which is a simple eigenvalue. Let, for $n\geq 0$, $\begin{split}&{\mathfrak{F}}^{\sigma_{n}}={\mathfrak{F}}^{n}\,,\\\ &\Sigma_{1\,n}^{\ \,n+1}=\Sigma_{1}\cap\\{p_{2};\ \sigma_{n+1}\leq|p_{2}|<\sigma_{n}\\}\ ,\\\ &{\mathfrak{F}}_{\ell,2,n}^{\ \ \ \,n+1}={\mathfrak{F}}_{a}(L^{2}(\Sigma_{1\,n}^{\ \,n+1}))\otimes{\mathfrak{F}}_{a}(L^{2}(\Sigma_{1\,n}^{\ \,n+1}))\,,\\\ &{\mathfrak{F}}_{n}^{n+1}=\otimes_{\ell=1}^{3}\,{\mathfrak{F}}_{\ell,2,n}^{\ \ \ \,n+1}.\end{split}$ We have ${\mathfrak{F}}^{n+1}\simeq{\mathfrak{F}}^{n}\otimes{\mathfrak{F}}_{n}^{n+1}\ .$ Let $\Omega^{n}$ (respectively $\Omega_{n}^{n+1}$) be the vacuum state in ${\mathfrak{F}}^{n}$ (respectively in ${\mathfrak{F}}_{n}^{n+1}$). We now set $H_{0\,n}^{\ \,n+1}=H_{0}^{(1)}+H_{0}^{(3)}+\sum_{\ell=1}^{3}\sum_{\epsilon=\pm}\int_{\sigma_{n+1}\leq|p_{2}|<\sigma_{n}}\\!\\!\\!w_{\ell}^{(2)}(\xi_{2})c_{\ell,\epsilon}^{*}(\xi_{2})c_{\ell,\epsilon}(\xi_{2})\mathrm{d}\xi_{2}\ .$ The operator $H_{0\,n}^{\ \,n+1}$ is a self-adjoint operator in ${\mathfrak{F}}_{n}^{n+1}$. Let us denote by $H_{I}^{n}$ and $H_{I\,n}^{\ \,n+1}$ the interaction $H_{I}$ given by (2.10)-(2.12) but associated with the following kernels $\tilde{\chi}^{\sigma_{n}}(p_{2})G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})\ ,$ and $(\tilde{\chi}^{\sigma_{n+1}}(p_{2})-\tilde{\chi}^{\sigma_{n}}(p_{2}))G^{(\alpha)}_{\ell,\epsilon,\epsilon^{\prime}}(\xi_{1},\xi_{2},\xi_{3})\ ,$ respectively, where $\tilde{\chi}^{\sigma_{n+1}}$ is defined by (3.1). Let for $n\geq 0$, $\begin{split}&H_{+}^{n}=H^{n}-E^{n}\ ,\\\ &\tilde{H}_{+}^{n}=H_{+}^{n}\otimes{\mathbf{1}}_{n}^{n+1}+{\mathbf{1}}_{n}\otimes H_{0\,n}^{\ \,n+1}\ .\end{split}$ The operators $H_{+}^{n}$ and $\tilde{H}_{+}^{n}$ are self-adjoint operators in ${\mathfrak{F}}^{n}$ and ${\mathfrak{F}}^{n+1}$ respectively. Here ${\mathbf{1}}^{n}$ and ${\mathbf{1}}_{n}^{n+1}$ are the identity operators in ${\mathfrak{F}}^{n}$ and ${\mathfrak{F}}_{n}^{n+1}$ respectively. Combining (2.29) and (2.30) with (3.3)-(3.6) we obtain for $n\geq 0$, (A.1) $g\|H_{I}^{n}\psi\|\leq gK(G)(C_{\beta\eta}\|H_{0}\psi\|+B_{\beta\eta}\|\psi\|)\ ,$ for every $\psi\in{\mathcal{D}}(H_{0}^{n})\subset{\mathfrak{F}}^{n}$. It follows from [22, §V, Theorem 4.11] that $H^{n}\geq-\frac{gK(G)B_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\geq-\frac{g_{1}K(G)B_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\ ,$ and $E^{n}\geq-\frac{gK(G)B_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\ .$ We have (A.2) $(\Omega^{n},\ H^{n}\Omega^{n})=0\ .$ Therefore $E^{n}\leq 0\ ,$ and (A.3) $|E^{n}|\leq\frac{gK(G)B_{\beta\eta}}{1-g_{1}K(G)C_{\beta\eta}}\ .$ Let (A.4) $K_{n}^{n+1}(G)=K({\mathbf{1}}_{\sigma_{n+1}\leq|p_{2}|\leq 2\sigma_{n}}\,G)\ .$ Combining (2.29) and (2.30) with (3.3), (3.4) and (A.4) we obtain for $n\geq 0$ (A.5) $g\|H_{I\,n}^{\ \,n+1}\psi\|\leq g\,K_{n}^{n+1}(G)\,(C_{\beta\eta}\|H_{0}^{n+1}\psi\|+B_{\beta\eta}\|\psi\|)\ ,$ for $\psi\in{\mathcal{D}}(H_{0}^{n+1})\subset{\mathfrak{F}}^{n+1}$, where we remind that $H_{0}^{n+1}=H_{0}|_{{\mathfrak{F}}^{\sigma_{n+1}}}$ as defined in (3.2). We have for every $\psi\in{\mathcal{D}}(H_{0}^{n+1})$, (A.6) $H_{0}^{n+1}\psi=\tilde{H}_{+}^{n}\psi+E^{n}\psi-g(H_{I}^{n}\otimes{\mathbf{1}}_{n}^{n+1})\psi\ ,$ and by (A.1) (A.7) $g\|(H_{I}^{n}\otimes{\mathbf{1}}_{n}^{n+1})\psi\|\leq g\,K(G)\,(C_{\beta\eta}\|H_{0}^{n+1}\psi\|+B_{\beta\eta}\|\psi\|)\ .$ In view of (A.3) and (A.6) it follows from (A.7) that (A.8) $\begin{split}&g\|(H_{I}^{n}\otimes{\mathbf{1}}_{n}^{n+1})\psi\|\\\ &\leq\frac{g\,K(G)\,C_{\beta\eta}}{1-g_{1}\,K(G)\,C_{\beta\eta}}\|\tilde{H}_{+}^{n}\psi\|+\frac{g\,K(G)\,B_{\beta\eta}}{1-g_{1}\,K(G)\,C_{\beta\eta}}\big{(}1+\frac{g\,K(G)\,B_{\beta\eta}}{1-g_{1}\,K(G)\,C_{\beta\eta}}\big{)}\|\psi\|\ .\end{split}$ By (3.7), (3.8), (A.5), (A.6), (A.8) we finally get (A.9) $g\|H_{I\,n}^{\ \,n+1}\psi\|\leq gK_{n}^{n+1}(G)(\tilde{C}_{\beta\eta}\|\tilde{H}_{+}^{n}\psi\|+\tilde{B}_{\beta\eta}\|\psi\|)\ .$ For $n\geq 0$, a straightforward computation yields (A.10) $K_{n}^{n+1}(G)\leq\sigma_{n}\tilde{K}(G)\leq\sup(\frac{4\Lambda\gamma}{2m_{1}-\delta},\ 1)\,\tilde{K}(G)\frac{\sigma_{n+1}}{\gamma}\ .$ Recall that for $n\geq 0$, (A.11) $\sigma_{n+1}<m_{1}\ .$ By (A.9), (A.10) and (A.11), we get, for $\psi\in{\mathcal{D}}(H_{0})$, $g\,\|H_{I\,n}^{\ \,n+1}\psi\|\leq g\,K_{n}^{n+1}(G)\,\big{(}\,\tilde{C}_{\beta\eta}\|(\tilde{H}_{+}^{n}+\sigma_{n+1})\psi\|+(\tilde{C}_{\beta\eta}\,m_{1}+\tilde{B}_{\beta\eta})\|\psi\|\,\big{)}\ ,$ and for $\phi\in{\mathfrak{F}}$, (A.12) $\begin{split}g\|H_{I\,n}^{\ \,n+1}(\tilde{H}_{+}^{n}+\sigma_{n+1})^{-1}\phi\|&\leq g\,K_{n}^{n+1}(G)\,\big{(}\,\tilde{C}_{\beta\eta}+\frac{m_{1}\tilde{C}_{\beta\eta}+\tilde{B}_{\beta\eta}}{\sigma_{n+1}}\,\big{)}\|\phi\|\\\ &\leq\frac{g}{\gamma}\,\sup(\frac{4\Lambda\gamma}{2m_{1}-\delta},\,1)\,\tilde{K}(G)(2m_{1}\tilde{C}_{\beta\eta}+\tilde{B}_{\beta\eta})\|\phi\|\ .\end{split}$ Thus, by (A.12), the operator $H_{I\,n}^{\ \,n+1}(\tilde{H}_{+}^{n}+\sigma_{n+1})^{-1}$ is bounded and $g\|H_{I\,n}^{\ \,n+1}(\tilde{H}_{+}^{n}+\sigma_{n+1})^{-1}\|\leq g\frac{\tilde{D}}{\gamma}\ ,$ where $\tilde{D}$ is given by (see (3.9) $\tilde{D}=\,\sup(\frac{4\Lambda\gamma}{2m_{1}-\delta},\,1)\,\tilde{K}(G)\,(2m_{1}\tilde{C}_{\beta\eta}+\tilde{B}_{\beta\eta}).$ This yields, for $\psi\in{\mathcal{D}}(\tilde{H}_{+}^{n})$, $g\|H_{I\,n}^{\ \,n+1}\psi\|\leq g\frac{\tilde{D}}{\gamma}\|(\tilde{H}_{+}^{n}+\sigma_{n+1})\psi\|\ .$ Hence it follows from [22, §V, Theorems 4.11 and 4.12] that (A.13) $g|(H_{I\,n}^{\ \,n+1}\psi,\,\psi)|\leq g\frac{\tilde{D}}{\gamma}(\,(\tilde{H}_{+}^{n}+\sigma_{n+1})\psi,\,\psi\,)\ .$ Let $g_{\delta}^{(2)}>0$ be such that $g_{\delta}^{(2)}\frac{\tilde{D}}{\gamma}<1\quad\mbox{and}\quad g_{\delta}^{(2)}\leq g_{\delta}^{(1)}\ .$ By (A.13) we get, for $g\leq g_{\delta}^{(2)}$, (A.14) $H^{n+1}=\tilde{H}_{+}^{n}+E^{n}+gH_{I\,n}^{\ \,n+1}\geq E^{n}-\frac{g\,\tilde{D}}{\gamma}\,\sigma_{n+1}+(1-\frac{g\,\tilde{D}}{\gamma})\tilde{H}_{+}^{n}\ .$ Because $(1-g\tilde{D}/\gamma)\tilde{H}_{+}^{n}\geq 0$ we get from (A.14) (A.15) $E^{n+1}\geq E^{n}-\frac{g\,\tilde{D}}{\gamma}\,\sigma_{n+1},\ n\geq 0\ .$ Suppose that $\psi^{n}\in{\mathfrak{F}}^{n}$ satisfies $\|\psi^{n}\|=1$ and for $\epsilon>0$, (A.16) $(\psi^{n},\,H^{n}\psi^{n})\leq E^{n}+\epsilon\ .$ Let (A.17) $\tilde{\psi}^{n+1}=\psi^{n}\otimes\Omega_{n}^{n+1}\in{\mathfrak{F}}^{n+1}\ .$ We obtain (A.18) $E^{n+1}\leq(\tilde{\psi}^{n+1},\,H^{n+1}\tilde{\psi}^{n+1})\leq E^{n}+\epsilon+g(\tilde{\psi}^{n+1},\ H_{I\,n}^{\ \,n+1}\,\tilde{\psi}^{n+1})$ By (A.13), (A.16), (A.17) and (A.18) we get, for every $\epsilon>0$, $E^{n+1}\leq E^{n}+\epsilon(1+\frac{g\,\tilde{D}}{\gamma})+\frac{g\,\tilde{D}}{\gamma}\,\sigma_{n+1}\ ,$ where $g\leq g_{\delta}^{(2)}$. This yields (A.19) $E^{n+1}\leq E^{n}+\frac{g\,\tilde{D}}{\gamma}\,\sigma_{n+1}\ ,$ and by (A.15), we obtain $|E^{n}-E^{n+1}|\leq\frac{g\,\tilde{D}}{\gamma}\,\sigma_{n+1}\ .$ For $n=0$, since $\sigma_{0}=\Lambda$, remind that $H_{0}^{\,0}=H_{0}^{n=0}=H_{0}^{\sigma_{0}}=H_{0}|_{{\mathfrak{F}}^{\Lambda}}$. Thus, the ground state energy of $H_{0}^{\,0}$ is $0$ and it is a simple isolated eigenvalue of $H_{0}^{\,0}$ with $\Omega^{0}$, the vacuum in ${\mathfrak{F}}^{0}$, as eigenvector. Moreover, since $\Lambda>m_{1}$, $\inf\left(\sigma(H_{0}^{\,0}\right)\setminus\\{0\\})=m_{1}\ ,$ thus $(0,m_{1})$ belongs to the resolvent set of $H_{0}^{\,0}$. By Hypothesis 3.1(iv) we have $H^{0}=H_{0}^{\,0}$. Hence $E^{0}=\\{0\\}$ is a simple isolated eigenvalue of $H^{0}$ and $H^{0}=H_{+}^{\,0}$. We finally get (A.20) $\inf\left(\sigma(H_{+}^{\,0})-\\{0\\}\right)=m_{1}>m_{1}-\frac{\delta}{2}=\sigma_{1}\ .$ We now prove Proposition 3.5 by induction in $n\in{\mathbb{N}}^{*}$. Suppose that $E^{n}$ is a simple isolated eigenvalue of $H^{n}$ such that $\inf\left(\sigma(H_{+}^{n})\setminus\\{0\\}\right)\geq(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n},\quad n\geq 1\ .$ Since (3.10) gives $\sigma_{n+1}<(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n}$ for $g\leq g_{\delta}^{(2)}$, $0$ is also a simple isolated eigenvalue of $\tilde{H}_{+}^{n}$ such that (A.21) $\inf\left(\sigma(\tilde{H}_{+}^{n})\setminus\\{0\\}\right)\geq\sigma_{n+1}\ .$ We must now prove that $E^{n+1}$ is a simple isolated eigenvalue of $H^{n+1}$ such that $\inf\left(\sigma(H_{+}^{n+1})\setminus\\{0\\}\right)\geq(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n+1}\ .$ Let $\lambda^{(n+1)}=\sup_{\psi\in{\mathfrak{F}}^{n+1};\,\psi\neq 0}\ \ \inf_{(\phi,\psi)=0;\,\phi\in{\mathcal{D}}(H^{n+1});\,\|\phi\|=1}(\phi,\,H_{+}^{n+1}\phi)\ .$ By (A.14) and (A.19), we obtain, in ${\mathfrak{F}}^{n+1}$ (A.22) $\begin{split}H_{+}^{n+1}&\geq E^{n}-E^{n+1}-\frac{g\tilde{D}}{\gamma}\sigma_{n+1}+(1-\frac{g\tilde{D}}{\gamma})\tilde{H}_{+}^{n}\\\ &\geq(1-\frac{g\tilde{D}}{\gamma})\tilde{H}_{+}^{n}-\frac{2g\tilde{D}}{\gamma}\sigma_{n+1}\ .\end{split}$ By (A.17), $\tilde{\psi}^{n+1}$ is the unique ground state of $\tilde{H}_{+}^{n}$ and by (A.21) and (A.22), we have, for $g\leq g_{\delta}^{(2)}$, $\begin{split}\lambda^{(n+1)}&\geq\inf_{(\phi,\tilde{\psi}^{n+1})=0;\,\phi\in{\mathcal{D}}(H^{n+1});\,\|\phi\|=1}(\phi,H_{+}^{n+1}\phi)\\\ &\geq(1-\frac{g\tilde{D}}{\gamma})\sigma_{n+1}-\frac{2g\tilde{D}}{\gamma}\sigma_{n+1}=(1-\frac{3g\tilde{D}}{\gamma})\sigma_{n+1}>0\ .\end{split}$ This concludes the proof of Proposition 3.5 by choosing $g_{\delta}=g_{\delta}^{(2)}$, if one proves that $H^{1}$ satisfies Proposition 3.5. By noting that $0$ is a simple isolated eigenvalue of $\tilde{H}_{+}^{0}$ such that $\inf(\sigma(\tilde{H}_{+}^{0})\setminus\\{0\\})=\sigma_{1}$, we prove that $E^{1}$ is indeed an isolated simple eigenvalue of $H^{1}$ such that $\inf(\sigma(H_{+}^{1})\setminus\\{0\\})\geq(1-\frac{3g\tilde{D}}{\gamma})\sigma_{1}$ by mimicking the proof given above for $H_{+}^{n+1}$. ∎ ## References * [1] Z. Ammari. Scattering theory for a class of fermionic Pauli-Fierz model. J. Funct. Anal., 208(2):302–359, 2004. * [2] L. Amour, B. Grébert, and J.-C. Guillot. A mathematical model for the Fermi weak interactions. Cubo, 9(2):37–57, 2007. * [3] W. O. Amrein, A. Boutet de Monvel, and V. Georgescu. $C_{0}$-groups, commutator methods and spectral theory of $N$-body Hamiltonians, volume 135 of Progress in Mathematics. Birkhäuser Verlag, Basel, 1996. * [4] V. Bach, J. Fröhlich, and A. Pizzo. Infrared-finite algorithms in QED: the groundstate of an atom interacting with the quantized radiation field. Comm. Math. Phys., 264(1):145–165, 2006. * [5] V. Bach, J. Fröhlich, and I. M.Sigal. Spectral analysis for systems of atoms and molecules coupled to the quantized radiation field. Comm. Math. Phys., 207(2):249–290, 1999. * [6] V. Bach, J. Fröhlich, I. M. Sigal, and A. Soffer. Positive commutators and the spectrum of Pauli-Fierz Hamiltonian of atoms and molecules. Comm. Math. Phys., 207(3):557–587, 1999. * [7] J.-M. Barbaroux, M. Dimassi, and J.-C. Guillot. Quantum electrodynamics of relativistic bound states with cutoffs. J. Hyperbolic Differ. Equ., 1(2):271–314, 2004. * [8] J.-M. Barbaroux and J.-C. Guillot, Limiting absorption principle at low energies for a mathematical model of weak interactions: the decay of a boson. To appear in C. R. Acad. Sci. Paris, Ser. I, 2009. * [9] J. Dereziński and C. Gérard. Asymptotic completeness in quantum field theory. Massive Pauli-Fierz Hamiltonians. Rev. Math. Phys., 11(4):383–450, 1999. * [10] J. Dereziński and V. Jakšić. Spectral theory of Pauli-Fierz operators. J. Funct. Anal., 180(2):243–327, 2001. * [11] J. Faupin, J. S. Møller, E. Skibsted. Regularity of bound states and second order perturbation theory I. and II. To appear. * [12] J. Fröhlich, M. Griesemer, and B. Schlein. Asymptotic completeness for Compton scattering. Comm. Math. Phys., 252(1-3):415–476, 2004. * [13] J. Fröhlich, M. Griesemer, and I. M. Sigal. Spectral theory for the standard model of non-relativistic QED. Comm. Math. Phys., 283(3):613–646, 2008. * [14] V. Georgescu, C. Gérard, J. S. Møller. Spectral theory of massless Pauli-Fierz models. Comm. Math. Phys., 249(1):29–78, 2004. * [15] V. Georgescu, C. Gérard, J. S. Møller. Commutators, $C_{0}$-semigroups and resolvent estimates. J. Funct. Anal., 216(2):303–361, 2004. * [16] J. Glimm, A. Jaffe. Quantum Field Theory and Statistical Mechanics. Birkhäuser, Boston inc., Boston MA, 1985, Expositions, Reprint of articles published in 1969–1977. * [17] S. Golénia. Positive commutators, Fermi golden rule and the spectrum of zero temperature Pauli-Fierz Hamiltonians. J. Funct. Anal., 256(8):2587-2620, 2009. * [18] W. Greiner and B. Müller. Gauge Theory of weak interactions Springer, Berlin, 1989. * [19] F. Hiroshima. Multiplicity of ground states in quantum field models: application of asymptotic fields J. Funct. Anal., 224(2):431–470, 2005. * [20] F. Hiroshima. Ground states and spectrum of quantum electrodynamics of non-relativistic particles Trans. Amer. Math. Soc. , 353:4497–4598, 2001. * [21] M. Hübner and H. Spohn. Spectral properties of the spin-boson Hamiltonian. Ann. Inst. H. Poincaré Phys. Théor., 62(3):289–323, 1995. * [22] T. Kato. Perturbation Theory for Linear Operators, volume 132 of Grundlehren der mathematischen Wissenschaften. Springer-Verlag, Berlin, 1 edition, 1966. * [23] E. Mourre. Absence of singular continuous spectrum for certain selfadjoint operators. Comm. Math. Phys., 78(3):391–408, 1980/81. * [24] M. Reed and B. Simon. Methods of modern mathematical physics. II. Fourier analysis, self-adjointness. Academic Press, New York, 1975. * [25] J. Sahbani. The conjugate operator method for locally regular Hamiltonians. J. Operator Theory, 38(2):297–322, 1997. * [26] E. Skibsted. Spectral analysis of ${N}$-body systems coupled to a bosonic field. Rev. Math. Phys., 10(7):989–1026, 1998. * [27] M. Srednicki. Quantum Field Theory. Cambridge University Press, 2007. * [28] Toshimitsu Takaesu. On the spectral analysis of quantum electrodynamics with spatial cutoffs I. Preprint arXiv: math-ph 0812.3482, 2008. * [29] B. Thaller. The Dirac Equation. Texts and Monographs in Physics. Springer-Verlag, Berlin, 1 edition, 1992. * [30] S. Weinberg. The quantum theory of fields. Vol. I. Cambridge University Press, Cambridge, 2005. Foundations. * [31] S. Weinberg. The quantum theory of fields. Vol. II. Cambridge University Press, Cambridge, 2005. Modern applications.
arxiv-papers
2009-04-21T13:12:53
2024-09-04T02:49:02.036161
{ "license": "Public Domain", "authors": "J.-M. Barbaroux, J.-C. Guillot", "submitter": "Jean-Marie Barbaroux", "url": "https://arxiv.org/abs/0904.3171" }
0904.3376
# Stability and chaotic behaviors of Bose-Einstein condensates in optical lattices with two- and three-body interactions Yan Chen Institute of Theoretical Physics, Lanzhou University, Lanzhou $730000$, China Ke-Zhi Zhang Physics and Electronics Engineering College, Northwest Normal University, Lanzhou 730070, China Yong Chen Corresponding author. Email: ychen@gmail.com Institute of Theoretical Physics, Lanzhou University, Lanzhou $730000$, China Key Laboratory for Magnetism and Magnetic Materials of the Ministry of Education, Lanzhou University, Lanzhou 730000, China ###### Abstract The stability and chaotic behaviors of Bose-Einstein condensates with two- and three-atom interactions in optical lattices are discussed with analytical and numerical methods. It is found that the steady-state relative population appears tuning-fork bifurcation when the system parameters are changed to certain critical values. In particular, the existence of three-body interaction not only transforms the bifurcation point of the system but also affects greatly on the macroscopic quantum self-trapping behaviors of the system associated with the critically stable steady-state solution. In addition, we also investigated the influence of the initial conditions, three- body interaction and the energy bias on the macroscopic quantum self-trapping. Finally, by applying the periodic modulation on the energy bias, we find that the relative population oscillation exhibits a process from order to chaos, via a series of period-doubling bifurcations. ###### pacs: 03.75.Kk, 67.85.Jk, 03.65.Ge, ## I Introduction In Recent years, Bose-Einstein condensates (BECs) in optical lattices have attracted enormous attention both experimentally and theoretically ce1 ; ce2 . This is mainly because the lattice parameters and interaction strength can be manipulated using a modern experimental technique. Making use of this, researchers have discovered many long-predicted phenomena, for example non- linear Landau-Zener tunneling, energetic and dynamical instability and the strongly inhibited transport of one-dimensional BEC in optical lattices ce3 ; ce4 ; ce5 ; ce6 ; ce7 ; ce8 ; ce9 ; ce10 . More attracting phenomena, namely, self-trapping, was recently observed experimentally in this system ce11 . In such an experiment, a BEC cloud with repulsive interaction initially loaded in optical lattices was self-trapped. Many theoretical analysis was also presented about self-trapping ce12 ; ce13 ; ce14 ; ce15 . It is well know the macroscopic quantum self-trapping (MQST) means self-maintained population imbalance with non-zero average value of the fractional population imbalance which was detailed discussed ce16 ; ce17 . Marino et. al. considered that the damping decays all different oscillations to the zero-phase mode ce18 . Besides, macroscopic quantum fluctuations have also been discussed by taking advantage of second-quantization approaches ce19 . However, when the trapping potential is time dependent and the damping and finite-temperature effect can not be neglected, chaos emerges. Abdullaev and Kraenkel studied the nonlinear resonances and chaotic oscillation of the fractional imbalance between two coupled BEC’s in a double-well trap with a time-dependent tunneling amplitude for different damping ce20 . When the asymmetry of the trap potential is time- dependent and its amplitude is so small that can be took as a perturbation, Lee et al. studied the chaotic and frequency-locked atomic population oscillation between two coupled BECs with a weak damping, and discovered that the system comes to an stationary frequency-locked atomic population oscillations from transient chaos ce21 . It is important to note that theoretical studies of stability are mainly focused on the effect of two-body interactions. It is clear that in low temperature and density, where interatomic distance is much greater than the distance scale of atom-atom interactions, two-body s-wave scattering should be important and three-body interactions can be neglected. But, if the atom density is higher, for example, in the case of BEC in optical lattices, three- body interactions will play an important role ce22 . As reported in Ref. ce23 , even for a small strength of the three-body force, the region of stability for the condensate can be extended considerably. Therefore, the purpose of this paper is to investigate the steady-state solution of BEC in an one-dimensional periodic optical lattice when both the two-body and three-body interactions are taken into account. By using the mean-field approximation and linear stability theorem, one interesting result is found that the tuning-fork bifurcation of steady-state relative population appears when the system parameters are changed to certain critical values. The existence of three-body interaction not only transforms the bifurcation point of the system but also affects greatly on the self-trapping behaviors of the system associated with the critically stable steady-state solutions. Additionally, we also study the effects of the initial conditions, three-body interaction and the energy bias on the MQST. Besides, we discuss the chaos behaviors of the system by applying the periodic modulation on the energy bias. The result shows the relative population oscillation can undergo a process from order to chaos, via a series of period-doubling bifurcations. This paper is organized as follows. In Sec. II, we introduce the mean-field description of BEC in optical lattices with two- and three-atom interactions. In Sec. III, with linear stability theorem, we analysis the stability of steady-state solutions. Then the influences of three-body interaction on the macroscopic quantum self-trapping of the system are displayed In Sec. IV. In Sec. V, by applying the periodic modulation in the energy bias, we discuss chaotic behaviors of the system using the numerical simulation method. In the last section, summary and conclusion of our work are presented. ## II Mean-field description of BEC in optical lattices with two- and three- atom interactions We focus our attention on a BEC with both two- and three-body interactions is subjected to one dimensional (1D) optical lattices where the motion in the perpendicular directions is confined. In the mean-field approximation , the dynamics of BEC can be modeled by the 1D Gross-Pitaevskii (GP) equation in the comoving frame of the lattice ce3 ; ce6 ; ce24 ; ce25 , $i\hbar\frac{\partial\Phi}{\partial t}=-\frac{1}{2m}\left(\hbar\frac{\partial}{\partial t}-ima_{l}t\right)^{2}\Phi+\upsilon_{0}\cos(2K_{l}x)\Phi+\frac{2\hbar^{2}a_{s}}{a_{\bot}^{2}m}|\Phi|^{2}\Phi+\frac{g_{2}}{3\pi^{2}a_{\bot}^{4}}|\Phi|^{4}\Phi,$ (1) where $\Phi$ is the wave function of the condensate, $m$ is the mass of atoms, $a_{s}$ is the two-body s-wave scattering length, $\upsilon_{0}$ is the strength of the periodic potential, $K_{l}$ is the wave number of the laser light which is used to generate the optical lattice, $ma_{l}$ stands for either the inertial force in the comoving frame of an accelerating lattice or the gravity force, $a_{\bot}=\sqrt{\hbar/(m\omega_{\bot})}$, where $\omega_{\bot}$ is the radial frequencies of the anisotropic harmonic trap, $g_{2}|\Phi|^{4}\Phi/(3\pi^{2}a_{\bot}^{4})$ is three-body interactions related to the GP equation. Among Eq. (1), all the variables can be rescaled to be dimensionless by the following system’s basic parameter $x\sim 2K_{l}x,\Phi\sim\frac{\Phi}{\sqrt{2K_{l}N}},t\sim\frac{4\hbar}{m}K_{l}^{2}t$. we obtain the normalized 1D-GP equation in optical lattices with cubic and quintic nonlinearities, $i\frac{\partial\Phi}{\partial t}=-{{1}\over{2}}\left(\frac{\partial}{\partial t}-i\alpha t\right)^{2}\Phi+\upsilon\cos(x)\Phi+c|\Phi|^{2}\Phi+\lambda|\Phi|^{4}\Phi,$ (2) where $\upsilon=\frac{m\upsilon_{0}}{4\hbar^{2}K_{l}^{2}},\alpha=\frac{m^{2}}{8\hbar^{2}K_{l}^{3}}a_{l},c=\frac{Na_{s}}{K_{l}a\bot^{2}}$ is the effective two-body interaction, $N$ is the total numbers of atoms, $\lambda=\frac{mg_{2}N^{2}}{3\pi^{2}\hbar^{2}a_{\bot}^{4}}$ is the effective interaction among three atoms, here the three-body interaction is expected to be positive with a value of $0<\lambda<1$. In the neighborhood of the Brillouin Zone edge $k=1/2$, the wave function can be approximated by ce3 $\Phi(x,t)=a(t)e^{ikx}+b(t)e^{i(k-1)x},$ (3) where $a(t)$, $b(t)$ are the probability amplitudes of atoms in each of the two wells respectively and $|a|^{2}+|b|^{2}=1$. By inserting such wave functions into Eq. (2) and performing some spatial integrals, we obtain the dynamical equations with two- and three-body interactions. $\displaystyle i\frac{\partial a}{\partial t}$ $\displaystyle=$ $\displaystyle\frac{\gamma}{2}a+\frac{c}{2}\left(|b|^{2}-|a|^{2}\right)a+\lambda\left(1+2|a|^{2}|b|^{2}+2|b|^{2}\right)a+\frac{\upsilon}{2}b,$ (4) $\displaystyle i\frac{\partial b}{\partial t}$ $\displaystyle=$ $\displaystyle-\frac{\gamma}{2}b-\frac{c}{2}\left(|b|^{2}-|a|^{2}\right)b+\lambda\left(1+2|a|^{2}|b|^{2}+2|b|^{2}\right)b+\frac{\upsilon}{2}a.$ (5) Here, the level bias $\gamma(t)=\alpha t$, and $\alpha$ is the sweeping rate, $c$ and $\lambda$ represent the nonlinear parameters, $\upsilon$ is the coupling constant between the two condensates. We introduce the relative population variance $s=|b|^{2}-|a|^{2},$ (6) with the parameters $a=|a|e^{i}\theta_{a}$, $b=|b|e^{i}\theta_{b}$, $\theta=\theta_{b}-\theta_{a}.$ (7) Combining Eqs. (4-7), one yields the equations of the relative population and relative phase, $\displaystyle\dot{s}$ $\displaystyle=$ $\displaystyle-\upsilon\sqrt{1-s^{2}}\sin\theta,$ (8) $\displaystyle\dot{\theta}$ $\displaystyle=$ $\displaystyle\gamma+(c+2\lambda)s+\frac{\upsilon s}{\sqrt{1-s^{2}}}\cos\theta.$ (9) $\dot{s}$ and $\dot{\theta}$ denote the time derivative of the relative population and the relative phase. If we regard $s$ and $\theta$ as the canonically conjugate variables Eqs. (8) and (9), become a pair of Hamilton’s canonical equations with the conserved effective Hamiltonian $H=\gamma s+\frac{1}{2}(c+2\lambda)s^{2}+\upsilon\sqrt{1-s^{2}}\cos\theta.$ (10) In the following section, we will discuss the stability of steady-state in the symmetric condition ($\gamma=0$) with linear stability theorem. ## III Stability analysis of the steady-state solutions In Sec. II, we have given the dynamical equations of the system with three- body interaction. In this section, we will discuss the stability of steady- state in the symmetric condition. Generally, there are two ways to study the stability of nonlinear system, the linear stability theorem and the Lyapunov direct method. We will investigate the stability of the system with the first method. The steady-state solution of this system can be obtained by setting Eqs. (8) and (9) to zero. The forms of steady-state solutions are very complicated when the level bias $\gamma\neq 0$. For simplicity, we set $\gamma=0$, leading to $\displaystyle\dot{s}$ $\displaystyle=$ $\displaystyle f_{1}(s,\theta)=-\upsilon\sqrt{1-s^{2}}\sin\theta,$ (11) $\displaystyle\dot{\theta}$ $\displaystyle=$ $\displaystyle f_{2}(s,\theta)=(c+2\lambda)s+\frac{\upsilon s}{\sqrt{1-s^{2}}}\cos\theta.$ (12) and the conserved energy $H=\frac{1}{2}(c+2\lambda)s^{2}+\upsilon\sqrt{1-s^{2}}\cos\theta.$ (14) Taking $\dot{s}=0$, $\dot{\theta}=0$, we get $\displaystyle-\upsilon\sqrt{1-s^{2}}\sin\theta$ $\displaystyle=$ $\displaystyle 0,$ (15) $\displaystyle(c+2\lambda)s+\frac{\upsilon s}{\sqrt{1-s^{2}}}\cos\theta$ $\displaystyle=$ $\displaystyle 0.$ (16) The steady-state solutions obeyed Eqs. (14) and (15) regard as $\displaystyle\theta_{1}$ $\displaystyle=$ $\displaystyle 2n\pi,\quad s_{1}=0\quad\mathrm{for}\quad H=-\upsilon,$ (17) $\displaystyle\theta_{2}$ $\displaystyle=$ $\displaystyle(2n+1)\pi,\quad s_{2}=0\quad\mathrm{for}\quad H=\upsilon,$ (18) $\theta_{3,4}=(2n+1)\pi,\quad s_{3,4}=\pm\sqrt{1-(\frac{\upsilon}{c+2\lambda})^{2}}\quad\mathrm{for}\quad H=\frac{(c+2\lambda)^{2}+\upsilon^{2}}{2(c+2\lambda)^{2}}.$ (19) According to the linear stability theorem, we look for the perturbed solutions which are near the steady-state solutions, $s(t)=s_{i}(t)+\varepsilon_{1}(t),\qquad\theta(t)=\theta_{i}(t)+\varepsilon_{2}(t)$ (20) where $s_{i}(t)$, $\theta_{i}(t)$ for $i=1,2,3,4$ signify the steady-state solutions, $|\varepsilon_{1}(t)|\ll|s_{i}(t)|$ and $|\varepsilon_{2}(t)|\ll|\theta_{i}(t)|$ which is relate to the first-order perturbed. Inserting the above expression into Eqs. (11) and (12), we can obtain the linear equations near to the steady-states of the nonlinear equations as $\dot{\varepsilon_{1}}=\left(\frac{\partial f_{1}}{\partial s}\right)_{1}\varepsilon_{1}+\left(\frac{\partial f_{1}}{\partial\theta}\right)_{1}\varepsilon_{2}\qquad namely\qquad\dot{\varepsilon_{1}}=a_{11}\varepsilon_{1}+a_{12}\varepsilon_{2}$ (21) $\dot{\varepsilon_{2}}=\left(\frac{\partial f_{2}}{\partial s}\right)_{2}\varepsilon_{1}+\left(\frac{\partial f_{2}}{\partial\theta}\right)_{2}\varepsilon_{2}\qquad namely\qquad\dot{\varepsilon_{2}}=a_{21}\varepsilon_{1}+a_{22}\varepsilon_{2}$ (22) Now, we make use of the above expression to investigate the stability of the steady-states of Eqs. (16-18). (1)For $\theta_{1}=2n\pi,s_{1}=0,H=-\upsilon$, we can calculate the matrix elements $a_{11}=0$, $a_{12}=-\upsilon$, $a_{21}=(c+2\lambda)+\upsilon$, $a_{22}=0$. So, the coefficient matrix of the linearized equations (20) and (21) becomes $A_{1}=\left[\begin{array}[]{cc}{0}&{-\upsilon}\\\ {c+2\lambda+\upsilon}&{0}\\\ \end{array}\right]$ such that the characteristic equation writes $\det(A_{1}-\lambda I)=\left[\begin{array}[]{cc}{0-\lambda}&{-\upsilon}\\\ {c+2\lambda+\upsilon}&{0-\lambda}\\\ \end{array}\right]=0$, which reveals that $\lambda^{2}+\upsilon(c+2\lambda+\upsilon)=0$. We solve the equation to get the two eigenvalues of the matrix A as $\lambda_{1}=\sqrt{-\upsilon(c+2\lambda+\upsilon)},\lambda_{2}=-\sqrt{-\upsilon(c+2\lambda+\upsilon)}$. In response to the forms of the eigenvalues, there exist two cases for the stabilities: (a) $\upsilon(c+2\lambda+\upsilon)\geq 0$, that is $\upsilon>0\quad and\quad(c+2\lambda)\geq-\upsilon$ (23) $\upsilon<0\quad and\quad(c+2\lambda)\leq-\upsilon$ (24) so the two eigenvalues are both pure imaginary numbers. Thus, the stability of the steady-state solutions $(\theta_{1},s_{1})$ corresponds to a critical case ce26 and the dynamical bifurcations between the unstable and stable steady- states will appear when the parameters with two- and three-body interactions are changed. (b) $\upsilon(c+2\lambda+\upsilon)<0$, namely $\upsilon>0\quad and\quad(c+2\lambda)<-\upsilon$ (25) $\upsilon<0\quad and\quad(c+2\lambda)>-\upsilon$ (26) so the two eigenvalues are real number. It means that $\varepsilon_{1}$ and $\varepsilon_{2}$ tend to infinity with the increase of time, and the steady- state solutions $(\theta_{1},s_{1})$ are unstable. (2)For $\theta_{2}=(2n+1)\pi$, $s_{2}=0$, $H=\upsilon$, the matrix elements write as $a_{11}=0,a_{12}=-\upsilon,a_{21}=(c+2\lambda)-\upsilon,a_{22}=0$. The corresponding eigenvalues of the matrix $A_{2}$ become $\lambda_{1}=\sqrt{-\upsilon(\upsilon-(c+2\lambda))},\lambda_{2}=-\sqrt{-\upsilon(\upsilon-(c+2\lambda))}$. Similarly, there are two cases of the stabilities: (a) $\upsilon(\upsilon-(c+2\lambda))>0$, that is $\displaystyle(c+2\lambda)>0\quad$ $\displaystyle\mathrm{and}\quad\upsilon>(c+2\lambda)$ (27) $\displaystyle(c+2\lambda)<0\quad$ $\displaystyle\mathrm{and}\quad\upsilon>0.$ (28) so the two eigenvalues are both pure imaginary numbers. And the stability of the steady-state solutions $(\theta_{2},s_{2})$ of the nonlinear equations are reviewed as critical and the dynamical bifurcations will occur. (b) $\upsilon(\upsilon-(c+2\lambda))\leq 0$, that is $\displaystyle\upsilon>0\quad$ $\displaystyle\mathrm{and}$ $\displaystyle\quad(c+2\lambda)\geq\upsilon$ (29) $\displaystyle(c+2\lambda)<\upsilon\quad$ $\displaystyle\mathrm{and}$ $\displaystyle\quad\upsilon<0$ (30) so the two eigenvalues are positive or negative real number, respectively. $\varepsilon_{1}$, $\varepsilon_{2}$ tend to infinity as increasing the time to infinity, and the steady-state solutions $(\theta_{2},s_{2})$ are losing their stability. (3)For $\theta_{3,4}=(2n+1)\pi,s_{3,4}=\pm\sqrt{1-(\frac{\upsilon}{c+2\lambda})^{2}},H=\frac{(c+2\lambda)^{2}+\upsilon^{2}}{2(c+2\lambda)^{2}}$, the matrix elements read $a_{11}=0$, $a_{12}=\upsilon^{2}/(c+2\lambda)$, $a_{21}=(c+2\lambda)-(c+2\lambda)^{3}/\upsilon^{2}$, $a_{22}=0$, and the eigenvalues $\lambda_{1}=\sqrt{\upsilon^{2}-(c+2\lambda)^{2})}$, $\lambda_{2}=-\sqrt{\upsilon^{2}-(c+2\lambda)^{2})}$. In Eq. (18) the population $s_{3,4}$ are both real quantities which implies $(c+2\lambda)^{2}>\upsilon^{2}$ (31) Figure 1: Plots of the tuning-fork bifurcation from Eqs. (17) and (18), where $s_{2},s_{3},s_{4}$ are the steady-state solutions and the bifurcation point is $\frac{\upsilon}{c+2\lambda}=1$ Therefore, the two eigenvalues are pure imaginary numbers. The stability of the steady-state solutions$(\theta_{3,4},s_{3,4})$ of the nonlinear equations are regarded as critical and the dynamical bifurcations will emerge at the bifurcation point $(c+2\lambda)=\upsilon$, $s=0$. Obviously, the existence of three-body interaction can change the bifurcation point of the system. It plays a important role for stability analysis of the system, as shown in Fig. 1. For $\frac{\upsilon}{c+2\lambda}>1$, the system is in the critically stable steady-state ($\theta_{2},s_{2}$), and for $\frac{\upsilon}{c+2\lambda}<1$, ($\theta_{2},s_{2}$) is unstable and the two steady-state solutions ($\theta_{3,4},s_{3,4}$) are critically stable. This is a typical tuning-fork bifurcation, and the bifurcation point is $\frac{\upsilon}{c+2\lambda}=1$ According to the above analysis, we conclude that three steady-state solutions possess different stability for different parameter regions. And it is very interesting to arrive at the critically stable steady-state solution in experiment which relate to the stable stationary MQST ce26 . In the following section, we will illustrate the MQST of the non-stationary states in detail by two different methods. ## IV The macroscopic quantum self-trapping of BEC with two- and three-atom interactions In this section, we investigate the macroscopic quantum self-trapping by plotting the phase trajectories and the time evolution of the relative population of the system. ### IV.1 The phase trajectories diagram The macroscopic quantum self-trapping refers to the phase space trajectories whose the relative population is not equal zero. This can be well understood from the analysis Eqs. (8)-(10), corresponding to the critically stable steady-state solutions discussed in sec.II. Three kinds of cases occur with different three-body interaction parameters, as shown in Fig.2. (1) In the case of $\upsilon=0.2,c=0.1,0<\lambda<0.05$ in the phase space , there are two stable points $P_{1},P_{2}$ at $s=0,\theta=\pi$ and $s=0,\theta=0$ respectively [Fig. 2(a)], from the circumstance described by Eqs. (22) and (26). Obviously, for the stable points $P_{1}$, $P_{2}$, the atoms distributions are equal in the two adjacent wells, the relative population of the trajectories around them is equal to $0$. It means that atoms oscillate between two adjacent wells and the macroscopic quantum self- trapping phenomenon does not emerge in this case. (2) When parameter is set to $\upsilon=0.2$, $c=0.1$, $0.05\leq\lambda<0.15$, two more fixed points emerge in the line $\theta=\pi$ marked by $P_{3}$, $P_{4}$. Among them, $P_{1}$, $P_{3}$ are steady which is corresponding to condition of Eq. (30). They are located in $s=\pm\sqrt{1-(\frac{\upsilon}{c+2\lambda})^{2}}$, hence, $P_{4}$ is unstable point which lies in $s=0$ and corresponds to condition of Eq.(26). As seen from Fig. 2(b), for the stable points $P_{1},P_{3}$, the atoms distributions are not equilibrium between two adjacent wells, and the relative population of the trajectories around them is not equal to $0$. It indicates that atoms are self-trapped in one well. We take it as oscillating-phase-type because the relative population $s$ and the relative phase $\theta$ oscillate around the fixed points. Figure 2: Trajectories on the phase space of the system with three-body interaction varying from $\lambda=0$ to $\lambda=0.25$(the first row). Corresponding to in the second row we plot the energy profiles for the relative phase $\theta=0$ (red dashed) and $\theta=\pi$ (blue solid) (3) For $\upsilon=0.2,c=0.1$, $\lambda\geq 0.15$ , It emerges new trajectories , i.e.the trajectories across point $P_{c}$ [Fig. 2(c)]. Only the fixed point $P_{2}$ is stable which is relate to Eq. (22). So for these trajectories, $s$ varies with time from region of $[-1,0]$ to $[0,1]$, Apparently $\langle s\rangle\neq 0$, atoms are self-trapped in one well. We regard it as running- phase-type macroscopic quantum self-trapping, as described in Refs. ce27 ; ce28 and observed in experiment ce29 . The above changes on the topological structure of the phase space are concerned with the change of the energy profile. When the relative phase is zero or $\pi$, energy relying on the parameter with three-body interaction and the average population $s$ can be derived from Eq. (10). Seeing Fig. 2 , the transition from case(1)to case(2) corresponds to the bifurcation of the energy profile of $\theta=\pi$: energy curve bifurcates from a single minimum to the curve of two minima. It means the system goes from the Rabi regime into the self-trapping regime through this bifurcation. The lowest order of energy profile with $\theta=0$ is $-\frac{c+2\lambda}{2}$, and the energy of the unstable point $P_{4}$ is $-\upsilon$ which is located on the maximal order of energy profile with $\theta=\pi$. The results displayed by the phase space trajectories conform to the case of steady-state solutions discussed in Sec.III. The transition from case (2) to case(3) is signified by the overlap of the two energy regions of the profile. In this condition the trajectory stared from $s=-1$, $\theta=0$ should be confined to the lower half of phase plane, corresponding to the running-phase-type macroscopic quantum self- trapping. Connecting the analysis of the steady-state solutions to the above analysis on the energy profile, it concludes that stable behaviors of the system change constantly with the increase of $\lambda$ and we obtain a general criterion for the macroscopic quantum self-trapping trajectories, namely, $H(s,\theta)<-\upsilon$. It plays a critical role to find the transition parameters of macroscopic quantum self-tapping. ### IV.2 Numerical simulations of the MQST Now, we focus on the dynamic behavior which dominated by Eq. (8) and (9) without the time-dependent system parameters. We study the effect parameters of the system on the MQST with numerical method starting form Eq. (8) and (9). Figure 3: The time evolution of the relative population from Eqs.(8) and (9) with initial conditions $s(0)=0$, $\theta_{0}=\pi/2$ and parameter: (a) $c=0.1$, $\lambda=0.45$, $v=0.2$, and $\gamma=0$; (b) $c=0.1$, $\lambda=0.95$, $v=0.2$, and $\gamma=0$; (c) $c=0.1$, $\lambda=0.45$, $v=0.8$, and $\gamma=0$; (d) $c=0.1$, $\lambda=0.45$, $v=0.2$, and $\gamma=0.5$; (e) $c=0.1$, $\lambda=0.95$, $v=0.2$, and $\gamma=0.5$; (f) $c=0.1$, $\lambda=0.45$, $v=0.8$, and $\gamma=0.5$; Figure 4: the time evolution of the relative population from Eqs. (8) and (9). (a) initial conditions $s(0)=0.8$, $\theta_{0}=\pi$ (b) initial conditions $s(0)=0.8$, $\theta_{0}=\pi/2$, and the other parameters $c=0.1$, $\lambda=0.45$, $v=0.2$, and $\gamma=0$. Choosing initial condition $s(0)=0$, $\theta(0)=\pi/2$, the time evolutions of the relative population Fig. (3a)-(3d) show some very absorbing features. In Fig. 3(a), the oscillations are regular and the average the relative population $\bar{s}$ is zero for symmetric well case ($\gamma=0$) with a special parameter, but the corresponding MQST does not appear. If we increase $\lambda$ from 0.45 to 0.95 in Fig. 3(b), the MQST does not still appear, but the oscillating period becomes short. Similarly, rising $\upsilon$ , we obtain the same result as shown in Fig. 3(c). Here, we study impacting asymmetric well case ($\gamma\neq 0$) on the MQST. when we enhance the level bias to $\gamma=0.5$ the average the relative population is changed to $-0.41$ in Fig.3(d). Correspondingly, the oscillating period of $s$ is longer and the MQST emerges. Note that parameter $c$, $\lambda$ and $\upsilon$ impact greatly on the MQST which are plotted in Fig. 3(e) and (f). In fig. 3(e), when $\lambda$ is from $0.45$ to $0.95$, the MQST is suppressed with shorter oscillating period. Similarly, with increasing $\upsilon$, the average relative population are changed to $-0.21$ and the oscillating period becomes shorter again, as seen in Fig. 3(f). Thus, the influence of parameter $c$ ,$\lambda$ ,$\upsilon$ and $\gamma$ on the MQST of the system is very dramatic. In the case of $\gamma=0$, fixing the other parameters and changing the initial condition from $s(0)=0,\theta(0)=\pi/2$ of Fig.3 to $s(0)=0.8,\theta(0)=\frac{\pi}{2}$ and $s(0)=0.8,\theta(0)=\pi$, we observe that the MQST always emerges with varying $s(0),\theta(0)$. The oscillating period is decreased comparing to Fig.3(a)and Fig. 3(d), but the $\bar{s}$ is increased to $-0.86,-0.72$ as shown in Fig. 4. According to the above analysis, we can draw conclusion that when the initial conditions $s(0)=0$, $\theta(0)=\pi/2$ are read, the parameter $c$, $\lambda$, $\upsilon$ can impact on the MQST for asymmetric well case($\gamma\neq 0$). In addition, in the symmetric case, the MQST does not appear and those parameters only affect the oscillating period of the system. Besides, the initial conditions can impact the MQST for anyone parameter set. ## V Numerical simulation of chaos by applying periodic modulation on the lever bias As a whole, the elementary features of chaos is that the dynamic behaviors are unpredictable for a deterministic system. It is very sensitive for the initial conditions and parameters of the system. So, according to these characteristics, we can adjust the parameters to make the system get into or get out of the chaos, in other words, we can control the regime appearing chaos. In this section We discuss the chaotic behaviors of the system by numerical method. Figure 5: Dynamical phase orbits of the dimensionless variables ($s,ds/dt$) from Eqs. (31) and (32) with parameters $\upsilon=0.001$, $c=0.1$, $\lambda=0.45$, $\omega=0.1$, $s(0)=0$, $\theta_{0}=\pi$, and (a) $A_{1}=0.002$, (b) $A_{1}=0.009$, (c) $A_{1}=0.04$, (d) $A_{1}=0.12$, (e) $A_{1}=0.3$, (f)=$A_{1}=1$. Here, $A_{1}$ denotes the amplitude of the time- dependent relative energy. If we apply periodic modulation on the lever bias $\gamma=A_{0}+A_{1}sin(\omega t)$, the chaos will appear in a special region, where $A_{0},A_{1}$ stand for initial phase and amplitude respectively. Inserting this into Eqs. (8)and (9), one derives the below dynamic equation. $\displaystyle\dot{s}$ $\displaystyle=$ $\displaystyle-\upsilon\sqrt{1-s^{2}}\sin\theta$ (32) $\displaystyle\dot{\theta}$ $\displaystyle=$ $\displaystyle A_{0}+A_{1}\sin(\omega t)+(c+2\lambda)s+\frac{\upsilon s}{\sqrt{1-s^{2}}}\cos\theta$ (33) Figure 6: (a) and (b): The time evolution of the relative population of the relative population from Eqs. (31)and (32) with the parameters $\upsilon=0.001$, $A_{0}=0.4$, $c=0.1$, $\lambda=0.45$, $\omega=0.1$, $s(0)=0$, $\theta(0)=\pi$, and (a) $A_{1}=0.002$, (b) $A_{1}=0.3$ (c) and (d): The corresponding power spectrum, where the parameters in Fig. 6(c)are the same with Fig. 6(a) and the parameters in Fig. 6(d)are the same with Fig. 6(b). Starting from Eqs. (32), It is found that the dynamics behavior of the system is periodic in some special parameters region and it will vary from order to chaos with the increase of $A_{1}$ , as shown in Fig.5. With initial conditions $s(0)=0,\theta(0)=\pi$, the phase orbit is a period-one cycle and the corresponding oscillation is a Rabi oscillation for the set of parameters with amplitude $A_{1}=0.002$, as in Fig. 5(a). In this case, we set the oscillating period of the relative population $T$. When $A_{1}=0.009$, the phase orbit becomes period-two in Fig. 5(b). It means the oscillating period of $s$ arriving at $2T$. Then the phase orbit increases from that of period- four to period-eight with increasing $A_{1}$ as shown in Fig. 5(c)and (d). Fig. 5(e) and 5(f) are plotted for $A_{1}=0.3$ and $A_{1}=1$, where the phase orbit does not show a clear periodicity which signifies the emergence of chaos. From the above analysis, we find that the oscillating period of the relative population varies from a period-one limit-cycle to period-two to period-four and then to period-eight and finally all limit-cycles tend to infinity with $\gamma$ increasing. It exhibits a process from order to chaos, through the period-doubling bifurcations ce26 . That is to say, for a set of fixed parameter $\upsilon$, $c$, $\lambda$, $A_{0}$, $A_{1}$, $s(0)$, $\theta(0)$ and $\omega$, the first-order derivative of relative population transform from the single period to multiple period and get into chaos at last with the increase of vibration amplitude $A_{1}$. For the aim of showing the chaotic MQST, we present the plots of the time evolution of the relative population and corresponding plots of power spectra from Eqs. (31) and (32) in Fig. 6. And the parameter of Fig.5(a) is accord with Fig. 6(a) and 6(c) where the system oscillates periodically. Making use of those parameters of Fig. 5(e), we plot Fig. 6(b)and 6(d). It shows that the power spectrum appears confusion and the average value of the relative population is less than zero, which implies the existence of the chaotic behaviors . ## VI Summary and conclusion In this paper, we study the stability and chaos of BEC with repulsive two- and three-body interactions immersed in a one-dimensional optical lattice. The stability of the steady-state solution are analyzed with the linear stability theorem. The analytical results show: (1) For $\upsilon>0$ and $c+2\lambda\geq-\upsilon$ or $\upsilon<0$ and $c+2\lambda\leq-\upsilon$, the stability of the steady-state solution($\theta_{1}=2n\pi,s_{1}=0$) is in the critical case. (2) For $c+2\lambda>0$ and $\upsilon>c+2\lambda$ or $c+2\lambda<0$ and $\upsilon>0$, the steady-state solution($\theta_{2}=(2n+1)\pi,s_{2}=0$) is the critical stability. (3) For $(c+2\lambda)_{2}>\upsilon_{2}$, the steady-state solution ($\theta_{3,4}=(2n+1)\pi,S_{3,4}=\pm\sqrt{1-(\frac{\upsilon}{c+2\lambda})^{2}}$) is also critically stable. When these relationship are not satisfied, the corresponding steady-state solution are unstable. A typical tuning-fork bifurcation of steady-state relative population appears in special parameter region. And the existence of three-body interaction can change the bifurcation point of the system, which is shown as Fig. 1. It plays a important role for stability analysis of the system. The critically stable steady-state solution indicates the existence of the stationary MSQT. The stable behaviors of the system change constantly with the increase of $\lambda$ and get a general criteria for the self-trapping trajectories, $H<-\upsilon$. In addition, we also investigate the effects of the initial conditions, a set of parameters $c,\upsilon,\lambda,\gamma$ on MQST. It shows that $c,\upsilon,\lambda$ could affect on the MQST when $s(0)=0,\theta_{0}=\pi$ for $\gamma\neq 0$. Particularly, the initial value $s(0)=0,\theta_{0}=\pi$ or $s(0)=0,\theta_{0}=\pi/2$ can directly impact on the MQST. Finally, we discuss the chaos behaviors by applying the modulation on the energy bias ($\gamma=A_{0}+A_{1}sin\omega t$). In this case, the system will go into chaos through the period-doubling bifurcations with the increasing of $\lambda$, and the time evolution of the relative population and power spectra indicate the existence of the chaos MQST. It suggests that one can adjust the lasing detuning and intensity to change the values of the parameters in experiments. This adjustable parameters supply the possibility for controlling the instabilities of the system, MQST state and the chaotic behaviors. ###### Acknowledgements. This work was supported by the National Natural Science Foundation of China and by the Open Project of Key Laboratory for Magnetism and Magnetic Materials of the Ministry of Education, Lanzhou University. ## References * (1) J. K. Chin, D. E. Miller, Y. Liu, C. stan, W. Setiawan, C. Sanner, K. Xu, and W. Ketterle, Nature (London) 443, 961 (2006). * (2) J. K. Xue and A. X. Zhang, Phys. Rev. Lett. 101, 180401 (2008). * (3) B. Wu and Q. Niu, Phys. Rev. A 61, 023402 (2000). * (4) B. Wu, R. B. Diener, and Q. Niu, Phys. Rev. A 65, 025601 (2002). * (5) J. Liu et al., Phys. Rev. A 66, 023404 (2002). * (6) L. M. JonaM, O. Morsh, M. Cristiani, N. Malossi, J. H. Muller, E. Couritade, M. Anderlini, and E. Arumondo, Phys. Rev. Lett. 91, 230406 (2003). * (7) D. Diakonov et al., Phys. Rev. A 66, 013064 (2002). * (8) Mueller E J, Phys. Rev. A 66. 063603 (2002). * (9) L. Fallni, L. D. Sarlo, J. E. Lye, M. Modugno, R. Saer, C. Fort, and M. Inguscio, Phys. Rev. Lett. 93, 140406 (2004). * (10) T. Koponen, J. P. Martikainen, J. Kinnunen, and P. Torma, Phys. Rev. A 973, 033620 (2006). * (11) S. K. Adhikari and B. A. Malomed, Europhy. Lett. 79, 50003 (2007); Phys. Rev. A 76, 043626 (2007). * (12) B. Wu and Q. Niu, New J. Phys. 5, 104 (2003). * (13) O. Morsch and M. Oberthaler, and D. Ionut, Rev. Mod. Phys. 78, 179 (2006). * (14) B. Liu, L. B. Fu, S. P. Yang, and J. Liu, Phys. Rev. A 75, 033601 (2007). * (15) G. F. Wang, D. F. Ye, L. B. Fu, X. Z. Chen, and J. Liu, Phys. Rev. A 74, 033414 (2006). * (16) A. Smerzi, S. Fantoni, S. Giovanzzi, and S. R. Shenoy, Phys. Rev. Lett. 79, 4950 (1997). * (17) S. Raghavan, A. Smerzi, S. Fantoni, and S. R. shenoy, Phys. Rev. A 59, 620 (1999). * (18) I. Marino, S. Fantoni, S. R. shenoy, and A. Smerzi, Phys. Rev. A 60, 487 (1999). * (19) A. Smerzi and S. Raghavan, Phys. Rev. A 61, 063601 (2000). * (20) F. K. Abdullaev and R. A. Kraenkel, Phys. Rev. A 62, 023613 (2000). * (21) C. Lee, W. Hai, L. Shi, X. Zhu, and K. Gao, Phys. Rev. A 64, 053604 (2001). * (22) T. Kohler, Phys. Rev. Lett. 89, 210404 (2002). * (23) N. Akhmediev, M. P. Das, and A. V. Vagov, Int. J. Mod. Phys. B 13, 625 (1999). * (24) A. X. Zhang and J. K. Xue, Phys. Rev. A 75, 013624 (2007). * (25) Q. Niu and M. G. Raizen, Phys. Rev. Lett. 80, 3491 (1998). * (26) B. Z. Liu and J. H. Peng, Nonlinear Dynamics (Advanced Education Publishing House, Beijing, 2004). (in Chinese) * (27) S. Raghavan, A. Smerzi, and V. M. Kenkre, Phys. Rev. A 60, 1787 (1999). * (28) M. Holthaus, Phys. Rev. A 64, 011601 (2001). * (29) M. Albiez et al., Phys. Rev. Lett. 79, 4950 (1997).
arxiv-papers
2009-04-22T02:50:40
2024-09-04T02:49:02.057240
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Yan Chen, Ke-Zhi Zhang, and Yong Chen", "submitter": "Yong Chen", "url": "https://arxiv.org/abs/0904.3376" }
0904.3456
11institutetext: Physics Department and INFM - University of Milan and European Theoretical Spectroscopy Facility Via Celoria 16, 20133 Milano, Italy 22institutetext: Department of Physics, University of Cagliari and SLACS-INFM/CNR Sardinian Laboratory for Computational Materials Science Cittadella Universitaria, I-09042 Monserrato (Ca), Italy # Atomistic simulations of the sliding friction of graphene flakes Federico Bonelli 11 Nicola Manini 11 Emiliano Cadelano 22 Luciano Colombo 22 (April 2, 2008) ###### Abstract Using a tight-binding atomistic simulation, we simulate the recent atomic- force microscopy experiments probing the slipperiness of graphene flakes made slide against a graphite surface. Compared to previous theoretical models, where the flake was assumed to be geometrically perfect and rigid, while the substrate is represented by a static periodic potential, our fully-atomistic model includes quantum mechanics with the chemistry of bond breaking and bond formation, and the flexibility of the flake. These realistic features, include in particular the crucial role of the flake rotation in determining the static friction, in qualitative agreement with experimental observations. ###### pacs: 68.35.Af, 62.20.Qp, 81.05.Uw, 07.79.Sp ## 1 Introduction The scanning tunneling microscope (STM) Binning82 , and even more the atomic- force microscope (AFM) Binning86 , have triggered perhaps the biggest wave of advances and discoveries ever in surface science and nanoscience. Experimental investigations of friction on the atomic scale have become possible by virtue of the friction force microscope (FFM). In a FFM experiment a sharp tip scans a sample surface with atomic precision, while lateral forces are recorded with a resolution that can reach the pN range. Since Mate et al. Mate87 investigated the nanoscale periodic frictional force map of a graphite surface using a tungsten tip, many studies have been conduced experimentally and theoretically. In recent works the Leiden group Dienwiebel04 ; Dienwiebel05 has probed quantitatively the well known slipperiness of graphite, responsible for its excellent lubrication properties. Morita et al. Morita96 suggested that in FFM experiments on layered materials, such as $\rm MoS_{2}$ or graphite, a flake, consisting of several hundred atoms in contact with the substrate, can attach to the tip. By controlling the relative angles of individual nanoflakes to achieve a suitable lattice mismatch, thus incommensurate contact Hirano90 , an almost frictionless sliding was demonstrated for dry and wearless tip-surface contact, a phenomenon known as superlubricity. Several experiments and calculations an have been probing the effects of lattice mismatch on friction Maier07 ; Maier08 ; Filleter09 ; Vanossi06 ; Vanossi07PRL ; Castelli08Lyon , showing that incommensuracy often prevents global ingraining of large areas, thus attenuating the consequent strongly dissipative stick-slip motion. Theoretically, atomic-scale friction on ideal solid surfaces is often described by simple balls-and-springs models such as the Tomlinson model Tomlinson29 , where a single atom, or a more structured tip Tomanek91 , is dragged through a spring along a static periodic potential energy surface. In the present work we implement a Tomlinson-like model of a simulated FFM experiment where dissipation of a finite graphene flake is driven along a graphite substrate, in a fully atomistic scheme based on a tight-binding (TB) force field. Compared to similar models in the literature Sorensen96 ; Verhoeven04 ; Fusco04 ; Filippov08 , where the flake is assumed to be perfect and rigid and the substrate is represented by an analytically defined static periodic potential, our fully-atomistic TB simulation explores two realistic features, namely: (i) The flake-substrate interaction potential is not classical and contains quantum mechanics with the chemistry of bond breaking and bond formation. (ii) The flake is nonrigid, so that during its advancement it can deform and relax. In Sec. 2 we introduce the model implementation details. Section 3 reports the results obtained, in particular for the friction dependency on the flake size, the rotation angle relative to the substrate, and the applied load; we compare the results of the present model to experiment and to previous calculations. The final Sec. 4 discusses the results and the advantages and drawbacks of the present model. ## 2 The model We describe the sliding by means of a generalized Tomlinson-like model similar to that of Ref. Verhoeven04 , but including the following features: (i) the interaction among all carbon atoms is realized in terms of the tight-binding scheme of Xu et al. Xu92 , and (ii) the flake is not rigid but is allowed to deform and rotate while sliding. Interatomic forces are computed as customary in the TB scheme Colombo05 ; the hopping parameters and the pairwise repulsive potential term follow the scaling form given by Xu et al. Xu92 . All interatomic interactions vanish at a cutoff distance $r_{c}=2.6$ Å. This distance sits in between the nearest-neighbor and the next-nearest-neighbor distances of carbon atoms of the equilibrium sp3 diamond structure, and of the sp2 graphene plane. It is also shorter than the interlayer distance of graphite, which is as long as 3.35 Å Zacharia04 . The present TB model has been applied successfully to investigate several low-dimensional carbon systems Canning97 ; Yamaguchi07 ; Cadelano09 . In particular, this parameterization reproduces the experimental equilibrium distance $d_{\rm graph}=1.4224$ Å of the graphitic plane. To study friction, we use a model constituted by a graphene flake sliding over a single infinite rigid graphene sheet. The infiniteness of the substrate is simulated by repeating periodically a regular arrangement of $N^{\rm sub}$ atoms at positions $\vec{r}^{\rm\,sub}_{i}$ in the $x-y$ plane. We consider a periodic rectangular supercell, containing as many carbon atoms as necessary for the flake not to interact with its periodic images. Figure 1: (Color online) The definition of the angle $\phi$ measuring the initial rotation of the flake (thick, pink lines) with respect to the substrate honeycomb structure (thin, black lines). The pulling line is defined by its distance $h^{\prime}$ to the center of a substrate hexagon and the pulling angle $\theta$. To take as a reference the AB stacking ($\phi=0$), we define $h^{\prime}$ in terms of the parameter $h=h^{\prime}+\frac{1}{2}d_{\rm graph}$. We have studied three different regular hexagonal flakes composed of $N^{\rm fl}=24$, 54, and 96 atoms, respectively. Initially, the flake is rotated by an angle $\phi$ with respect to the substrate and translated horizontally to put its center of mass along a sliding line at a distance $h^{\prime}$ from the center of a substrate hexagon. As illustrated in Fig. 1, this line is oriented at an angle $\theta$ from the $\hat{x}$ direction, which is defined by being parallel to the zig-zag direction of the honeycomb lattice. In our simulations we drag the flake along this pulling line and usually let the flake atoms relax in all directions ($x$, $y$ and $z$), whereas the substrate remains completely rigid. The $\phi$ angle defines the stacking mismatch, which has a central importance for friction. Specific values of $\theta$ such as $0^{\circ}$ and $30^{\circ}$ define special pulling directions where the pulled flake encounters periodic corrugations, while aperiodic corrugations are experienced for generic $\theta$ angles. The range of interest of both angles $\theta$ and $\phi$ runs from $0^{\circ}$ to $30^{\circ}$: outside this range we recover equivalent geometries. Figure 2: (Color online) The computed normal force per atom $F_{N\;\rm atom}$ as a function of the fixed rigid flake-substrate distance $d$. The curves refer to different stackings (AA or eclipsed, AB and an incommensurate obtained starting from AB rotated by $\phi=30^{\circ}$) for a 96-atom flake undeformed flake. The compression curve based on the low-pressure data of Ref. Yeoman69 is reported for comparison. To simulate an AFM experiment we introduce a constant load $F_{N}$ pushing the flake against the substrate along the vertical $z$ direction and simulating the force applied by the actual tip. This load acts against the reaction forces produced by the interaction with the substrate. These forces are reported in Fig. 2 for a $N^{\rm fl}=96$-atom flake in several configurations, and of course vanish beyond $r_{c}=2.6$ Å, the TB interaction cutoff. For a distance $d\geq 0.18$ nm, the load force per atom does not exceed 10 nN (a total load in the tens to few hundred nN for a flake composed by 10 to $10^{2}$ atoms, corresponding to a load pressure $\simeq 4$ Mbar), which is a value practically accessible to FFM experiments Maier07 ; Maier08 ; Filleter09 . A load per atom of 0.5 nN, withing the selected force-field model, produces an approach distance near 0.21 nm, similar to the one obtained by assuming for the flake-substrate system the equilibrium interlayer separation of graphite (3.35 Å) and the very soft $c$-axis compressibility Yeoman69 , expressed as $d\ln c/dP=-2.8\times 10^{-6}$ bar-1. Note however that we apply this compressibility relation, also sketched in Fig. 2 for distances and pressures that go beyond its linear-response range of validity: in the region of close approach, $d\leq 0.22$ nm, the actual force is likely to increase more rapidly, like in the TB model curves. We implement a Tomlinson-like dynamics with each flake atom coupled horizontally to a rigid “support” by elastic springs. The support is a set of ideal graphene-net points, which coincide with the initial flake atomic positions: $\vec{r}_{i}^{\rm\,sup}=\vec{r}_{i}^{\rm\,fl}(t=0)$. This support is then translated rigidly parallel to the substrate. Its orientation is fixed once and for all by the angle $\phi$. The support advances by steps of length $\delta x$ along the direction defined by the pulling angle $\theta$ and lateral shift $h^{\prime}$. After a few tests, we select an advancement step $\delta x=0.0024$ nm. After each advancement step relaxation, we evaluate and store the total spring energy and the total dragging force, defined as follows: $\displaystyle E^{\rm spr}$ $\displaystyle=$ $\displaystyle\frac{K}{2}\sum_{i=1}^{N^{\rm fl}}\left(r^{\rm fl}_{x\,i}-r^{\rm sup}_{x\,i}\right)^{2}+\left(r^{\rm fl}_{y\,i}-r^{\rm sup}_{y\,i}\right)^{2}\,;$ (1) $\displaystyle\vec{F}_{\varparallel}^{{\rm\,spr}}$ $\displaystyle=$ $\displaystyle\sum_{i=1}^{N^{\rm fl}}\vec{F}_{\varparallel\,i}^{{\rm\,spr}}\,,$ (2) $\displaystyle\vec{F}_{\varparallel\,i}^{{\rm\,spr}}$ $\displaystyle=$ $\displaystyle-K\left(\vec{r}_{i}^{\rm\,fl}-\vec{r}^{\rm\,sup}_{i}\right)_{\varparallel}\,,$ (3) where the $\varparallel$ symbol indicates the in-plane component. The component $F^{{\rm\,spr}}_{\varparallel\,i}$ of $\vec{F}_{\varparallel\,i}^{{\rm\,spr}}$ along the pulling direction equals the force needed to make the support advance, so that the work of this force equals $F^{{\rm\,spr}}_{\varparallel\,i}\,\delta x$, for an infinitesimal displacement in the pulling direction. In an AFM experiment, the scanning tip speed is typically of the order of tens or hundreds nm/s, much slower than the fast dynamics of the flake. Assuming that the substrate temperature is fairly low, it is appropriate to consider a quasi-static motion of the flake as follows: after each advancement of the support, all flake atomic positions are made relax in all directions by damped dynamics 111 The advantage of damped dynamics with respect to a standard energy-minimization algorithm is that at each step it relaxes smoothly and predictably to the nearest local-minimum configuration. On the other hand, this algorithm is computationally less efficient than, e.g., a conjugated- gradient technique. Eventually we settle on a fairly fast converging damped dynamics with a time step $\delta t=4$ fs. under the combined action of (i) the TB forces, (ii) the vertical load force $F_{N}$, and (iii) the horizontal spring forces that attract the flake atoms near the support points. When the stationary equilibrium position is reached (defined by no force component exceeding a threshold of $10^{-2}$ nN), the support moves one step further and the whole relaxation procedure is repeated until the support reaches the end of a pre-defined path. With the selected fairly small advancement step $\delta x$, each relaxation requires typically 10 to 200 MD steps. We consider a path of moderate length $d\simeq 1$ nm divided into approximately 400 advancement steps. The spring elastic constant coupling the support and the flake in the $x$-$y$ plane is a quite critical parameter of the present model. Softer springs allow the flake a greater freedom to translate, rotate, and deform, with better pinning to energetically favorable sites and more pronounced stick-slip motion and higher friction. Harder springs enforce a more stiff flake showing little or no stick-slip motion. The limit $K\to\infty$ matches the model by Verhoeven et al. Verhoeven04 . The spring constant mimic the combined interaction between the flake and the tip and the elastic tip response. We suggest that a value $K=0.5\,\frac{\rm eV}{\AA^{2}}\simeq 8.01\,\frac{\rm N}{\rm m}$ (4) corresponding to about 10% of the stretching stiffness of a carbon-carbon bond within a graphene layer should probably be fairly realistic. We also perform computations with softer ($K=0.1$ eV/Å2) and harder ($K_{x}=K_{y}=2.5$ eV/Å2) springs, as detailed in Sec. 3. Figure 3: (Color online) The spring total lateral force component $\vec{F}_{\varparallel}^{{\rm\,spr}}$ projected along the scan line, for a 24-atom flake dragged starting from an initial stacking AB along a pulling angle $\theta=15^{\circ}$, and with a stacking angle $\phi=30^{\circ}$. The spring constant is $K=0.1$ eV/Å2, the total load $F_{N}=100$ nN. The $95\%$ force level (dashed line) estimates the static friction force $F_{\rm fric}$. In our calculations, by convention, we estimate the static friction force $F_{\rm fric}$ along a given sliding path by the force level below which 95% of the spring force values $F_{\varparallel}^{\rm spr}$ encountered along the path (at the end of each relaxation, and excluding an initial transient) are found. This definition is illustrated in Fig. 3. Figure 4: (Color online) The dynamic-friction force is evaluated as the energy dissipated through a forward-backward scan (solid and dashed lines respectively). The shaded area between the two curves measures the energy dissipated by friction. The conditions are as follows: $N^{\rm fl}=24$, $F_{N}=100$ nN, $\theta=0^{\circ}$, $\phi=0^{\circ}$, $K=0.1$ eV/Å2. The dynamic-friction force is defined in terms of the energy dissipated in a forward-backward loop. Figure 4 illustrates this concept: the component of the spring force parallel to the advancement direction shows a clear hysteretic behavior in a forward-backward scan. The shaded area enclosed between the two curves measures the energy $E_{\rm fric}$ dissipated by friction, and is clearly related to the stick-slip events. The average dynamical friction force $F_{\rm fric}^{\rm dynamic}=E_{\rm fric}/d\simeq 0.325$ nN is of course smaller than the static friction force $F_{\rm fric}\simeq 0.9$ nN evaluated according to the 95% protocol described above. In the following we will focus on the static friction force $F_{\rm fric}$, which is cheaper to compute and eventually of the same order as $F_{\rm fric}^{\rm dynamic}$. As the flake advances along its path, it deforms and rotates around its center of mass. In particular, to understand the evolution of the static friction force, it is useful to track the flake instantaneous stacking angle $\phi_{A}$, which generally differs from the fixed support angle $\phi$. At each relaxed configuration, we calculate $\phi_{A}$ as an average over all flake atoms $i$, of a sine projection obtained as the length of the vector product of two vectors in the horizontal $xy$ plane: ${\bf R}_{i}^{\rm cm}$, joining the flake center of mass to the $i$-th flake atom, and the corresponding vector ${\bf R}_{i}^{0\,\rm cm}$ computed for the unrotated $\phi=0^{\circ}$ support. Explicitly: $\phi_{A}=\arcsin\\!\left(\sum_{i}\frac{R_{i}^{{\rm cm}\ y}R_{i}^{0\,{\rm cm}\ x}-R_{i}^{{\rm cm}\ x}R_{i}^{0\,{\rm cm}\ y}}{N^{\rm fl}\,|{\bf R}_{i}^{{\rm cm}}|\,|{\bf R}_{i}^{0\,{\rm cm}}|}\right).$ (5) ## 3 Results We analyze the friction force dependence on several physical parameters, namely the pulling angle $\theta$, stacking angle $\phi$, applied load, flake size and position of the scan-line. Experimentally, the number of flake atoms, estimated in the order of 100, is not well determined, while the total applied load and the total force acting on the flake are under control in the FFM. For ease of comparison with experiments, our discussion shall always deal with total quantities, i.e. summed over the flake atoms. ### 3.1 Relaxation to equilibrium Figure 5: (Color online) The relaxed configuration of the $24$-atom flake. Static substrate atoms are clear (white), flake atoms are dark (red). Figure 6: (Color online) The relaxed configuration of the $54$-atom flake. Static substrate atoms are clear (white), flake atoms are dark (red). Figure 7: (Color online) The relaxed configuration of the $96$-atom flake. Static substrate atoms are clear (white), flake atoms are dark (red). Optimally stacked configurations are important in providing the most efficient sticking points during a friction sliding experiment. Figs. 5, 6, and 7 report typical such relaxed configurations for $24-$, $54-$ and $96-$atom flakes respectively, obtained under the action of a total load of $100$ nN, and with no spring connection to a support ($K=0$). The relaxed configuration (up to a symmetry rotation/translation) depends only moderately on the starting stacking, unless the initial stacking angle is strongly incommensurate. The average vertical flake-substrate separation is 0.192 nm. The equilibrium configuration tends to arrange the flake so as to minimize the number of flake atoms stacked on top of a substrate atom: indeed Fig. 2 shows that the eclipsed “AA” stacking produces the strongest repulsive force at the same distance. Geometrically different non-optimal configurations are characterized by typical excess total energies of 1 eV or less. ### 3.2 The stick-slip movement Figure 8: (Color online) The component of the springs force $F_{\varparallel}^{\rm spr}$ in the dragging direction as a function of the support advancement distance $x_{\rm tip}$ for two different pulling directions: $\theta=0^{\circ}$ (solid) and $\theta=15^{\circ}$ (dashed). The simulation involves a $24$ atom flake with total applied load of 100 nN, support stacking angle $\phi=0^{\circ}$ and spring constant $K=0.1$ eV/Å2. We come now to the actual simulation of sliding friction: to start with, Fig. 8 displays the pulling force $F_{\varparallel}^{\rm spr}$ measured along two sliding paths of different commensurability nature: $\theta=0^{\circ}$ (periodic) and $\theta=15^{\circ}$ (aperiodic). As expected, the regular stick-slip pattern of the $\theta=0^{\circ}$ path is replaced by an irregular dependency in the $\theta=15^{\circ}$ trajectory. The initial part of the $\theta=0^{\circ}$ trajectory is not periodic because of the usual startup transient behavior: the first 0.2 nm are omitted from the calculation of the friction force, as discussed above. Figure 9: (Color online) Several physical quantities plotted as functions of the support position $x_{\rm tip}$: (a) the parallel component of the springs lateral force $F_{\varparallel}^{\rm spr}$, (b) the flake excess energy $E^{\rm tot}-E^{\rm spr}-E^{\rm eq}$, (c) the flake center-of-mass advancement $x_{\rm CM}$ along the pulling direction, and (d) the flake instantaneous rotation angle $\phi_{A}$ relative to the substrate. Two different values of the spring constant are compared: soft, $K=0.1$ eV/Å2 (solid, squares), and hard, $K=2.5$ eV/Å2 (dashed, triangles). These simulations involve $N^{\rm fl}=24$, $F_{N}=100$ nN, $\theta=0^{\circ}$, and $\phi=0^{\circ}$. The stick-slip motion and the role of the spring stiffness is understood even better by comparing other physical quantities with $F_{\varparallel}^{\rm spr}$. In particular, Fig. 9 displays the internal energy of the flake- substrate interaction, the displacement of the flake center of mass along the pulling direction, and the actual stacking angle $\phi_{A}$. We focus initially on the solid curves, obtained in a simulation based on soft springs with $K=0.1$ eV/Å2. After the initial transient, where the flake explores once a configuration with a negative $\phi_{A}$, it then jumps back and forth between two kinds of sticking configurations: the most favorable one characterized by $\phi_{A}\simeq 4^{\circ}$, and another one, at 0.1 to 0.2 eV higher energy, near $\phi_{A}\simeq 0^{\circ}$. These stick-slip jumps overcome energy barriers whose heights are of order 0.2 to 0.3 eV. This energy amplitude sets the temperature range of validity of the present zero- temperature calculations to a few hundred Kelvin: when thermally-activated slips through energy barriers do not have enough time to occur, i.e. for a not-too-small tip advancement speed Riedo03 ; Gnecco03 , these slips are unlikely and our estimates of friction should be fairly reliable. Stick-slip events occur with correlated jumps in the spring force, flake excess energy, flake position, and stacking angle. The very different dashed curves show that stiff springs (with $K=2.5$ eV/Å2) produce a much stronger and more rigid binding of the flake to the rigid support. Accordingly, such an unrealistically rigid coupling suppresses the stick-slip behavior: both the advancement, shown in Fig. 9(c), and the spring force, Fig. 9(a), become smooth and jump-less. Despite the suppression of stick-slip, we observe higher force peaks for the stiffer springs, thus indicating a higher static friction than for the softer springs. This is due to the flake being forced to cross high potential-energy barriers, Fig. 9(b), with little or no possibility to avoid them by (i) shifting away from the pulling direction, (ii) deforming, and (iii) “rotating around” ($|\phi_{A}|<0.2^{\circ}$). A similar behavior is observed also in different geometries. The spring strength tuning the coupling between the flake and the AFM tip plays therefore an important role in the model calculations. We checked that up to spring constants of an intermediate value ($K=0.5$ eV/Å2) our model still performs a stick-slip motion similar to the one found in experiment Dienwiebel04 (where the cantilever harmonic constants values was estimated $K\simeq 0.36$ eV /Å2), especially in the fully commensurate $\phi=0^{\circ}$ stacking. ### 3.3 Flake-size effects Figure 10: (Color online) The parallel component of springs lateral force, $F_{\varparallel}^{\rm spr}$, as a function of the support position $x_{\rm tip}$ for three flake sizes: 24-atom flake (solid), 54-atom flake atoms (dashed), and 96-atom flake atoms (dot-dashed). The three simulations involve a total applied load $F_{N}=100$ nN, $\theta=0^{\circ}$, $\phi=30^{\circ}$, and soft springs constants $K=0.1$ eV/Å2. Figure 10 compares the frictional behavior of flakes of different size, showing that friction tends to decrease with increasing flake size. In detail, the static friction force of the 3 flakes is $F_{\rm fric}=2.99$ nN, 1.38 nN, and 1.24 nN for the 24, 54, and 96-atom flakes respectively. This decrease is not surprising, since the more reactive atoms at the flake boundary tend to bend down toward the substrate. As a result, friction is dominated by these boundary atoms, which amount to 75% of the 24-atom flake but only 44% of the 96-atom flake. Moreover, the 96-atom flake advances continuously, and shows no stick-slip, at variance with the 24-atom and 54-atom flakes. This difference is due to a reduced rotational freedom of the 96-atom flake flake, due to coupling to the support acting at a larger distance from the flake center. The flake rotational freedom, i.e. the angular range of $\phi_{A}$ explored around $\phi$, does represent a key issue in the friction physics of carbon flakes sliding over a graphite surface, as pointed out by Filippov et al. Filippov08 . In the framework of our model, with each atom tied to the moving support by an individual spring, the flake can both shift normally to the pulling direction and rotate around its center of mass: these degrees of freedom (and, more weakly, the possibility of the flake to distort) affect friction in two very different manners depending on the contact being commensurate or incommensurate. When the flake is pulled at a commensurate stacking, e.g. $\phi=0^{\circ}$, it encounters high potential-energy barriers thus high friction: the combined possibility of rotations and lateral shifts allows the flake dribble the high barriers through local changes of trajectory. The first effect of flake shifts and rotations is then to reduce the friction of highly commensurate contacts. In contrast, when the flake slides with an incommensurate stacking, e.g. $\phi=15^{\circ}$, it does not encounter high- energy barriers nor efficiently binding configurations, thus producing a low- friction motion. However rotations and shifts allow the flake to locate deeper energy wells (both moving apart from the pulling direction and rotating so as to explore different stacking configurations), where the flake can stick, eventually providing sizeable friction. This second effect is therefore to raise the friction for incommensurate contacts and eventually destroy superlubricity, as was observed and discussed by Filippov et al. Filippov08 . In our simple model the single parameter $K$ tunes the flake rotational freedom and that of shifting perpendicular to the pulling direction. However, while its effect on the translational freedom is independent of size, the rotational freedom does depend on the larger torque that springs of the same stiffness exert on flake atoms more remote from the flake center, as is also to be expected for a flake sticking to a not too sharp AFM tip. Figure 11: (Color online) The instantaneous rotation angle $\phi_{A}$ as a function of the support position $x_{\rm tip}$ for three values of the support stacking angle: (a) $\phi=0^{\circ}$, (b) $\phi=15^{\circ}$, and (c) $\phi=30^{\circ}$. Three flake sizes are considered: $N^{\rm fl}=24$ (black solid line), $N^{\rm fl}=54$ (red dashed line) and $N^{\rm fl}=96$ (blue dot- dashed line). Simulations are carried out with total applied load of $100$ nN, pulling angle $\theta=0^{\circ}$ and soft springs $K=0.1$ eV/Å2. This point shows clearly in Fig. 11, which displays the evolution of the actual rotation angle $\phi_{A}$ along the scanline, for three different support stacking angles and three different flake sizes: $N^{\rm fl}=24$, $54$, and $96$. Rotational fluctuations decrease as the flake size increases. Indeed significant systematic deviations of $\phi_{A}$ from $\phi$ are apparent in many cases, especially $N^{\rm fl}=24$. In particular, the small 24-atom flake for $\phi=30^{\circ}$ rotates all the way to $\phi_{A}\leq 10^{\circ}$, thus displaying angular oscillations in excess of $15^{\circ}$, for an average angle $\langle\phi_{A}\rangle\simeq 16^{\circ}$, very different from $\phi$. When plotting the dependence of friction force $F_{\rm fric}$ on the stacking angle, it will make more sense to use, instead of the initial stacking angle $\phi$, the average flake rotation angle $\langle\phi_{A}\rangle$, although even this indicator does not account properly for rotational fluctuations. This large rotational freedom, for hard springs, is almost completely frozen: in that case the largest rotational fluctuation we observe is as little as $\simeq 3^{\circ}$ for $N^{\rm fl}=24$ and $\phi=15^{\circ}$. Figure 12: (Color online) Subsequent points marking the trajectories of the center of mass of a 24-atom flake in the $x$-$y$ plane for $\phi=30^{\circ}$ (incommensurate stacking, blue circles) and for $\phi=0^{\circ}$ (commensurate stacking, black diamonds) at the end of each relaxation cycle. The dashed lines represent the support scanlines ($\theta=0^{\circ}$); large circles represent the substrate atomic positions. The simulations are the soft-spring ones of Fig. 9. As for lateral shifts, for soft springs $K=0.1$ eV/Å2 we observe shifts perpendicular to the pulling line of the order of 1 Å, depicted in Fig. 12 which displays the actual path followed by the center of mass of a 24-atom flake pulled by the support along a $\theta=0^{\circ}$ scanline. Note that, similarly to rotational fluctuations, the incommensurate stacking $\phi=30^{\circ}$ yields larger lateral shifts than the commensurate stacking $\phi=0^{\circ}$. With hard springs the possibility of the flake to perform lateral shifts is strongly reduced, so that the actual trajectory of the flake center of mass remains very close to the support scanline. For example, springs of $K=2.5$ eV/Å2 yield perpendicular shifts $\leq 0.2$ Å along the same trajectory. The rotational freedom plus the lateral shifts of the flake can lead to effectively commensurate contacts even for an incommensurate stacking, thus explaining the deep energy valleys of the soft-spring pattern of Fig. 9b, eventually responsible for the stick-slip motion demonstrated by the lateral force patterns of Fig. 9a. For hard springs constants, locking into deep energy minima does not occur, but at the same time the flake is driven into highly repulsive geometries which it cannot dribble. This leads to higher force peaks, and eventually to a larger static friction. ### 3.4 Angular dependence of friction As a reference benchmark we consider a nearly rigid flake model, where atoms are allowed to relax only in the $z$ direction, corresponding to the $K\to\infty$ limit of the model studied until here, and comparing directly to the model used by Verhoeven et al. Verhoeven04 . The complete suppression of angular fluctuations should produce an extremely sharp angular dependency of the friction force. Figure 13: (Color online) Friction force $F_{\rm fric}$ as a function of the fixed stacking angle $\phi$ for three different flake sizes: $24$ atoms (black solid line), $54$ atoms (red dashed line) and $96$ atoms (blue dot-dashed line). The simulations are carried out with pulling angle $\theta=0^{\circ}$ and total applied load of $100$ nN. Flake atoms are allowed to relax only along $z$ direction. Figure 13 shows the computed static friction force as a function of the fixed stacking angle $\phi$ for different flakes. We note that friction decreases with the $\phi$ angle, showing a maximum peak centered at $\phi=0^{\circ}$, similar to the outcome of previous model calculation Verhoeven04 . As shown by experiments Dienwiebel04 ; Dienwiebel05 , friction is maximum at an highly commensurate contact ($\phi=0^{\circ}$) and decreases rapidly as the flake rotates to incommensurate stackings. The friction peak is sharper for wider flakes. The sharpest peak for the 96-atom flake is similar to the one exhibited by the rigid model of Ref. Verhoeven04 . $F_{\rm fric}$ decreases by nearly one order of magnitude from the high-friction $\phi=0^{\circ}$ commensurate angle to the low-friction $\phi\simeq 30^{\circ}$ incommensurate one. This drop is smaller than was found by experiment Dienwiebel04 , where it exceeded significantly one order of magnitude. Also the absolute values of friction are systematically larger than experiment. Experiment shows friction peak values near 0.2 nN, while the present model yields a peak value of order 10 nN, 50 times larger. This difference is even larger in the “superlubric” region near $\phi=30^{\circ}$. These differences are to be ascribed to the larger load, the adopted short-ranged TB parameterization, and the neglect of thermal fluctuations, as discussed below. Figure 14: (Color online) The friction force $F_{\rm fric}$ as a function of the average rotation angle $\langle\phi_{A}\rangle$ for three different flake sizes: $24$ atoms (black solid line), $54$ atoms (red dashed line) and $96$ atoms (blue points). Simulations involve a pulling angle $\theta=0^{\circ}$, total applied load of $100$ nN and soft springs constants $K=0.1$ eV/Å2. The rigid-flake models, studied here and in previous work Dienwiebel04 do not look not especially realistic, since in practice a carbon flake does deform, shift and rotate while interacting with the graphite substrate and the AFM tip. Figure 14 reports the dependence of friction force $F_{\rm fric}$ on the average rotation angle $\langle\phi_{A}\rangle$, for a flake whose atoms are allowed to relax in all directions, for soft spring constants $K=0.1$ eV/Å2. In all calculations except those of 96-atom flake we use the same angles $\phi=0^{\circ}$, $5^{\circ}$, $10^{\circ}$, $15^{\circ}$, $20^{\circ}$, $25^{\circ}$ and $30^{\circ}$, but the possibility of flake rotations allowed by the soft springs produces significantly different effective average angles $\langle\phi_{A}\rangle$, especially for the 24-atom flake. Not surprisingly, with its vast rotational freedom, the 24-atom flake displays an almost $\phi$-independent, constant friction. For such a small flake with soft springs, rotations and shifts are so effective to hinder the possibility to observe any reliable $\phi$-dependency of $F_{\rm fric}$. The 54-atom flake and, more clearly, the 96-atom flake show average angles nearer to the support values, with smaller-amplitude fluctuations, and therefore display a friction curve behavior with a peak at $\langle\phi_{A}\rangle\simeq 0^{\circ}$, fairly similar to the one obtained in the semi-rigid case and observed in experiment, and with smaller friction at incommensurate angles. These results suggest that when the FFM tip happens to bind to a graphene flake constituted by substantially less than approximately $10^{2}$ atoms, no clear angular dependency and no superlubric regimes are observed. Figure 15: (Color online) Comparison of the friction force dependence on the average rotation angle $\langle\phi_{A}\rangle$ for a 54-atom flake for two values of springs strength: soft $K=0.1$ eV/Å2 (black solid line) and hard $K=2.5$ eV/Å2 (red dashed line), plus the semi-rigid case (blue dot-dashed line). Simulations involve a pulling angle $\theta=0^{\circ}$, total applied load of $100$ nN. Figure 15 summarizes the effect of increasing the rigidity of the springs on the friction dependency on $\langle\phi_{A}\rangle$: the friction peak at a commensurate arrangement becomes sharper and sharper as the spring rigidity increases. At variance with the radical changes in $\langle\phi_{A}\rangle$ dependency of the 24-atom flake as a function of the spring constant, for the 54-atom flake the shift-rotational effects become comparably less important, suggesting that for realistically large flakes in excess of one hundred atoms, the precise value of the spring stiffness should become irrelevant, as long as it remains in the $\lesssim 1$ eV/Å2 region. ### 3.5 Load dependency Figure 16: (Color online) Nonlinear dependency of (a) the friction force and (b) the friction coefficient $\mu=\frac{F_{\rm fric}}{F_{N}}$ on the total applied load $F_{N}$, for a commensurate contact ($\phi=0^{\circ}$, black solid line) and an incommensurate contact ($\phi=15^{\circ}$, red dashed line) of the 24-atom flake flake. Simulations are carried out for pulling angle $\theta=0^{\circ}$ and rigid springs, $K=2.5$ eV/Å2. We come now to study the dependence of the friction force $F_{\rm fric}$ on the applied load $F_{N}$, exploring a range 20 to 100 nN, matching typical experiment values Dienwiebel04 ; Sasaki02 . Figure 16 shows the dependence of the friction force $F_{\rm fric}$ and coefficient $\mu\equiv F_{\rm fric}/F_{N}$ on the applied load. Hard springs are selected to reduce the flake shift-rotational effects, in order to focus on the load dependence of friction and simpler comparison with earlier results. Friction increases with load, but significant deviations from the linear Coulomb law are observed, especially for commensurate stacking $\phi=0^{\circ}$. Observe that experiment found an even weaker dependency of the friction force on load Dienwiebel04 . Although the data do not point clearly in the direction of a power-law behavior $F_{\rm fric}\propto F_{N}^{\alpha}$, it is clear that if any such law was to be estimated, it would have $\alpha<1$. This is at variance with previous findings for a sharp undeformable tip-surface contact Fusco04 , and with recent studies of the sliding of hydrogen-passivated carbon Mo09 . The resulting static friction coefficient approaches the standard macroscopic value CRC94 of graphite-graphite contact, $\mu=0.1$, while much smaller values are found in the single-crystal FFM experiments addressed by the present model. Regardless of the applied load, the flake-substrate distance being smaller in the model than in real life produces larger absolute values of friction, and this overestimation is particularly severe at small load. ### 3.6 Scanline dependency Figure 17: (Color online) (a) Friction force $F_{\rm fric}$ as a function of the average stacking angle $\langle\phi_{A}\rangle$ for three different scanlines drawn in panel (b), defined by the three following initial stackings of the support over the substrate: AB (black solid), AB with a transverse shift $h=d_{\rm graph}/4$ (red dashed) and AB with transverse shift $h=d_{\rm graph}/2$ (blue dot-dashed). The simulations involve a 24-atom flake, pulling angle $\theta=0^{\circ}$, applied load $F_{N}=100$ nN and hard springs of constants $K=2.5$ eV/Å2. We investigate the dependence of the friction force versus stacking angle on the actual scanline followed by the support. Changing scanline determines a different potential profile seen by the flake, thus modifying the frictional behavior Fusco04 . Figure 17 reports the friction angular dependency for three equally spaced scanlines. We carry out simulations for hard springs $K=2.5$ eV/Å2 where scanline effects are the most visible, because of hindered lateral shifts. For the $h=0$ and $h=d_{\rm graph}/2$ scanlines we find a similar friction for all values of the stacking angle $\langle\phi_{A}\rangle$, while the $h=d_{\rm graph}/4$ scanline shows systematically lower friction, especially for small $\phi$. The reason is that for $\phi_{A}\simeq 0$ along this special line each flake atom never hits any substrate atom directly on top, therefore effectively finding a significantly lower corrugation. In contrast along the two other scanlines, for $\phi=0^{\circ}$ one half of flake atoms encounters periodically a substrate atom right below its trajectory, thus finding a high corrugation. Softer springs produce a much weaker dependence on the scanline: the flake takes advantage of its freedom to displace laterally, thus following low-corrugation lines (such as $h=d_{\rm graph}/4$) even when the support pulls it along some nearby parallel line. Figure 18: Friction force $F_{\rm fric}$ as a function of the pulling angle $\theta$. Static friction data are obtained by averaging three different scanlines, defined by initial stacking AB, AB shifted by $d_{\rm graph}/4$ and AB shifted by $d_{\rm graph}/2$ perpendicular to the pulling direction. Simulations involve a 24-atom flake with load of $100$ nN, support stacking angle $\phi=0^{\circ}$ and springs constants $K=2.5$ eV/Å2. The scanlines of Fig. 17 involves $\theta=0^{\circ}$, i.e. a pulling along the $x$ direction, where the flake encounters periodic repetitions of the substrate potential. A different pulling angle affects directly this periodicity of the problem, in general leading to a nonperiodic profile. Figure 18 displays the friction force as a function of the pulling angle $\theta$. Data are averaged over three different scanlines, defined by initial stacking with $h=0$, $h=d_{\rm graph}/4$ and $h=d_{\rm graph}/2$. Like in previous calculations Verhoeven04 , we find a minimum friction for pulling angle $\theta=0^{\circ}$, followed by a fast growth in friction (until $\theta=10^{\circ}$). We attribute the observed differences between our results and those by Verhoeven et al. to the different interaction models. ## 4 Discussion and conclusion We find fair qualitative agreement between the results obtaining by our TB atomistic model and the existing experimental data, with a few significant differences. Firstly, our calculations recover the stick-slip behavior of the lateral forces, characteristic of FFM sliding experiments. In particular, we find the correct qualitative dependence of stick-slip on the springs stiffness characterizing the cantilever-tip-flake coupling: soft springs allow for clean stick-slip behavior, while hard springs inhibit it. Our calculations also reproduce correctly the friction pattern as a function of the average stacking angle $\langle\phi_{A}\rangle$ especially as long as the rotational degree of freedom $\phi_{A}$ is quenched. We also find that for larger flakes, the fluctuation in $\phi_{A}$ are suppressed automatically anyway, due to the larger torque exerted by the springs connecting the flake to the tip. Accordingly, for flakes of sufficiently large size incommensurability produces significantly less friction, although the friction drop is smaller than in experiment. In the quantitative comparison between the experimental results and our model, we find static friction force $F_{\rm fric}$ and coefficient $\mu$ systematically at least one order of magnitude larger than experiment, this difference being especially significant in the incommensurate configurations where no proper superlubric regime is observed. These and other quantitative discrepancies are to be attributed to: (i) The reduced interlayer equilibrium distance, related to the small cut-off distance of the present TB parameterization, which is responsible for the increased energy corrugation experienced by our model flake with respect to real graphene on graphite. (ii) The extra reactivity of the isolated model graphene flake with respect to a real one, which is bond to the AFM tip and thus somewhat passivated; accordingly, especially the atoms at the flake border, show a greater tendency to react with substrate atoms, thus increasing friction. (iii) The neglect of thermally-activated slips through energy barriers Riedo03 ; Gnecco03 : this neglect generates an overestimation of friction especially where these barriers are lower, i.e. at incommensurate stackings. Indeed the current understanding Frenken09conf of the observed Dienwiebel04 superlubric sliding involves thermolubricity associated to a high attempt rate for overcoming the corrugation barriers due to the microscopic mass of the vibrating tip apex. If the experiment of Ref. Dienwiebel04 could be repeated at the much lower temperature of a few degree Kelvin, the observed friction values and dependency on the $\Phi$ angle would probably look much more similar to the one obtained in the present model. Calculations carried out with comparably soft springs and small flakes ($N_{\rm fl}\leq 54$) show that the flake shift-rotational freedom increases friction for incommensurate stackings (by allowing the flake to explore deeper-bound minima) and decreases it for commensurate ones (by allowing the flake to dribble the top barriers): the result is a substantial flattening of the dependency of the friction static force $F_{\rm fric}$ on the stacking angle $\phi$. Harder springs (e.g. $K=2.5$ eV/Å2) would suppress the flake freedom to rotate and shift laterally but are incompatible with the clear stick-slip behavior observed experimentally. These considerations confirm that the size of the flakes showing superlubric sliding in actual FFM experiments is large $N_{\rm fl}\geq 96$. Many discrepancies with experiment would probably be disposed of, if a longer ranged interatomic interaction was employed, for example a TB model based on a longer cutoff Papaconstantopoulos98 . This way, a much weaker flake-surface interaction would effectively correspond to comparably stronger tip-flake interaction, thus a significant hindering of rotations and translations even with a realistically weak tip-flake coupling $K\leq 0.5$ eV/Å2. If accurate long- range C-C interactions up to distances of the order of 1 nm were present in the force field, one could even include substrate relaxation to study an even more realistic model. Such an improved model would however imply significantly larger computational workload, especially if thermal excitations were also included. Further research should also investigate the effect of the presence of structural defects in the flake or in the substrate, as proposed by Guo et al. Guo07 , and the effect of flake shape. ## Acknowledgments We are grateful to J. Frenken and R. Buzio for useful discussion. We acknowledge financial support by the project MIUR-PON ”CyberSar”, and by the Italian National Research Council (CNR) through contract ESF/EUROCORES/FANAS/AFRI. ## References * (1) G. Binning, H. Rohrer, Ch. Gerber, and E. Weibel, Phys. Rev. Lett. 49, 57 (1982). * (2) G. Binning, C. F. Quate, and Ch. Gerber, Phys. Rev. Lett. 56, 930 (1986). * (3) C. M. Mate, G. M. McClelland, R. Erlandsson, and S. Chiang, Phys. Rev. Lett. 59, 1942 (1987). * (4) M. Dienwiebel, G. S. Verhoeven, N. Pradeep, J. W. M. Frenken, J. A. Heimberg, and H. W. Zandbergen, Phys. Rev. Lett. 92, 126101 (2004). * (5) M. Dienwiebel, N. Pradeep, G. S. Verhoeven, H. W. Zandbergen, and J. W. M. Frenken, Surf. Sci. 576, 197 (2005). * (6) S. Morita, F. Fujisawa, and Y. Sugawara, Surf. Sci. Rep. 23, 1 (1996). * (7) M. Hirano and K. Shinjo, Phys. Rev. B 41, 11837 (1990). * (8) S. Maier, O. Pfeiffer, Th. Glatzel, E. Meyer, T. Filleter, and R. Bennewitz, Phys. Rev. B 75, 195408 (2007). * (9) S. Maier, E. Gnecco, A. Baratoff, R. Bennewitz, and E. Meyer, Phys. Rev. B 78, 045432 (2008). * (10) T. Filleter, J. L. McChesney, A. Bostwick, E. Rotenberg, K. V. Emtsev, T. Seyller, K. Horn, and R. Bennewitz, Phys. Rev. Lett. 102, 086102 (2009). * (11) A. Vanossi, N. Manini, G. Divitini, G. E. Santoro, and E. Tosatti, Phys. Rev. Lett. 97, 056101 (2006). * (12) A. Vanossi, N. Manini, F. Caruso, G. E. Santoro, and E. Tosatti, Phys. Rev. Lett. 99, 206101 (2007). * (13) I. E. Castelli, N. Manini, R. Capozza, A. Vanossi, G. E. Santoro, and E. Tosatti, J. Phys.: Condens. Matter 20, 354005 (2008). * (14) G. A. Tomlinson, Philos. Mag. 7, 905 (1929). * (15) D. Tománek, W. Zhong, and H. Thomas, Europhys. Lett. 15, 887 (1991). * (16) M. R. Sorensen, K. W. Jacobsen, and P. Stolze, Phys. Rev. B 53, 2101 (1996). * (17) G. S. Verhoeven, M. Dienwiebel, and J. W. M. Frenken, Phys. Rev. B 70, 165418 (2004). * (18) C. Fusco and A. Fasolino, Appl. Phys. Lett. 84, 699 (2004). * (19) A. E. Filippov, M. Dienwiebel, J. W. M. Frenken, J. Klafter, and M. Urbakh, Phys. Rev. Lett. 100, 046102 (2008). * (20) C. H. Xu, C. Z. Wang, C. T. Chan, and K. M. Ho, J. Phys.: Condens. Matter 4, 6047 (1992). * (21) L. Colombo, Rivista Nuovo Cimento 28, 1 (2005). * (22) R. Zacharia, H. Ulbricht, and T. Hertel, Phys. Rev. B 69, 155406 (2004). * (23) A. Canning, G. Galli, and J. Kim, Phys. Rev. Lett. 78, 4442 (1997). * (24) Y. Yamaguchi, L. Colombo, P. Piseri, L. Ravagnan, and P. Milani, Phys. Rev. B 76, 134119 (2007). * (25) E. Cadelano, P. L. Palla, S. Giordano, and L. Colombo, submitted for pubblication. * (26) M. L. Yeoman and D. A. Young, J . Phys. C 2, 1742 (1969). * (27) E. Riedo, E. Gnecco, R. Bennewitz, E. Meyer, and H. Brune, Phys. Rev. Lett. 91, 084502 (2003). * (28) E. Gnecco, R. Bennewitz, A. Socoliuc, and E. Meyer, Wear 254, 859 (2003). * (29) N. Sasaki, S. Watanabe, and M. Tsukada, Phys. Rev. Lett. 88, 046106 (2002). * (30) Y. Mo, K. T. Turner, and I. Szlufarska, Nature 457, 1116 (2009). * (31) D. R. Lide, CRC Handbook of Chemistry and Physics (CRC Press, Boca Ranton, 1994), 15-40. * (32) J. W. M. Frenken, Friction and thermolubrication: thermal fluctuations and ’universal’ behavior, communication at the Conference “Physics of Tribology”, Bad Honnef, 23-25 March 2009. * (33) D. A. Papaconstantopoulos, M. J. Mehl, S. C. Erwin and M. R. Pederson, in Tight-Binding Approach to Computational Materials Science, P. Turchi, A. Gonis, and L. Colombo, eds., Material Research Society Proceedings 491, 221 (1998). * (34) Y Guo, W. Guo, and C. Chen, Phys. Rev. B 76, 155429 (2007).
arxiv-papers
2009-04-22T13:05:14
2024-09-04T02:49:02.066573
{ "license": "Public Domain", "authors": "Federico Bonelli, Nicola Manini, Emiliano Cadelano and Luciano Colombo", "submitter": "Emiliano Cadelano", "url": "https://arxiv.org/abs/0904.3456" }
0904.3493
# surfaces with central convex cross-sections Bruce Solomon Math Department, Indiana University, Bloomington IN 47405 solomon@indiana.edu mypage.iu.edu/$\sim$solomon ###### Abstract. Say that a surface in $\,S\subset\mathbf{R}^{3}\,$ has the _central plane oval property, or cpo_, if * • $S\,$ meets some affine plane transversally along an oval, and * • Every such transverse plane oval on $\,S\,$ has central symmetry. We show that a complete, connected $\,C^{2}\,$ surface with cpo must either be a cylinder over a central oval, or else _quadric_. We apply this to deduce that a complete $\,C^{2}\,$ surface containing a transverse plane oval but no skewloop, must be cylindrical or quadric. ###### Key words and phrases: Quadric surface, oval, central symmetry, skewloop ## 1\. Introduction and overview Call a set in a euclidean space _central_ if it has symmetry with respect to reflection through a point—its _center_. Call an embedded plane loop an _oval_ if its curvature never vanishes. Figure 1. Ovals and their centrices (see §2.3). Only the rightmost oval is central. If we erect a cylinder over a central oval in $\,\mathbf{R}^{3}\,$, its transverse planar cross-sections, whenever compact, will be central ovals too. The same goes for _quadrics_ —level-sets of a quadratic polynomials on $\,\mathbf{R}^{3}\,$: Their transverse planar cross-sections, when compact, are always ellipses, which are certainly central ovals. We show here that these two kinds of examples provide the _only_ complete $\,C^{2}\,$ surfaces in $\,\mathbf{R}^{3}\,$ whose planar ovals are all central. We will call this the _central plane oval_ property and abbreviate it by _cpo_ : ###### Definition 1.1 (cpo). A $\,C^{2}$-immersed surface $\,S\subset\mathbf{R}^{3}\,$ has the _central plane oval property_ , or _cpo_ , if * • $S\,$ intersects _at least one_ affine plane transversally along an oval, and * • _Every_ time $\,S\,$ intersects an affine plane transversally along an oval, that oval is _central_ Given this terminology, we can state our main result as follows: Theorem 5.2 (Main Theorem) _A complete, connected $\,C^{2}$-immersed surface in $\,\mathbf{R}^{3}\,$ with cpo is either a cylinder, or quadric._ This result complements a fundamentally local fact about _convex_ surfaces proven long ago by W. Blaschke in [Bl]: ###### Proposition 1.2 ([Bl, 1918]). Suppose every plane transverse, and nearly tangent to, a smooth _convex_ surface $\,S\subset\mathbf{R}^{3}\,$ cuts $\,S\,$ along a central loop. Then $\,S\,$ is quadric. Though it resembles—and helped to inspire—our Main Theorem above, Blaschke’s result seems much easier to prove, for the simple reason that convex surfaces lie on one side of their tangent planes. By pushing such a plane slightly into the surface, one always cuts it in a small convex loop. Blaschke merely observed that when all such loops are _central_ , one can Taylor-expand the surface as a graph over any tangent plane with no cubic term. This annihilates the Pick invariant on the surface, making it quadric. Contrastingly, our Theorem allows some, or even all of the surface, to have negative Gauss curvature. In a negatively curved region, one _never_ finds arbitrarily small planar ovals, and this totally blocks any direct generalization of Blaschke’s argument—as he himself laments in [Bl]. We thus find it necessary to approach Theorem 5.2 using a global, multi-stage argument that ultimately rests on the rotationally symmetric case. We published the latter result in [S]: ###### Proposition 1.3 ([S]). Let $\,M\,$ be a surface of revolution. If $\,M\,$ intersects every plane nearly perpendicular to its axis in a central set, then $\,M\,$ is quadric. The fundamental problem we must solve to get from this basic result to our Main Theorem boils down to the case of a general “tube”. For suppose an immersed surface $\,M\,$ meets some plane transversally along an oval as our definition of cpo requires. Then some neighborhood, in $\,M\,$, of that oval embeds into $\,\mathbf{R}^{3}\,$ as a roughly cylindrical tube with cpo. Such tubes turn out to form the critical test case for our work. To explain further, we need some precise language. Let $\,I:=(-1,1)\,$ denote the open unit interval. ###### Definition 1.4 (Transversely convex tube). Suppose $\,X:\mathbf{S}^{1}\times I\to\mathbf{R}^{3}\,$ is an embedding of the form $X(\theta,z):=\bigl{(}\mathbf{c}(z)+\gamma(z;\theta),\,z\bigr{)}\,,$ where $\,\mathbf{c}:I\to\mathbf{R}^{2}\,$ and $\,\gamma:I\times\mathbf{S}^{1}\to\mathbf{R}^{2}\,$ are $\,C^{2}\,$, and for each fixed $\,z\in I\,$, the map $\,\gamma(z;\cdot):\mathbf{S}^{1}\to\mathbf{R}^{2}\,$ parametrizes a plane oval having its centroid at the origin. A transversely convex tube is any embedded annulus that, after an affine isomorphism, can be parametrized in this way. We call $\,\mathbf{c}\,$ its central curve. When studying a transversely convex tube, we lose no generality by assuming it to lie in the slab $\,|z|<1\,$ as parametrized above, and we will routinely do so without further comment. Discarding the central curve $\,\mathbf{c}\,$ of a transversely convex tube $\,\mathcal{T}\,$ in standard position, we get the rectification $\,\mathcal{T}\,$, denoted $\,\mathcal{T}^{*}\,$, and given by the image of $X^{*}(\theta,z):=\bigl{(}\gamma(z;\theta),\,z\bigr{)}$ (Figure 2). Finally, we say that $\,\mathcal{T}^{*}\,$ splits when $\gamma(z;\theta)=r(z)\,\gamma(\theta)$ for some fixed oval $\,\gamma:\mathbf{S}^{1}\to\mathbf{R}^{2}\,$, and some positive scaling function $\,r:I\to(0,\infty)\,$. Note that a split tube is a surface of revolution precisely when$\,\gamma\,$ parametrizes an origin- centered circle. Figure 2. A transversely convex tube $\,\mathcal{T}\,$ (left) and its rectification $\,\mathcal{T}^{*}\,$ (right). In these terms, we reach a key analytical juncture in our work when we prove the following technical result: Proposition 3.10. (Splitting Lemma) _If a transversely convex tube $\,\mathcal{T}\,$ in standard position has cpo, then its rectification $\,\mathcal{T}^{*}\,$ splits._ Simple as this statement is, proving it was the most challenging part of our work. Much of the effort goes toward deriving a pair of partial differential equations satisfied by the function $\,h:\mathbf{S}^{1}\times I\to\mathbf{R}\,$ which, for each $\,z\in I\,$, yields the support function $\,h(z,\cdot)\,$ of the oval $\,\gamma(z;\cdot)\,$—the height-$z$ cross- section of the rectified tube $\,\mathcal{T}^{*}\,$. These PDE’s form the conclusion of Proposition 3.9, and we devote most of §3 to their derivation. Our approach has a variational flavor that we sketch out at the beginning of §3. We then obtain our Splitting Lemma by playing these PDE’s off against each other. Specifically, we use information gleaned from the second equation to rewrite the first as an equation for the _square_ of $\,h\,$. We then notice a first integral for that equation, and finally prove splitting with the help of ODE techniques in which the second equation again plays a role. Once we have Splitting, we return again to the first PDE from Proposition 3.9, where we can now separate variables. This yields independent elementary ODE’s for the horizontal and vertical behavior of our tube. Solving these, we reach the key geometric turning point of our work: We find that the possibilities for a tube with cpo branch in two directions: Proposition 3.11. (Cylinder/Quadric) Suppose $\,\mathcal{T}\,$ is a transversely convex tube with cpo. Then its rectification $\,\mathcal{T}^{*}\,$ is either * (i) The cylinder over a central oval, or * (ii) Affinely congruent to a surface of revolution. By Proposition 1.3, however, surfaces of revolution having cpo are already quadric. So we now see that, insofar as tubes go, it remains only to eliminate the rectification step. We do this in §4 by proving Proposition 4.1. (Axis lemma) _Suppose $\,\mathcal{T}\,$ is a transversally convex tube with cpo. Then its central curve is affine, so that $\,\mathcal{T}\,$ is affinely congruent to its rectification $\,\mathcal{T}^{*}\,$._ Together, the Cylinder/Quadric Proposition, Axis Lemma, and rotationally invariant case (Proposition 1.3) combine to show that a transversely convex tube with cpo is either cylindrical or quadric. In other words, we have a “tubular” version of our Main Theorem: Proposition 5.1 (Collar Theorem) A transversely convex tube with cpo is either cylindrical or quadric. In §5, we start with this fact, and show that it “propagates,” using an open/closed argument, to any complete $\,C^{2}\,$ immersion with cpo. This proves our Main Theorem 5.2, and the argument is not difficult. For as we mentioned above, any surface $\,M\,$ with cpo contains an annular subset that embeds in $\,\mathbf{R}^{3}\,$ as a transversely convex tube. Our Collar Theorem now makes that tube either cylindrical or quadric. But the boundaries of such a tube, in either case, are again transverse central ovals. So they too have annular neighborhoods that embed as transversely convex tubes. Roughly speaking, this pushes the boundaries of the tube a little further out along $\,M\,$, and by completeness, the process terminates only when the tube engulfs all of $\,M\,$. We conclude in §6, with an application that first motivated us toward the Main Theorem here: We extend the main result from our earlier paper with M. Ghomi on skewloops [GS]. A _skewloop_ is a smoothly immersed loop in $\,\mathbf{R}^{3}\,$ with no pair of distinct parallel tangent lines. In [GS], we showed that _when a complete $C^{2}$-immersed surface in $\,\mathbf{R}^{3}\,$ has a point of positive curvature, it contains a skewloop if and only if it is not quadric._ We required the positive curvature assumption because our proof cited Proposition 1.2 above (Blaschke’s theorem) in an essential way. The Main Theorem here lets us bypass that result, eliminating the positive curvature assumption in favor of one that holds for many surfaces with _no_ positive curvature: the existence of a single transverse planar oval. We thus obtain Theorem 6.5. Suppose a $C^{2}$-immersed surface $\,M\subset\mathbf{R}^{3}\,$ crosses some plane transversally along an oval. Then exactly one of the following holds: * (i) $S\,$ contains a skewloop. * (ii) $S\,$ is the cylinder over an oval. * (iii) $S\,$ is a non-cylindrical quadric. For instance, this result characterizes the tube (i.e. one-sheeted) hyperboloids as _the only negatively curved surfaces that contain a transverse plane oval, but no skewloop_. We now proceed from the overview above to the details of our paper, starting with some preliminary facts about ovals. ## 2\. Oval and Centrix Recall that by an _oval_ in the plane, we mean an embedded, _strictly_ convex $\,C^{2}\,$ loop, and that a _central oval_ has central symmetry—symmetry with respect to reflection through a point called its _center_. ###### Definition 2.1 (Support parametrization/support function). A map $\,\gamma:\mathbf{S}^{1}\to\mathbf{R}^{2}\,$ _support parametrizes_ an oval $\,\mathcal{O}\subset\mathbf{R}^{2}\,$ if and only if it satisfies (2.1) $\gamma^{\prime}(\theta)=\left|\gamma^{\prime}(\theta)\right|\mathbf{i}\,e^{\mathbf{i}\theta}\quad\text{for all $\,\theta\in\mathbf{R}\,$}\,.$ Here we have identified $\,\mathbf{C}\approx\mathbf{R}^{2}\,$, and we regard $\,2\pi$-periodic maps $\,\mathbf{R}\to\mathbf{R}^{2}\,$ as maps from $\,\mathbf{S}^{1}\,$ to $\,\mathbf{R}^{2}\,$, in the obvious ways. We use these identifications without further comment below. Notice that (2.1) characterizes parametrization by the inverse of the outer unit normal. This is a diffeomorphism $\,\mathcal{O}\to\mathbf{S}^{1}\,$ on any $\,C^{2}\,$ oval $\,\mathcal{O}$, a fact that yields both existence and uniqueness of the support parametrization. By an easy exercise, the _support function_ $\,h:\mathbf{R}\to\mathbf{R}\,$, given by (2.2) $h(\theta):=\sup_{p\in\mathcal{O}}p\cdot e^{\mathbf{i}\theta}\,,$ determines $\,\gamma\,$ via the formula (2.3) $\gamma(\theta)=\left(h(\theta)+\mathbf{i}\,h^{\prime}(\theta)\right)\,e^{\mathbf{i}\theta}\,.$ Note that when we rotate an oval $\,\mathcal{O}\,$ counterclockwise through an angle $\,\phi\,$ about the origin, (2.2) shifts its support function right by $\,\phi\,$: (2.4) $h(\theta)\mapsto h(\theta-\phi)\,.$ Elementary calculations using (2.3) further show that the support parametrization makes speed and curvature reciprocal to each other: (2.5) $\left|\gamma^{\prime}(\theta)\right|=h(\theta)+h^{\prime\prime}(\theta)\qquad\text{and}\qquad\kappa(\theta)=\frac{1}{h(\theta)+h^{\prime\prime}(\theta)}\,.$ In particular, strict convexity of an oval ensures that its support parametrization _immerses_ the circle into $\,\mathbf{R}^{2}\,$. We eventually want to show that the cross-sectional ovals of a tube with cpo are circular up to affine isomorphism—ellipses. We will do so by invoking ###### Observation 2.2. An oval is an origin-centered ellipse if and only if its support function $\,h\,$ satisfies $\left(h^{2}\right)^{\prime\prime\prime}+4\left(h^{2}\right)^{\prime}=0\,.$ ###### Proof. We may parametrize any origin-centered ellipse by $\alpha(t)=A\,e^{\mathbf{i}\,t}$ for some symmetric invertible matrix $\,A_{2\times 2}\,$. In that case, (2.2) computes its support function as $h(\theta)=\sup_{t}\,A\,e^{\mathbf{i}\,t}\cdot e^{\mathbf{i}\theta}\ =\sup_{t}\,e^{\mathbf{i}\,t}\cdot Ae^{\mathbf{i}\theta}\,.$ This supremum here clearly occurs when $e^{\mathbf{i}\,t}=\frac{Ae^{\mathbf{i}\theta}}{\left|Ae^{\mathbf{i}\theta}\right|}\,,$ which instantly yields $\,h(\theta)=\left|Ae^{\mathbf{i}\theta}\right|\,$. Familiar trig identities then make it easy to deduce (2.6) $h^{2}(\theta)=a\cos(2\theta+b)+c>0\,,$ for some constants $\,a,b\,$ and $\,c\,$, with $\,|a|<c\,$, and the positive solutions of $\,f^{\prime\prime\prime}+4f^{\prime}=0\,$ are precisely the functions given by (2.6). ∎ Geometrically, (2.6) characterizes the support function of an ellipse with major and minor axes $\,\sqrt{c\pm a}\,$. ### 2.3. The centrix. We measure the failure of an oval to be centrally symmetric by examining the auxilliary curve that we call its _centrix_ : ###### Definition 2.4 (Centrix). Given an oval $\,\mathcal{O}\subset\mathbf{R}^{2}\,$ and a unit vector $\,e^{\mathbf{i}\theta}\in\mathbf{S}^{1}\,$, there exist exactly two points on $\,\mathcal{O}\,$ with tangent lines perpendicular to $\,e^{\mathbf{i}\theta}\,$. We call the line segment joining these two points the _$\theta$ -diameter_ of $\,\mathcal{O}\,$. Denoting its midpoint by $\,\mathbf{c}(\theta)\,$, we then call the image of the resulting map $\,\mathbf{c}:\mathbf{S}^{1}\to\mathbf{R}^{2}\,$ the _centrix_ of $\,\mathcal{O}\,$. Figure 3. Midpoints of diameters trace out the centrix. ###### Definition 2.5 (Even/odd). Given the support parametrization $\,\gamma\,$ of an oval $\,\mathcal{O}\,$, we call the maps ${\textstyle{\frac{1}{2}}}\,\left(\gamma(\theta)+\gamma(\theta+\pi)\right)\quad\text{and}\quad{\textstyle{\frac{1}{2}}}\,\left(\gamma(\theta)-\gamma(\theta+\pi)\right)\,,$ the _even_ and _odd_ parts of $\,\gamma\,$ respectively. ###### Observation 2.6. The centrix $\,\mathbf{c}:\mathbf{S}^{1}\to\mathbf{R}^{2}\,$ of $\,\mathcal{O}\,$ coincides with the even part of $\,\gamma\,$. It is a constant if and only if $\,\mathcal{O}\,$ has central symmetry. In that case, the odd part of $\,\gamma\,$ support-parametrizes the origin-centered oval $\,\mathcal{O}-\mathbf{c}\,$. ###### Proof. The defining condition for the support parametrization (2.1) puts the endpoints of each $\theta$-diameter on $\,\mathcal{O}\,$ at $\,\gamma(\theta)\,$ and $\,\gamma(\theta+\pi)\,$. It follows immediately that the even part of $\,\gamma\,$ parametrizes the centrix$\,\mathbf{c}\,$. When $\,\mathbf{c}(\theta)\equiv\mathbf{c}_{0}\in\mathbf{R}^{2}\,$, reflection through $\,\mathbf{c}_{0}\,$ clearly preserves $\,\mathcal{O}\,$. Conversely, if reflection through some point $\,\mathbf{c}_{0}\,$ preserves $\,\mathcal{O}\,$, it—like any affine isomorphism—must preserve pairs of parallel lines. In particular, it will swap the endpoints of each $\theta$-diameter, preserving their midpoints. But reflection through $\,\mathbf{c}_{0}\,$ preserves no other point. So central symmetry means $\,\mathbf{c}(\theta)\equiv\mathbf{c}_{0}\,$. The even and odd parts of $\,\gamma\,$ always add back to $\,\gamma\,$. So when $\,\mathcal{O}\,$ is central, the odd part $\,\gamma^{*}\,$ clearly parametrizes $\,\mathcal{O}-\mathbf{c}\,$, whose center of symmetry obviously lies at the origin. In this case, we also have $\,(\gamma^{*})^{\prime}(\theta)=\gamma^{\prime}(\theta)\,$, a multiple of $\,\mathbf{i}\,e^{\mathbf{i}\theta}\,$. It follows that (2.1) must hold for $\,\gamma^{*}\,$, which makes it a support parametrization. ∎ ## 3\. Splitting In this section we tackle the technical key to our Main Theorem, establishing that cpo forces the support function of a transversely convex tube to split along purely horizontal and vertical factors. Our Splitting Lemma 3.10 states this precisely, and the geometric consequence that makes it interesting, our Cylinder/Quadric Proposition 3.11, then follows fairly easily. To prepare for the Splitting Lemma, we need calculations that stretch over a number of pages. We hope the following descriptive plan-of-attack will help the reader navigate them with a clear sense of our intentions. Our strategy is to focus on the families of ovals one gets by intersecting a transversely convex tube $\,\mathcal{T}\,$ with planes tilted slightly away from the horizontal. Specifically, given any $\,\varepsilon\in\mathbf{R}\,$ and any unit-vector $\,\tau\in\mathbf{S}^{1}\,$, we consider the $\varepsilon$-tilted plane given by (3.1) $P_{\tau,b}(\varepsilon):=\left\\{(p,z)\in\mathbf{R}^{2}\times\mathbf{R}:\ z=\varepsilon\,(p\cdot\tau)+b\right\\}.$ We call $\,\tau\,$ the tilt-direction, $\,b\,$ the $z$-intercept, and $\,\varepsilon\,$ the slope of this plane. Fixing $\,\tau\in\mathbf{S}^{1}\,$ and $\,b\in(-1,1)\,$, we vary the slope $\,\varepsilon\,$ of this plane, and study the resulting intersections with $\,\mathcal{T}\,$ near $\,\varepsilon=0\,$. Since $\,\mathcal{T}\,$ is transversely convex, it intersects _horizontal_ planes in $\,C^{2}\,$ ovals. By transversality, the cross-section $\,P_{\tau,b}(\varepsilon)\cap\mathcal{T}\,$ remains a $\,C^{2}\,$ oval for all sufficiently small $\,\varepsilon\,$. When we assume that $\,\mathcal{T}\,$ has cpo, these ovals all have central symmetry too. Our key idea is to study the _centrices_ of these cross-sections. The preservation of central symmetry makes them all singletons, by Observation 2.6—they are independent of the variable $\,\theta\,$ along each oval. Differentiation with respect to $\,\theta\,$ therefore yields a vanishing condition. By taking an initial $\varepsilon$-derivative of this condition at $\,\varepsilon=0\,$, we produce the two partial differential equations of Proposition 3.9. As explained in our introduction, these equations lead fairly directly to our Splitting Lemma. We now work out the details of this program. ### 3.1. The support map of $\,\mathcal{T}\,$. As above, we let $\,\mathcal{T}\,$ denote a transversely convex tube in standard position. By Definition 1.4 $\,\mathcal{T}\,$ intersects the horizontal plane at any height $\,b\in(-1,1)\,$ in an oval we shall call $\,\mathcal{O}(b)\,$. Denote by $\,\nu:\mathcal{T}\to\mathbf{S}^{1}\,$ the map that assigns to each point $\,p=(x,y,z)\in\mathcal{T}\,$ the (horizontal) outer unit normal to $\,\mathcal{O}(z)\,$ at $\,p\,$. Clearly, the map $\mathcal{T}\to\mathbf{S}^{1}\times(-1,1)\quad\text{given by}\quad p\longmapsto\left(\nu(p),\ z(p)\right)\,.$ is a diffeomorphism, whose inverse takes the form (3.2) $\left(e^{\mathbf{i}\theta},\,z\right)\longmapsto\left(\Gamma(\theta,z),\,z\right)$ for some smooth map $\,\Gamma:\mathbf{S}^{1}\times(-1,1)\to\mathbf{R}^{2}\,$. Indeed, $\,\Gamma\,$ reparametrizes $\,\mathcal{T}\,$, and for fixed $\,b\in(-1,1)\,$, it inverts the unit normal map on $\,\mathcal{O}(b)\,$. As mentioned following Definition 2.1, this means that $\,\Gamma(\cdot,b)\,$ support-parametrizes $\,\mathcal{O}(b)\,$, and for this reason, we call it the _support map_ of the tube $\,\mathcal{T}\,$. ### 3.2. The height function $\zeta\,$ We now take an arbitrary intercept $\,-1<b<1\,$ and tilt direction $\,\tau\in\mathbf{S}^{1}\,$, and regard them, for now, as fixed. Define the cross-section $\bar{\mathcal{O}}(b,\varepsilon):=\mathcal{T}\cap P_{\tau,b}(\varepsilon)\,,$ and its image under the projection $\,(x,y,z)\stackrel{{\scriptstyle\pi}}{{\mapsto}}(x,y)\,$, $\mathcal{O}(b,\varepsilon):=\pi\left(\bar{\mathcal{O}}(b,\varepsilon)\right)\,.$ We abbreviate the _horizontal_ ($\varepsilon=0$) cross-section by $\mathcal{O}(b):=\bar{\mathcal{O}}(b,0)\,,$ and we will not hesitate to identify $\,\mathcal{O}(b)\,$ with $\,\mathcal{O}(b,0)\,$ too, since the latter is clearly congruent to $\,\bar{\mathcal{O}}(b,0)\,$. As discussed above, the transverse convexity of $\,\mathcal{T}\,$ ensures that $\,\bar{\mathcal{O}}(b,\varepsilon)\,$ is an oval for all sufficiently small $\,\varepsilon\,$. When $\,\mathcal{T}\,$ has cpo, these tilted ovals will clearly have central symmetry as well, but we need not assume cpo for our immediate goal here: We want to introduce and study the “height function” $\,\zeta(\varepsilon,\theta)\,$ that lets us parametrize $\,\mathcal{O}(b,\varepsilon)\,$ by the map (compare (3.2)) (3.3) $\theta\longmapsto\Bigl{(}\Gamma\left(\theta,\,\zeta(\varepsilon,\theta)\right),\ \zeta\left(\varepsilon,\theta\right)\Bigr{)}\,.$ The Implicit Function Theorem ensures the existence and $\,C^{2}\,$ smoothness of $\,\zeta\,$. For suppose—informed by the characterization of $\,P_{\tau,b}(\varepsilon)\,$ in (3.1)—we define a map $\,G:\mathbf{R}\times\mathbf{S}^{1}\times(-1,1)\to\mathbf{R}\,$ via (3.4) $G(\varepsilon,\theta,\zeta):=\zeta-b-\varepsilon\,\tau\cdot\Gamma(\theta,\zeta)\,.$ Then $\,G\,$ inherits $\,C^{2}\,$ smoothness from $\,\Gamma\,$, and the pre- image of $\,\mathcal{O}(b,\varepsilon)\,$ in $\,\mathbf{S}^{1}\times(-1,1)\,$ under the parametrization of $\,\mathcal{T}\,$ in (3.2) clearly solves $G(\varepsilon,\theta,\zeta)=0\,.$ On the _horizontal_ oval $\,\mathcal{O}(b)\,$, we have $\,\zeta\equiv b\,$, so that trivially, $G(0,\theta,b)\equiv 0\quad\text{and}\quad\frac{\partial G}{\partial\zeta}\left(0,\theta,b\right)=1\neq 0\quad\text{for all $\,\theta\in\mathbf{S}^{1}\,$.}$ The Implicit Function Theorem then provides a $\,\delta>0\,$, and a $\,C^{2}\,$ mapping $\,\zeta:(-\delta,\delta)\times\mathbf{S}^{1}\to\mathbf{R}\,$ that satisfies (3.5) $\zeta(0,\theta)\equiv b\quad\text{for all $\,\theta\in\mathbf{S}^{1}\,$}\,,$ and $G\left(\varepsilon,\theta,\zeta(\varepsilon,\theta)\right)\equiv 0\quad\text{for all $\,\theta\in\mathbf{S}^{1},\,|\varepsilon|<\delta\,$.}$ Written out using (3.4), the latter equation becomes (3.6) $\zeta(\varepsilon,\theta)=b+\varepsilon\,\tau\cdot\Gamma\left(\theta,\,\zeta(\varepsilon,\theta)\right),$ which shows that, as hoped, (3.3) parametrizes $\,\mathcal{O}(b,\varepsilon)\,$. Now observe that the projection $\,(x,y,z)\stackrel{{\scriptstyle\pi}}{{\to}}(x,y)\,$ induces an affine isomorphism $\,P_{\tau,b}(\varepsilon)\approx\mathbf{R}^{2}\,$. Such maps preserve strict convexity, so that $\,\mathcal{O}(b,\varepsilon)\,$, and of course $\,\mathcal{O}(b)\,$, are again ovals. For future reference, we note that affine isomorphisms also preserve central symmetry. So when $\,\mathcal{T}\,$ has cpo, the projected oval $\,\mathcal{O}(b,\varepsilon)\,$ further inherits the central symmetry that cpo ascribes to $\,\bar{\mathcal{O}}(b,\varepsilon)\,$. In any case, it will suffice henceforth to study the projected ovals $\,\mathcal{O}(b,\varepsilon)\,$ as it varies with $\,\varepsilon\,$. In view of (3.3), we may clearly parametrize $\,\mathcal{O}(b,\varepsilon)\,$ by the immersion (3.7) $\theta\longmapsto\Gamma\left(\theta,\,\zeta(\varepsilon,\theta)\right)\ .$ To analyze the initial variation of the centrix of $\,\mathcal{O}(b,\varepsilon)\,$, we will eventually requires following facts about the derivatives of $\,\zeta\,$. The reader will easiliy confirm them by differentiating (3.6) implicitly, and using (3.5): ###### Observation 3.3. We have $\frac{\partial\zeta}{\partial\varepsilon}(0,\theta)=\tau\cdot\Gamma\left(\theta,\,b\right)$ and $\frac{\partial^{2}\zeta}{\partial\varepsilon\,\partial\theta}\left(0,\theta\right)=\tau\cdot\frac{\partial{\Gamma}}{\partial\theta}\left(\theta,b\right)\ .$ ### 3.4. The support-reparametrizing map $\,\theta_{\varepsilon}\,$ Though (3.7) parametrizes $\,\mathcal{O}(b,\varepsilon)\,$, we want to study the _centrix_ of $\,\mathcal{O}(b,\varepsilon)\,$. Observation 2.6 offers a way to parametrize the centrix, but it derives from the _support_ parametrization of $\,\mathcal{O}(b,\varepsilon)\,$, not the one given by (3.7). The Proposition below details the needed reparametrization, and its final conclusion yields a crucial input to our proof of the Splitting Lemma 3.10. Notation is as above. ###### Proposition 3.5. There exists a $\,\delta>0\,$ and a differentiable 1-parameter family of diffeomorphisms $\theta_{\varepsilon}:\mathbf{S}^{1}\to\mathbf{S}^{1}\quad-\delta<\varepsilon<\delta\,,$ such that the composition $\Gamma_{\varepsilon}\circ\theta_{\varepsilon}=\Gamma\left(\theta_{\varepsilon},\,\zeta(\varepsilon,\theta_{\varepsilon})\right)$ support-parametrizes $\,\mathcal{O}(b,\varepsilon)\,$ for each $\,\varepsilon\in(-\delta,\delta)\,$. The initial map $\,\theta_{0}\,$ is the identity on $\,\mathbf{S}^{1}\,$, with initial $\varepsilon$-derivative given by $\frac{d\theta_{\varepsilon}}{d\varepsilon}\Big{|}_{\varepsilon=0}=\left(\tau\cdot\mathbf{i}e^{\mathbf{i}\theta}\right)\left(\frac{\partial\Gamma}{\partial\zeta}(\theta,b)\cdot e^{\mathbf{i}\theta}\right)\,.$ ###### Proof. The existence of $\,\theta_{\varepsilon}\,$ is routine. For, $\,\Gamma\left(\theta,\zeta(\varepsilon,\theta)\right)\,$ parametrizes $\,\mathcal{O}(b,\varepsilon)\,$, and is $\,C^{2}\,$ in both $\,\theta\,$ and $\,\varepsilon\,$. This makes the unit outer normal $\,\nu_{\varepsilon}(\theta)\,$ on $\,\mathcal{O}(b,\varepsilon)\,$ continuously differentiable in both variables, while the strict convexity of $\,\mathcal{O}(b,\varepsilon)\,$ ensures that $\,\nu_{\varepsilon}\,$ induces a diffeomorphism $\,\mathbf{S}^{1}\to\mathbf{S}^{1}\,$ that varies smoothly with $\,\varepsilon\in(-\delta,\delta)\,$. By the Inverse Function Theorem, the inverse of this map varies smoothly in $\,\varepsilon\,$ too. As noted after Definition 2.1, however, the inverse of the outer normal on an oval gives its support parametrization. We therefore get the desired family of reparametrizing maps by setting $\,\theta_{\varepsilon}:=(\nu_{\varepsilon})^{-1}\,$ for each $\,|\varepsilon|<\delta\,$. Note too that by (3.5), setting $\,\varepsilon=0\,$ reduces $\,\Gamma\left(\theta,\zeta(\varepsilon,\theta)\right)\,$ to $\,\Gamma(\theta,b)\,$, which already support-parametrizes $\,\mathcal{O}(b)\,$, by definition of $\,\Gamma\,$. So $\,\theta_{0}\,$ is the trivial reparametrization—the identity map—as claimed. It remains to verify the stated formula for $\,\partial\theta_{\varepsilon}/\partial\varepsilon\,$ at $\,\varepsilon=0\,$. This requires some careful calculations. Start by observing that since $\,\Gamma_{\varepsilon}\circ\theta_{\varepsilon}\,$ support-parametrizes $\,\mathcal{O}(b,\varepsilon)\,$ when $\,|\varepsilon|<\delta\,$. By (2.1), this makes its velocity at any input $\,\theta\,$ a multiple of $\,\mathbf{i}e^{\mathbf{i}\theta}\,$. Hence $0\equiv e^{\mathbf{i}\theta}\cdot\frac{\partial}{\partial\theta}\left(\Gamma_{\varepsilon}\circ\theta_{\varepsilon}\right)\,.$ Use the chain rule to expand the derivative, abbreviating $\,\theta_{\varepsilon}(\theta)\,$ as simply $\,\theta_{\varepsilon}\,$, to rewrite this condition as $\displaystyle 0$ $\displaystyle=$ $\displaystyle e^{\mathbf{i}\theta}\cdot\frac{\partial}{\partial\theta}\,\Gamma\bigl{(}\theta_{\varepsilon},\,\zeta(\varepsilon,\,\theta_{\varepsilon})\bigr{)}$ $\displaystyle=$ $\displaystyle e^{\mathbf{i}\theta}\cdot\left[\frac{\partial\Gamma}{\partial\theta}\bigl{(}\theta_{\varepsilon},\zeta(\varepsilon,\theta_{\varepsilon})\bigr{)}+\frac{\partial\Gamma}{\partial\zeta}\bigl{(}\theta_{\varepsilon},\zeta(\varepsilon,\theta_{\varepsilon})\bigr{)}\frac{\partial\zeta}{\partial\theta}\left(\varepsilon,\theta_{\varepsilon}\right)\right]\frac{\partial\theta_{\varepsilon}}{\partial\theta}$ Since $\,\theta_{\varepsilon}\,$ is a diffeomorphism of $\,\mathbf{S}^{1}\,$, its derivative along the circle never vanishes. So we can divide out the final factor above and conclude that for all $\,|\varepsilon|<\delta\,$, we have (3.8) $\frac{\partial\zeta}{\partial\theta}\left(\varepsilon,\theta_{\varepsilon}\right)\,\frac{\partial\Gamma}{\partial\zeta}\Bigl{(}\theta_{\varepsilon},\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\Bigr{)}\cdot e^{\mathbf{i}\theta}\ =\ -\frac{\partial\Gamma}{\partial\theta}\Bigl{(}\theta_{\varepsilon},\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\Bigr{)}\cdot e^{\mathbf{i}\theta}\,.$ Regarding this as a characterization of $\,\theta_{\varepsilon}\,$, we will differentiate implicitly with respect to $\,\varepsilon\,$, then set $\,\varepsilon=0\,$ to verify the Proposition’s final claim. To manage the task, we differentiate the two sides of (3.8) separately before equating them to get our final conclusion. Left side of (3.8): Differentiate the left-hand side of (3.8). Because $\,\zeta(0,\theta)\equiv b\,$, all pure $\theta$-derivatives of $\,\zeta\,$ vanish at $\,\varepsilon=0\,$, and we can rewrite the sole surviving summand using Observation 3.3: $\displaystyle\frac{\partial}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\left[\frac{\partial\zeta}{\partial\theta}\left(\varepsilon,\theta_{\varepsilon}\right)\,\frac{\partial\Gamma}{\partial\zeta}\Bigl{(}\theta_{\varepsilon},\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\Bigr{)}\cdot e^{\mathbf{i}\theta}\right]$ $\displaystyle=$ $\displaystyle\frac{\partial^{2}\zeta}{\partial\theta\,\partial\varepsilon}\left(0,\theta\right)\,\frac{\partial\Gamma}{\partial\zeta}\left(\theta,b\right)\cdot e^{\mathbf{i}\theta}$ $\displaystyle=$ $\displaystyle\left(\tau\cdot\frac{\partial\Gamma}{\partial\theta}\left(\theta,b\right)\right)\,\left(\frac{\partial\Gamma}{\partial\zeta}\left(\theta,b\right)\cdot e^{\mathbf{i}\theta}\right)\,.$ Right side of (3.8): Now differentiate the right side of (3.8). Again, the constancy of $\,\zeta(\varepsilon,\theta)\,$ at $\,\varepsilon=0\,$ eliminates most summands, so that (3.10) $\displaystyle\frac{\partial}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\left[-\frac{\partial\Gamma}{\partial\theta}\Bigl{(}\theta_{\varepsilon},\,\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\Bigr{)}\,\cdot e^{\mathbf{i}\theta}\right]=$ $\displaystyle-\left(\frac{\partial^{2}\Gamma}{\partial\theta^{2}}\bigl{(}\theta,b\bigr{)}\cdot e^{\mathbf{i}\theta}\right)\frac{\partial\theta_{\varepsilon}}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\ -\ \left(\frac{\partial^{2}\Gamma}{\partial\theta\,\partial\zeta}\bigl{(}\theta,b\bigr{)}\cdot e^{\mathbf{i}\theta}\right)\frac{\partial\zeta}{\partial\varepsilon}\bigl{(}0,\theta\bigr{)}\,.$ We can now simplify this further, because $\,\Gamma(\,\cdot,b)\,$ support- parametrizes $\,\mathcal{O}(b)\,$. This implies, via (2.1), that at the preimage $\,(\theta,b)\,$ of any point in that oval, we have two identities: $\frac{\partial\Gamma}{\partial\theta}\cdot e^{\mathbf{i}\theta}\equiv 0\quad\text{and}\quad\frac{\partial\Gamma}{\partial\theta}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}=\left|\frac{\partial\Gamma}{\partial\theta}\right|\,.$ The first of these lets us deduce $\frac{\partial^{2}\Gamma}{\partial\theta\,\partial\zeta}\cdot e^{\mathbf{i}\theta}=\frac{\partial}{\partial\zeta}\,\left(\frac{\partial\Gamma}{\partial\theta}\cdot e^{\mathbf{i}\theta}\right)=0\,,$ which eliminates the final term on the right in (3.10). Alternatively, if we differentiate the first of the two identities above with respect to $\,\theta\,$, and then use the second, we get (3.11) $\frac{\partial^{2}\Gamma}{\partial\theta^{2}}\cdot e^{\mathbf{i}\theta}=-\frac{\partial\Gamma}{\partial\theta}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}=-\left|\frac{\partial\Gamma}{\partial\theta}\right|\,.$ This lets us rewrite the first term on the right in (3.10), collapsing the whole equation to (3.12) $\frac{\partial}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\left[-\frac{\partial\Gamma}{\partial\theta}\Bigl{(}\theta_{\varepsilon},\,\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\Bigr{)}\,\cdot e^{\mathbf{i}\theta}\right]=\left|\frac{\partial\Gamma}{\partial\theta}\right|\ \frac{\partial\theta_{\varepsilon}}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\,.$ We now finish by setting (3.4) equal to (3.12). This exhibits the initial $\varepsilon$-derivative of equation (3.8) as $\left(\frac{\partial\Gamma}{\partial\theta}\cdot\tau\right)\,\left(\frac{\partial\Gamma}{\partial\zeta}\cdot e^{\mathbf{i}\theta}\right)\ =\ \left|\frac{\partial\Gamma}{\partial\theta}\right|\ \frac{\partial\theta_{\varepsilon}}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\,.$ Since this holds at the preimage $\,(\theta,b)\,$ of any point in $\,\mathcal{O}(b,\varepsilon)\,$, and since, by (2.1) again, $\,\partial\Gamma/\partial\theta\,$ normalizes to $\,\mathbf{i}\,e^{\mathbf{i}\theta}\,$, this proves the last conclusion of our Proposition. ∎ ### 3.6. The symmetry obstruction. We shall write $\,\mathbf{c}_{\varepsilon}\,$ for the centrix of $\,\mathcal{O}(b,\varepsilon)\,$. By Observation 2.6, $\,\mathcal{O}(b,\varepsilon)\,$ is _central_ if and only if $\,\mathbf{c}_{\varepsilon}\,$ is _constant_ , or equivalently, $\frac{\partial}{\partial\theta}\mathbf{c}_{\varepsilon}\equiv 0\,.$ Now observe that when $\,\mathcal{O}(b,\varepsilon)\,$ has central symmetry for all $\,\varepsilon\,$ sufficiently near zero—as it clearly does when $\,\mathcal{T}\,$ has cpo—we will also have (3.13) $\frac{\partial^{2}}{\partial\theta\,\partial\varepsilon}\Big{|}_{\varepsilon=0}\mathbf{c}_{\varepsilon}\equiv 0\,.$ The initial mixed second partial of $\,\mathbf{c}_{\varepsilon}\,$ thus forms an _obstruction_ to cpo. We want to show that conversely, the vanishing of this obstruction—independently of the tilt-direction $\,\tau\,$ and the height $\,b\,$ at which we compute it—has a strong consequence. Indeed, this vanishing condition ultimately yields the partial differential equations of Proposition 3.9, which in turn imply the Splitting Lemma 3.10. To get there, we first need to rewrite the vanishing condition (3.13) in terms of the support function of the horizontal oval $\,\mathcal{O}(b)\,$. Toward that goal, we abbreviate $\theta_{\varepsilon}:=\theta_{\varepsilon}(\theta)\quad\text{and}\quad{\bar{\theta}}_{\varepsilon}:=\theta_{\varepsilon}(\theta+\pi)$ for each $\,\theta\in\mathbf{S}^{1}\,$, then combine Observation 2.6 with Proposition 3.5 to get a formula for $\,\mathbf{c}_{\varepsilon}\,$: (3.14) $\mathbf{c}_{\varepsilon}(\theta)=\frac{\Gamma\left(\theta_{\varepsilon},\zeta(\varepsilon,\theta_{\varepsilon})\right)+\Gamma\left({\bar{\theta}}_{\varepsilon},\zeta(\varepsilon,{\bar{\theta}}_{\varepsilon})\right)}{2}\,.$ In order to unpack (3.13), we must differentiate this formula twice: First with respect to $\varepsilon\,$, and then with respect to $\,\theta\,$. We record the initial $\varepsilon$-derivative as Lemma 3.7 below. To prepare, let $\,\Gamma^{*}(\,\cdot,z)\,$ denote the _odd_ part of $\,\Gamma(\,\cdot,z)\,$ as specified by Definition 2.5, and let $\,\mathbf{c}(z)\,$ denote the centroid of $\,\mathcal{O}(z)\,$ for each $\,-1<z<1\,$. In the language of Definition 1.4, $\,\mathbf{c}\,$ parametrizes the _central curve_ of $\,\mathcal{T}\,$, while $\,\Gamma^{*}\,$ parametrizes its _rectification_ $\,\mathcal{T}^{*}\,$. ###### Lemma 3.7. Suppose the horizontal cross-section $\,\mathcal{O}(z)\,$ of a transversely convex tube $\,\mathcal{T}\,$ is central about $\,(\mathbf{c}(z),z)\,$ for each $\,-1<z<1\,$. Then for any fixed tilt-direction $\,\tau\in\mathbf{S}^{1}\,$, we have $\displaystyle\frac{\partial\mathbf{c}_{\varepsilon}}{\partial\varepsilon}\left(\theta,z\right)\Big{|}_{\varepsilon=0}$ $\displaystyle=$ $\displaystyle\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Bigl{(}\frac{\ \partial\Gamma^{*}}{\partial\zeta}\cdot e^{\mathbf{i}\theta}\Bigr{)}\frac{\ \partial\Gamma^{*}}{\partial\theta}$ $\displaystyle\qquad\ +\ \bigl{(}\tau\cdot\mathbf{c}(z)\bigr{)}\,\mathbf{c}^{\prime}(z)\ +\ \bigl{(}\tau\cdot\Gamma^{*}\bigr{)}\,\frac{\ \partial\Gamma^{*}}{\partial\zeta}\,.$ We evaluate $\,\Gamma^{*}\,$ and its derivatives here at $\,(\theta,z)$ throughout. ###### Proof. With (3.14) in view, we first compute the initial $\varepsilon$-derivative of $\,\Gamma(\theta_{\varepsilon},\,\zeta(\varepsilon,\theta_{\varepsilon}))$. Recall that by Proposition 3.5, $\,\theta_{0}(\theta)=\theta\,$, and abbreviate $\theta_{0}^{\prime}:=\frac{\partial\theta_{\varepsilon}}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\,.$ A routine application of the chain rule then gives $\displaystyle\frac{\partial}{\partial\varepsilon}\Big{|}_{\varepsilon=0}\Gamma\bigl{(}\theta_{\varepsilon},\,\zeta\left(\varepsilon,\theta_{\varepsilon}\right)\bigr{)}$ $\displaystyle=$ $\displaystyle\frac{\partial\Gamma}{\partial\theta}\left(\theta,z\right)\theta_{0}^{\prime}+\frac{\partial\Gamma}{\partial\zeta}(\theta,z)\Bigl{(}\frac{\partial{\zeta}}{\partial\varepsilon}(0,\theta)+\frac{\partial\zeta}{\partial\theta}\left(0,\theta\right)\theta^{\prime}_{0}\Bigr{)}$ $\displaystyle=$ $\displaystyle\frac{\partial\Gamma}{\partial\theta}\left(\theta,z\right)\theta_{0}^{\prime}+\frac{\partial\Gamma}{\partial\zeta}(\theta,z)\Bigl{(}\tau\cdot\Gamma\left(\theta,z\right)\Bigr{)}\,,$ where we have used equation (3.5) and Observation 3.3 to evaluate the derivatives of $\,\zeta\,$. We must average (LABEL:eqn:Geps) over $\,\\{\theta,\bar{\theta}\\}\,$ to get the initial $\varepsilon$-derivative of $\,\mathbf{c}_{\varepsilon}\,$ via (3.14). We assume $\,\Gamma(\theta,z)\,$ support-parametrizes an oval $\,\mathcal{O}(z)\,$ having central symmetry about $\,\mathbf{c}(z)\,$ for each $\,-1<z<1\,$, so we have $\Gamma(\theta,z)=\mathbf{c}(z)+\Gamma^{*}(\theta,z)$ as in Observation 2.6. Here $\,\Gamma^{*}\,$ and all its $\theta$-derivatives are odd, so that for instance $\Gamma^{*}(\bar{\theta},z)=-\Gamma^{*}(\theta,z)\,.$ All $\theta$-derivatives of $\,\mathbf{c}(z)\,$, on the other hand, clearly vanish. If we average (LABEL:eqn:Geps) over $\,\\{\theta,\bar{\theta}\\}\,$ with all these facts in mind, we get $\displaystyle\frac{\partial\mathbf{c}_{\varepsilon}}{\partial\varepsilon}\left(\theta,z\right)\Big{|}_{\varepsilon=0}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\left\\{\frac{\partial\Gamma}{\partial\theta}\left(\theta,z\right)\,\theta_{0}^{\prime}+\frac{\partial\Gamma}{\partial\zeta}\left(\theta,z\right)\left(\tau\cdot\Gamma\left(\theta,z\right)\right)\right.$ $\displaystyle\quad+\left.\quad\frac{\partial\Gamma}{\partial\theta}\left(\bar{\theta},z\right)\,\bar{\theta}_{0}^{\prime}+\frac{\partial\Gamma}{\partial\zeta}\left(\bar{\theta},z\right)\left(\tau\cdot\Gamma\left(\bar{\theta},z\right)\right)\right\\}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\left\\{\frac{\ \partial\Gamma^{*}}{\partial\theta}\,\theta_{0}^{\prime}+\left(\mathbf{c}^{\prime}(z)+\frac{\ \partial\Gamma^{*}}{\partial\zeta}\right)\Bigl{(}\tau\cdot\left(\mathbf{c}(z)+\Gamma^{*}\right)\Bigr{)}\right.$ $\displaystyle\quad-\left.\frac{\ \partial\Gamma^{*}}{\partial\theta}\,\bar{\theta}_{0}^{\prime}+\left(\mathbf{c}^{\prime}(z)-\frac{\ \partial\Gamma^{*}}{\partial\zeta}\right)\Bigl{(}\tau\cdot\left(\mathbf{c}(z)-\Gamma^{*}\right)\Bigr{)}\right\\},$ where we now evaluate $\,\Gamma^{*}\,$ and its derivatives at $\,(\theta,z)\,$ throughout. To simplify further, note that the four mixed products involving $\,\mathbf{c}$ and $\,\Gamma^{*}$-terms cancel in pairs, so that $\displaystyle\frac{\partial\mathbf{c}_{\varepsilon}}{\partial\varepsilon}\left(\theta,z\right)\Big{|}_{\varepsilon=0}$ $\displaystyle=$ $\displaystyle\left(\frac{\theta_{0}^{\prime}-\bar{\theta}_{0}^{\prime}}{2}\right)\frac{\ \partial\Gamma^{*}}{\partial\theta}+\bigl{(}\tau\cdot\mathbf{c}(z)\bigr{)}\mathbf{c}^{\prime}(z)+\left(\tau\cdot\Gamma^{*}\right)\frac{\ \partial\Gamma^{*}}{\partial\zeta}$ This will give the formula we seek—we just need to prove (3.16) $\frac{\theta_{0}^{\prime}-\bar{\theta}_{0}^{\prime}}{2}=\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Bigl{(}\frac{\ \partial\Gamma^{*}}{\partial\zeta}\cdot e^{\mathbf{i}\theta}\Bigr{)}\,.$ For that, we invoke Proposition 3.5. Since $\,\Gamma^{*}\,$ and $\,e^{\mathbf{i}\theta}\,$ are both odd, that Proposition yields $\displaystyle\theta_{0}^{\prime}$ $\displaystyle=$ $\displaystyle\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Bigl{(}\mathbf{c}^{\prime}(z)\cdot e^{\mathbf{i}\theta}+\frac{\ \partial\Gamma^{*}}{\partial\zeta}\cdot e^{\mathbf{i}\theta}\Bigr{)}$ $\displaystyle\bar{\theta}_{0}^{\prime}$ $\displaystyle=$ $\displaystyle\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Bigl{(}\mathbf{c}^{\prime}(z)\cdot e^{\mathbf{i}\theta}-\frac{\ \partial\Gamma^{*}}{\partial\zeta}\cdot e^{\mathbf{i}\theta}\Bigr{)}\,.$ Subtract the second line from the first to get (3.16), and the desired formula follows. ∎ To finish analyzing the vanishing condition (3.13), we next need to differentiate the result just proven with respect to $\theta$. That seems to require a lengthy calculation, but if we work with respect to the frame $\,\\{e^{\mathbf{i}\theta},\,\mathbf{i}\,e^{\mathbf{i}\theta}\\}\,$, a simple observation eliminates the $\,e^{\mathbf{i}\theta}$ term entirely. ###### Observation 3.8. Suppose the horizontal cross-section $\,\mathcal{O}(z)\,$ of a transversely convex tube $\,\mathcal{T}\,$ is central about $\,(\mathbf{c}(z),z)\,$ for each $\,-1<z<1\,$. Then for each tilt-direction $\,\tau\in\mathbf{S}^{1}\,$, there exists a function $\,f_{\tau}:\mathbf{S}^{1}\times(-1,1)\to\mathbf{R}\,$ such that $\frac{\,\partial^{2}\mathbf{c}_{\varepsilon}}{\partial\varepsilon\,\partial\theta}\bigl{(}\theta,z\bigr{)}\Big{|}_{\varepsilon=0}=f_{\tau}(\theta,z)\,\mathbf{i}\,e^{\mathbf{i}\theta}$ for all $\,(\theta,z)\in\mathbf{S}^{1}\times(-1,1)\,$. ###### Proof. We get $\,\mathbf{c}_{\varepsilon}\,$ by symmetrizing each member in a smooth family of support parametrizations: $\mathbf{c}_{\varepsilon}\,(\theta)={\textstyle{\frac{1}{2}}}\left(\gamma_{\varepsilon}(\theta)+\gamma_{\varepsilon}(\theta+\pi)\right)$ Indeed, our formula (3.14) expresses $\,\mathbf{c}_{\varepsilon}\,$ in this way. It then follows from the defining condition (2.1) for support parametrizations, that $\frac{\partial}{\partial\theta}\mathbf{c}_{\varepsilon}={\textstyle{\frac{1}{2}}}\bigl{(}\left|\gamma_{\varepsilon}^{\prime}(\theta)\right|+\left|\gamma_{\varepsilon}^{\prime}(\theta+\pi)\right|\bigr{)}\mathbf{i}\,e^{\mathbf{i}\theta}$ Differentiation with respect to $\,\varepsilon\,$ affects only the scalar coefficient of $\,\mathbf{i}\,e^{\mathbf{i}\theta}\,$ here, making the desired fact obvious. ∎ Thanks to Observation 3.8, the vanishing condition (3.13) reduces to $\,f_{\tau}\equiv 0\,$. The two crucial PDE’s we have been aiming toward merely interpret this simple equation and now make their appearance in the statement of Proposition 3.9 below. As we have explained above, Proposition 3.9 is the technical heart of this section. It also marks our first real use of the cpo assumption: Up to now, our results have at most assumed central symmetry for the _horizontal_ cross- sections of $\,\mathcal{T}\,$. To set up the statement of Proposition 3.9, recall that for each $\,|z|<1\,$, $\,\Gamma^{*}(\,\cdot,z)\,$ support-parametrizes the horizontal cross-section $\,\mathcal{O}(z)-\mathbf{c}(z)\,$ of the rectified tube $\,\mathcal{T}^{*}\,$. There consequently exists a $\,C^{2}\,$ function $h:\mathbf{S}^{1}\times[-1,1]\to\mathbf{R}$ which, for each fixed $\,|z|<1\,$, yields the support function of that oval. We call $\,h\,$ the _transverse support function of $\,\mathcal{T}^{*}\,$_. To simplify notation, we now adopt the convention of indicating partial differentiation with respect to a given variable by subscripting with that variable. ###### Proposition 3.9. On a transversely convex tube $\,\mathcal{T}\,$ with cpo, the transverse support function $\,h\,$ of $\,\mathcal{T}^{*}\,$ satisfies two partial differential equations: $\bigl{(}h_{z}\left(h+h_{\theta\theta}\right)\bigr{)}_{\theta}+\bigl{(}h_{\theta}\left(h+h_{\theta\theta}\right)\bigr{)}_{z}=0$ and $h\,\left(h+h_{\theta\theta}\right)_{z}-\left(h+h_{\theta\theta}\right)\,h_{z}=0\,.$ ###### Proof. Differentiation with respect to $\,\theta\,$ annihilates $\,\mathbf{c}\,$ and $\,\mathbf{c}^{\prime}\,$, and hence Lemma 3.7 combines with Observation 3.8 to give $\displaystyle f_{\tau}$ $\displaystyle=$ $\displaystyle\mathbf{i}\,e^{\mathbf{i}\theta}\cdot\frac{\partial^{2}\mathbf{c}_{\varepsilon}}{\partial\varepsilon\,\partial\theta}\Big{|}_{\varepsilon=0}$ $\displaystyle=$ $\displaystyle\mathbf{i}\,e^{\mathbf{i}\theta}\cdot\bigl{[}\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\Gamma^{*}_{\theta}\bigr{]}_{\theta}+\mathbf{i}\,e^{\mathbf{i}\theta}\cdot\bigl{[}\left(\tau\cdot\Gamma^{*}\right)\Gamma^{*}_{z}\bigr{]}_{\theta}$ Since $\,\Gamma^{*}\,$ support-parametrizes $\,\mathcal{O}(z)-\mathbf{c}(z)\,$ for each $\,z\,$, however, we have $\,\Gamma^{*}_{\theta}=\left|\Gamma^{*}_{\theta}\right|\mathbf{i}\,e^{\mathbf{i}\theta}\,$. This is perpendicular to $\,-e^{\mathbf{i}\theta}=\left(\mathbf{i}\,e^{\mathbf{i}\theta}\right)_{\theta}\,$, so the product rule lets us rewrite the first term on the right above as $\bigl{[}\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\bigr{]}_{\theta}\,.$ To evaluate the second term, note that $\,\Gamma^{*}_{\theta}\cdot\tau=\left|\Gamma^{*}_{\theta}\right|\mathbf{i}\,e^{\mathbf{i}\theta}\cdot\tau\,$, and $\Gamma^{*}_{z\theta}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}=\left(\Gamma^{*}_{\theta}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)_{z}=\left|\Gamma^{*}_{\theta}\right|_{z}\,.$ Taking all these facts into account, our expansion of $\,f_{\tau}\,$ becomes $\displaystyle f_{\tau}$ $\displaystyle=$ $\displaystyle\bigl{[}\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\bigr{]}_{\theta}$ $\displaystyle\qquad+\ \left|\Gamma^{*}_{\theta}\right|\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Gamma^{*}_{z}\cdot\mathbf{i}\,e^{\mathbf{i}\,\theta}\ +\ \left(\tau\cdot\Gamma^{*}\right)\left|\Gamma^{*}_{\theta}\right|_{z}$ Now separate multiples of $\,\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\,$ from those of $\,\tau\cdot e^{\mathbf{i}\theta}\,$, noting that $\,\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)_{\theta}=-\left(\tau\cdot e^{\mathbf{i}\theta}\right)\,$, and that by orthonormal expansion, $\tau\cdot\Gamma^{*}=\left(\tau\cdot e^{\mathbf{i}\theta}\right)\left(e^{\mathbf{i}\theta}\cdot\Gamma^{*}\right)+\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left(\mathbf{i}\,e^{\mathbf{i}\theta}\cdot\Gamma^{*}\right)\,.$ Use these facts to expand $\,f_{\tau}\,$ further, collecting multiples of $\,\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\,$ and $\,\tau\cdot e^{\mathbf{i}\theta}\,$, and noticing that $\left(\Gamma^{*}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|_{z}+\left(\Gamma^{*}_{z}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|=\bigl{(}\left(\Gamma^{*}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\bigr{)}_{z}$ to get $\displaystyle f_{\tau}=$ $\displaystyle\left(\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\Bigl{[}\bigl{(}\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\bigr{)}_{\theta}+\bigl{(}\left(\Gamma^{*}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\bigr{)}_{z}\Bigr{]}$ $\displaystyle\qquad\qquad+\left(\tau\cdot e^{\mathbf{i}\theta}\right)\Bigl{[}\left(e^{\mathbf{i}\theta}\cdot\Gamma^{*}\right)\left|\Gamma^{*}_{\theta}\right|_{z}-\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\Bigr{]}\,.$ Now we invoke the central plane oval assumption, observing that _when $\,\mathcal{T}\,$ has cpo, we must have $\,f_{\tau}\equiv 0\,$_. Indeed, cpo endows the tilted ovals $\,\bar{\mathcal{O}}(z,\varepsilon)\,$ with central symmetry for all $\,\tau\in\mathbf{S}^{1}\,$, all $\,-1<z<1\,$, and all sufficiently small $\,\varepsilon\,$. As noted earlier, the projected ovals $\,\mathcal{O}(z,\varepsilon)\,$ inherit that symmetry too, since the projection $\,(x,y,z)\to(x,y)\,$ induces an affine isomorphism from any non- vertical plane to $\,\mathbf{R}^{2}\,$. Observation 2.6 then makes the centrix $\,\mathbf{c}_{\varepsilon}\,$ of $\,\mathcal{O}(z,\varepsilon)\,$ constant (i.e. independent of $\,\theta\,$) for any tilt-direction $\,\tau\,$, any $\,|z|<1\,$ and all any sufficiently small $\,\varepsilon\,$. The vanishing condition (3.13) therefore obtains. Given Observation 3.8, this forces $\,f_{\tau}\equiv 0\,$ as claimed. We may consequently set the right-hand side of (3.6) equal to zero. But the resulting identity holds for _any_ tilt-direction $\,\tau=:e^{\mathbf{i}\phi}\in\mathbf{S}^{1}\,$, and _the coefficients $\,\tau\cdot e^{\mathbf{i}\theta}=\cos(\phi-\theta)\,$ and $\,\tau\cdot\mathbf{i}\,e^{\mathbf{i}\theta}=\sin(\phi-\theta)\,$ appearing there are clearly linearly independent functions of $\,\tau\,$._ The terms they multiply must therefore vanish _individually_. In short, we now have (3.18) $\displaystyle 0$ $\displaystyle=$ $\displaystyle\Bigl{(}\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\Bigr{)}_{\theta}+\Bigl{(}\left(\Gamma^{*}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|\Bigr{)}_{z}$ (3.19) $\displaystyle 0$ $\displaystyle=$ $\displaystyle\left(e^{\mathbf{i}\theta}\cdot\Gamma^{*}\right)\left|\Gamma^{*}_{\theta}\right|_{z}-\left(\Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}\right)\left|\Gamma^{*}_{\theta}\right|$ For each $\,|z|<1\,$, the relationship between the support parametrization $\,\Gamma^{*}(\,\cdot,z)\,$ of $\,\mathcal{O}(z)\,$ and its support function $\,h(\,\cdot,z)\,$, as detailed in §2, now lets us write $\Gamma^{*}=\left(h+\mathbf{i}\,h_{\theta}\right)\,e^{\mathbf{i}\theta}\quad\text{and}\quad\Gamma^{*}_{\theta}=\left(h+h_{\theta\theta}\right)\mathbf{i}\,e^{\mathbf{i}\theta}\,,$ from which we can immediately deduce $\begin{array}[]{rclcccl}\Gamma^{*}\cdot e^{\mathbf{i}\theta}&=&h\,,&&\Gamma^{*}\cdot\mathbf{i}\,e^{\mathbf{i}\theta}&=&h_{\theta}\\\ \Gamma^{*}_{z}\cdot e^{\mathbf{i}\theta}&=&h_{z}\,,&&\left|\Gamma^{*}_{\theta}\right|&=&h+h_{\theta\theta}\,,\end{array}$ Substituting these into (3.18) and (3.19) instantly gives the differential equations we want. ∎ We can now prove our Splitting Lemma 3.10, restated below. As above, $\,h\,$ denotes the transverse support function of $\,\mathcal{T}^{*}\,$, the rectification of a transversely convex tube $\,\mathcal{T}\,$ with central curve $\,\mathbf{c}\,$. Recall that we say $\,\mathcal{T}^{*}\,$ _splits_ if we can factor its support map $\,\Gamma^{*}(z,\theta)\,$ as a product $\,\gamma(\theta)r(z)\,$, with $\,\gamma\,$ parametrizing a fixed oval and $\,r>0\,$. ###### Proposition 3.10 (Splitting Lemma). If a transversely convex tube $\,\mathcal{T}\,$ in standard position has cpo, then its rectification $\,\mathcal{T}^{*}\,$ splits. ###### Proof. It will clearly suffice to prove that the transverse support function $\,h\,$ of $\,\Gamma^{*}\,$ factors as $\,h(z,\theta)=h(\theta)\,r(z)\,$. We know that $\,h(z,\theta)\,$ satisfies the two differential equations of Proposition 3.9, and we start by noticing that the second equation there forms the numerator of a quotient-rule calculation. Specifically, it implies $\frac{\partial}{\partial z}\left(\frac{h+h_{\theta\theta}}{h}\right)=0\,,$ from which we easily deduce (3.20) $h_{\theta\theta}+h=q^{2}(\theta)\,h$ for some _strictly_ positive, $z$-independent function $\,q\,$ on $\,\mathbf{S}^{1}\,$. We can assume positivity of $\,q\,$ because $\,\mathcal{O}(z)-\mathbf{c}(z)\,$ is origin-centered and strictly convex for each $\,z\,$, properties that, by equations (2.2) and (2.5), make both $\,h\,$ and $\,h_{\theta\theta}+h\,$ strictly positive. In any case, since $\,q\,$ depends only on $\,\theta\,$, we see that the support functions of the translated ovals $\,\mathcal{O}(z)-\mathbf{c}(z)\,$ all solve the same ordinary differential equation, namely (3.20). Such equations have independent solutions, of course, so by itself, (3.20) leaves us short of splitting. But it lets us rewrite the _first_ differential equation of Proposition 3.9 as (3.21) $\bigl{(}h_{z}\,h\,q^{2}\bigr{)}_{\theta}+\bigl{(}h_{\theta}\,h\,q^{2}\bigr{)}_{z}=0\,.$ Since $\,h_{z}h\,$ and $\,h_{\theta}h\,$ are derivatives of (half) the _squared_ support function $H(\theta,z):=h^{2}(\theta,z)\,,$ we can the exploit $z$-independence of $\,q\,$, and use $\,H_{z\theta}=H_{\theta z}\,$ to rewrite (3.21) in the form of a first-order equation for $\,H_{z}\,$: $2H_{z\theta}\,q^{2}+H_{z}\bigl{(}q^{2}\bigr{)}_{\theta}=0\,.$ Now multiply by $\,H_{z}\,$ to recognize that (3.21) actually reduces to $\bigl{(}H_{z}^{2}q^{2}\bigr{)}_{\theta}=0\,.$ Evidently, there exists a $\theta$-independent function $\,\phi(z)\,$ such that $H_{z}(\theta,z)=\phi(z)\big{/}q(\theta)\,.$ Integrating with respect to $\,z\,$ then yields $H(\theta,z)=H(\theta,0)+\frac{\Phi(z)}{q(\theta)}\,,\quad\text{where}\quad\Phi(z):=\int_{0}^{z}\phi(s)\,ds\,.$ Rewrite this as $H(\theta,z)=H(\theta,0)\left(1+\alpha(\theta)\Phi(z)\right)\,,$ where $\alpha(\theta):=\frac{1}{H(\theta,0)\,q(\theta)}\,.$ Since $\,H=h^{2}\,$, and, as the support function of an origin-centered oval, $\,h(\theta,z)$ is always positive, we see that $\,1+\alpha\,\Phi>0\,$ too. Hence (3.22) $h(\theta,z)=h(\theta,0)\sqrt{1+\alpha(\theta)\,\Phi(z)}\,.$ The continuity of $\,\alpha\,$ guarantees it a maximum value $\,\bar{\alpha}\,$ at some point $\,\bar{\theta}\in\mathbf{S}^{1}\,$, and there, (3.22) yields $\displaystyle h(\bar{\theta},z)$ $\displaystyle=$ $\displaystyle h(\bar{\theta},0)\sqrt{1+\bar{\alpha}\,\Phi(z)}$ $\displaystyle h_{\theta}(\bar{\theta},z)$ $\displaystyle=$ $\displaystyle h_{\theta}(\bar{\theta},0)\sqrt{1+\bar{\alpha}\,\Phi(z)}\,.\rule{0.0pt}{17.07164pt}$ These identities show that for any fixed $\,z\,$ with $\,|z|<1\,$, the functions $\,h(\theta,z)\,$ and $\,h(\theta,0)\sqrt{1+\bar{\alpha}\,\Phi(z)}\,$ both obey the same initial conditions at $\,\theta=\bar{\theta}\,$. Since both also solve (3.20), Picard’s uniqueness theorem forces them to agree everywhere. The Lemma consequently holds with $r(z)=\sqrt{1+\bar{\alpha}\,\Phi(z)}\quad\text{and}\quad h(\theta)=h(\theta,0)\,.$ ∎ We now reach the main goal of this section—a geometric consequence of the Splitting lemma: ###### Proposition 3.11. Suppose $\,\mathcal{T}\,$ is a transversely convex tube with cpo. Then its rectification $\,\mathcal{T}^{*}\,$ is either * (i) The cylinder over a central oval, or * (ii) Affinely congruent to a surface of revolution. ###### Proof. We show that when $\,\mathcal{T}\,$ is a transversely convex tube in standard position, and $\,\mathcal{T}^{*}\,$ is _not_ a cylinder, there exists a single linear isomorphism that fixes the $z$-axis while making each horizontal cross- section $\,\mathcal{O}(z)\,$ of $\,\mathcal{T}^{*}\,$ simultaneously circular. This clearly implies the desired result. We start by using the Splitting Lemma to factor the transverse support function $\,h\,$ of $\,\mathcal{T}^{*}\,$ as (3.23) $h(\theta,z)=r(z)\,h(\theta)\,.$ Put this factorization _back_ into the first differential equation in Proposition 3.9 and simplify, to find that $\,r\,$ and $\,h\,$ now jointly solve (3.24) $r\,r^{\prime}\bigl{(}h\,h^{\prime\prime\prime}+3\,h^{\prime}h^{\prime\prime}+4\,h\,h^{\prime}\bigr{)}=0$ on $\,\mathbf{S}^{1}\times(-1,1)\,$. We have assumed that $\,\mathcal{T}^{*}\,$ is not cylindrical, so $\,r^{\prime}(z_{0})\neq 0\,$ for some $\,-1<z_{0}<1\,$. Evaluating (3.24) at that height, we then deduce that the horizontal support function $\,h(\theta)\,$ solves the following ordinary differential equation: $h\,h^{\prime\prime\prime}+3\,h^{\prime}h^{\prime\prime}+4\,h\,h^{\prime}=0\,.$ The reader will find it routine to verify what came as a pleasant surprise to us: That this quadratic ODE for $\,h\,$ reduces to a linear equation—one that could hardly be more familiar—for the _squared_ support function $\,H(\theta):=h^{2}(\theta)\,$: $H^{\prime\prime\prime}+4H^{\prime}=0\,.$ By Proposition 2.2, this makes $\,h(\theta)\,$ the support function of an origin-centered _ellipse_ $\,\mathcal{O}_{0}\,$. By (3.23), _every_ horizontal cross-section of $\,\mathcal{T}^{*}\,$ is then homothetic to $\,\mathcal{O}_{0}\,$, and since it is origin-centered, $\,\mathcal{O}_{0}\,$ is congruent to the unit circle via some linear mapping $\,A\,$ of $\,\mathbf{R}^{2}\,$. Extending $\,A\,$ trivially to $\,\mathbf{R}^{3}\,$, we clearly map $\,\mathcal{T}^{*}\,$ to a surface of revolution, precisely as we sought to prove. ∎ ## 4\. Straightening the central curve So far we have shown, using variational and analytic arguments, that when a transversely convex tube has cpo, it rectifies to either a cylinder or—up to affine isomorphism—a surface of revolution. We now use more elementary arguments of a local geometric type to show that the rectification step is actually superfluous. Specifically, we prove ###### Proposition 4.1 (Axis lemma). Suppose $\,\mathcal{T}\,$ is a transversally convex tube with cpo. Then its central curve is affine, so that $\,\mathcal{T}\,$ is affinely congruent to its rectification $\,\mathcal{T}^{*}\,$. ###### Proof. We can assume $\,\mathcal{T}\,$ lies in the standard position described by Definition 1.4, and it clearly suffices to prove that when $\,\mathcal{T}^{*}\,$ is either a cylinder or a surface of revolution, cpo forces the axis of $\,\mathcal{T}\,$ itself to be a straight line. The latter occurs if and only if the tube’s central curve $\,\mathbf{c}:(-1,1)\to\mathbf{R}^{2}\,$ is affine (linear plus constant). We will establish exactly that, using the following Linearity Criterion: _A $\,C^{2}\,$ mapping $\,\mathbf{c}:I\to\mathbf{R}\,$ is affine on an open interval $\,I\,$ if and only if it is locally _odd_ around each input, in the sense that for all $\,b\in I\,$, we have_ (4.1) $\mathbf{c}(b+t)-\mathbf{c}(b)=-\bigl{(}\mathbf{c}(b-t)-\mathbf{c}(b)\bigr{)}$ _for all sufficiently small $\,t\,$._ When $\,\mathbf{c}\,$ is affine, (4.1) clearly holds. To prove the converse, it suffices to show that (4.1) implies $\,\mathbf{c}^{\prime\prime}\equiv 0\,$. But that follows instantly if we differentiate it twice, and then let $\,t\to 0\,$. With this criterion in hand, we proceed, treating the cylindrical and rotationally symmetric cases separately. Cylindrical case: When $\,\mathcal{T}^{*}\,$ is a cylinder, its horizontal cross-section $\,\mathcal{O}(z)$ at every height $\,z\in(-1,1)\,$ translates to a fixed central oval $\,\mathcal{O}_{0}\in\mathbf{R}^{2}\,$. Take $\,\mathcal{O}_{0}\,$ to be centered at the origin and denote its support parametrization by $\,\gamma\,$ to get this parametrization $\,X:\mathbf{S}^{1}\times(-1,1)\to\mathcal{T}\,$: (4.2) $X(t,z)=\left(\mathbf{c}(z)+\gamma(t),\,z\right)\,.$ Now consider, for any height $\,b\in(-1,1)\,$, and any angle $\,\theta\in\mathbf{R}\,$, the $\theta$-diameter of $\,\mathcal{O}(b)$ (Definition 2.4). Since $\,\gamma\,$ support-parametrizes $\,\mathcal{O}_{0}\,$, the endpoints of this diameter clearly lie at $\,X(\theta,b)\,$ and $\,X(\theta+\pi,b)\,$, and the crucial point is that _the tangent planes to $\,\mathcal{T}\,$ at these endpoints are parallel._ To see that, compute the partial derivatives $\,X_{t}\,$ and $\,X_{z}\,$ at these points. Since $\,\mathcal{O}_{0}\,$ is central, we have $\,\gamma^{\prime}(\theta+\pi)=-\gamma^{\prime}(\theta)\,$, and this makes the tangent planes parallel, since both are spanned by $\left(\gamma^{\prime}(\theta),\,0\right)=\pm X_{t}\quad\text{and}\quad\bigl{(}\mathbf{c}^{\prime}(b),\,1\bigr{)}=X_{z}\,.$ Now suppose, fixing the $\theta$-diameter of $\,\mathcal{O}(b)$ as axis, we tilt the plane $\,z=b\,$ away from the horizontal with some small slope $\,\varepsilon>0\,$ to get a new plane $\,P_{\varepsilon}(\theta)\,$. For sufficiently small $\,\varepsilon>0\,$, the intersection $\,\mathcal{O}(b,\theta,\varepsilon):=\mathcal{T}\cap P_{\varepsilon}(\theta)\,$ will remain an oval—and a central oval, since $\,\mathcal{T}\,$ has cpo. Further, since $\,P_{\varepsilon}(\theta)\,$ contains the $\theta$-diameter of $\,\mathcal{O}(b)$, the endpoints $\,X(\theta,b)\,$ and $\,X(\theta+\pi,b)\,$ of that diameter remain on $\,\mathcal{O}(b,\theta,\varepsilon)\,$ independently of $\,\varepsilon\,$. And since the tangent planes to $\,\mathcal{T}\,$ at these points are parallel, and their intersections with $\,P_{\varepsilon}(\theta)\,$ clearly form lines tangent to $\,\mathcal{O}(b,\theta,\varepsilon)\,$ at $\,X(\theta,b)\,$ and $\,X(\theta+\pi,b)\,$, _those tangent lines are parallel_. The latter fact shows that the $\theta$-diameter of $\,\mathcal{O}(b)\,$ _remains_ a diameter of $\,\mathcal{O}(b,\theta,\varepsilon)\,$ independently of $\,\varepsilon\,$, and hence that _$\,(\mathbf{c}(b),b)$ forms the center of $\,\mathcal{O}(b,\theta,\varepsilon)\,$_, for each $\,\theta\,$ and each sufficiently small $\,\varepsilon>0\,$. The center of $\,\mathcal{O}(b,\theta,\varepsilon)\,$ remains fixed as we vary $\,\varepsilon\,$. Now observe that every point sufficiently close to $\,\mathcal{O}(b)$ on $\,\mathcal{T}\,$ belongs $\,\mathcal{O}(b,\theta,\varepsilon)\,$ for some $\,\theta\,$ and some small $\,\varepsilon>0\,$, so that by cpo, its reflection through $\,(\mathbf{c}(b),b)\,$ also lies on $\,\mathcal{T}\,$. It follows that an entire neighborhood of $\,\mathcal{O}(b)$ in $\,\mathcal{T}\,$ has reflection symmetry through $\,(\mathbf{c}(b),b)\,$. In some neighborhood of $\,(\mathbf{c}(b),b)\,$, the central curve $\,\mathbf{c}\,$ of $\,\mathcal{T}\,$ then inherits that same reflection symmetry. Since $\,b\in(-1,1)\,$ was arbitrary, this clearly means that (4.1) holds for $\,\mathbf{c}\,$, and our Linearity Criterion now straightens the central curve, as desired. Surface-of-revolution case: Here, each horizontal plane $\,z\equiv b\,$ cuts the original tube $\,\mathcal{T}\,$ in a _circle_ centered at $\,(\mathbf{c}(b),b)\,$ for each $\,b\in(-1,1)\,$. Write $\,F(b)>0\,$ for the squared radius of this circle, and $\,(\xi(b),\eta(b)):=\mathbf{c}(b)\,$ for the horizontal coordinates of its center. Then $\,\mathcal{T}\,$ clearly constitutes the solution set of (4.3) $\left(x-\xi(z)\right)^{2}+\left(y-\eta(z)\right)^{2}=F(z)\,.$ The $\,C^{2}\,$ differentiability of $\,\mathcal{T}\,$ ensures that $\,F\,$, $\,\xi\,$ and $\,\eta\,$ are all $\,C^{2}\,$ on $\,(-1,1)\,$. We want to show that cpo forces $\,\mathbf{c}\,$ to be affine. To do so, we study the even and odd components of $\,\xi,\,\eta,$ and $\,F\,$ with respect to reflection through a point, and for that we introduce the following notation. Suppose $\,\beta\in\mathbf{R}\,$, and let $\,f\,$ denote any function defined on a neighborhood of $\,\beta\,$. We define the $\,\beta$-translate of $\,f\,$ by $f_{\beta}(t):=f(\beta+t)\ .$ We also define the even and odd parts of $\,f_{\beta}\,$ respectively as $f_{\beta}^{+}(t)=\frac{f_{\beta}(t)+f_{\beta}(-t)}{2}\ ,\qquad f_{\beta}^{-}(t)=\frac{f_{\beta}(t)-f_{\beta}(-t)}{2}\,.$ As usual, we then have $f_{\beta}^{+}(-t)=f_{\beta}^{+}(t)\ ,\quad f_{\beta}^{-}(-t)=-f_{\beta}^{-}(t)$ and $f_{\beta}(t)=f_{\beta}^{+}(t)+f_{\beta}^{-}(t)\ ,\quad f_{\beta}(-t)=f_{\beta}^{+}(t)-f_{\beta}^{-}(t)\ .$ Now fix an arbitrary height $\,\beta\in(-1,1)\,$. Since $\,\mathcal{T}\,$ is horizontally circular, has cpo, and lies in standard position, we can find a small slope $\,m>0\,$, and a $z$-intercept $\,b=b(\beta)\,$ such that the plane $\,P\,$ given by $z=mx+b\quad\text{or}\quad x=\frac{z-b}{m}\,,$ cuts $\,\mathcal{T}\,$ is a central oval $\,\mathcal{O}\,$, depending on $\,m\,$ and $\,\beta\,$, and centered at height $\,\beta\,$. In the $\,(y,z)\,$ coordinate system on $\,P\,$, we get the following equation for $\,\mathcal{O}\,$ by restricting (4.3): (4.4) $\left(\frac{z-b}{m}-\xi(z)\right)^{2}+\left(y-\eta(z)\right)^{2}=F(z)\,.$ Solve this for $\,y\,$ in terms of the $\beta$-centered variable $\,t:=z-\beta\,$ to split $\,\mathcal{O}\,$ into a pair of arcs, graphs of functions we shall call $\,y_{\pm}(t)\,$, over the symmetric interval (4.5) $|t|<\sup\\{z-\beta\colon(x,y,z)\in\mathcal{O}\\}\,.$ Using the notation defined above, we can express these functions as (4.6) $y_{\pm}(t):=\eta_{\beta}(t)\pm\sqrt{F_{\beta}(t)-\left(\frac{\bar{\beta}+t}{m}-\xi_{\beta}(t)\right)^{2}}\,,$ where $\,\bar{\beta}:=\beta-b\,$. Since the chord joining $\,(y_{+}(0),\beta)\,$ to $\,(y_{-}(0),\beta)\,$ has height $\,\beta\,$, it clearly passes through the center of $\,\mathcal{O}\,$. It must therefore be a diameter. But the midpoint of any diameter locates the center of $\,\mathcal{O}\,$, so using (4.6) to average $\,y_{\pm}(0)\,$, we can now deduce that: _The center of $\,\mathcal{O}\,$ has coordinates $\,(\eta(\beta),\beta)\,$ in the $\,(y,z)\,$ coordinate system on $\,P\,$._ This fact lets us express the central symmetry of $\,\mathcal{O}\,$ as the coordinate swap $(\eta(\beta)+s,\,\beta+t)\ \longleftrightarrow\ (\eta(\beta)-s,\,\beta-t)\,.$ When $\,t\,$ is small enough as measured by (4.5), this swap always exchanges diametrically opposed solutions of (4.4). Write the resulting two statements in terms of the notation introduced above to get two simultaneous identities: $\displaystyle F^{+}_{\beta}(t)+F^{-}_{\beta}(t)$ $\displaystyle\quad=\ \left(\eta(\beta)+s-\eta^{+}_{\beta}(t)-\eta^{-}_{\beta}(t)\right)^{2}$ $\displaystyle\qquad\qquad+\left(\displaystyle{\frac{\bar{\beta}+t}{m}}-\xi_{\beta}^{+}(t)-\xi_{\beta}^{-}(t)\right)^{2}$ and $\displaystyle F^{+}_{\beta}(t)-F^{-}_{\beta}(t)$ $\displaystyle\quad=\ \left(\eta(\beta)-s-\eta^{+}_{\beta}(t)+\eta^{-}_{\beta}(t)\right)^{2}$ $\displaystyle\qquad\qquad+\left(\displaystyle{\frac{\bar{\beta}-t}{m}}-\xi_{\beta}^{+}(t)+\xi_{\beta}^{-}(t)\right)^{2}$ Subtract (4) from (4), factor differences between corresponding squares on the right, and divide by two, to obtain $\displaystyle F^{-}_{\beta}(t)$ $\displaystyle\quad=\ 2\left(\eta(\beta)-\eta_{\beta}^{+}(t)\right)\left(s-\eta_{\beta}^{-}(t)\right)$ $\displaystyle\qquad\qquad+\ 2\left(\frac{\bar{\beta}}{m}-\xi_{\beta}^{+}(t)\right)\left(\frac{t}{m}-\xi_{\beta}^{-}(t)\right)$ The strict convexity of $\,\mathcal{O}\,$ now guarantees that the line $\,z=\beta+t\,$ in $\,P\,$ cuts $\,\mathcal{O}\,$ in two distinct points whenever $\,t\,$ is sufficiently small. Call the $y$-coordinates of these points $\,\eta(\beta)+s\,$ and $\,\eta(\beta)+s^{\prime}\,$ respectively. Equation (4) clearly remains true if we replace $\,s\,$ by $\,s^{\prime}\,$. When we subtract the resulting $s^{\prime}$-version of (4) from the $s$-version and simplify, however, we find that for all sufficiently small $\,t\,$, we have $\left(s-s^{\prime}\right)\left(\eta_{\beta}^{+}(t)-\eta(\beta)\right)=0\,.$ Since $\,s\,$ and $\,s^{\prime}\,$ are distinct for the small $\,t\,$ in question, we evidently must have $\,\eta_{\beta}^{+}(t)\equiv\eta(\beta)\,$ for all sufficiently small $\,t\,$. By definition of $\,\eta_{\beta}^{+}\,$, this means $\eta(\beta+t)-\eta(\beta)=-\bigl{(}\eta(\beta-t)-\eta(\beta)\bigr{)}\,,$ so that (4.1) holds for $\,\eta\,$. But by swapping the roles of $\,x\,$ and $\,y\,$ in the argument above, we find that in precisely the same way, it holds for $\,\xi\,$, and hence for $\,\mathbf{c}=(\xi,\eta)\,$. Our Linearity Criterion then makes the $\,\mathbf{c}\,$ affine, as desired. ∎ ## 5\. Main theorem By combining the Axis Lemma just proven with our Cylinder/Quadric Proposition 3.11 and the rotationally invariant case (Proposition 1.3), one immediately deduces ###### Proposition 5.1 (Collar Theorem). A transversely convex tube with cpo is either cylindrical or quadric. We can strengthen this statement substantially, however, without much extra effort: ###### Theorem 5.2 (Main Theorem). A complete, connected $\,C^{2}$-immersed surface in $\,\mathbf{R}^{3}\,$ with cpo is either a cylinder, or quadric. ###### Proof. Suppose $\,F\,$ immerses a complete $\,C^{2}\,$ surface $\,M^{2}\,$ into $\,\mathbf{R}^{3}\,$ with cpo. The latter assumption ensures, first of all, that $\,F(M)\,$ crosses some affine plane—we take it to be the $\,z=0\,$ plane—transversally (if not exclusively) along a central oval $\,\mathcal{O}\,$. This being the case, define, for any two heights $\,a<0<b\,$, the open connected component $M_{a,b}\subset F^{-1}\left(\left\\{(x,y,z)\in\mathbf{R}^{3}\colon a<z<b\right\\}\right)$ as the unique component containing $\,F^{-1}(\mathcal{O})\,$. Since $\,\mathcal{O}\,$ is strictly convex and $\,F(M)\,$ is transverse to the plane $\,z=0\,$ along $\,\mathcal{O}\,$, standard arguments from basic differential topology show that for $\,a<0<b\,$ sufficiently near $0\,$, * (i) The pullback $\,F^{*}z\,$ of the height function $\,z\,$ on $\,\mathbf{R}^{3}\,$ has no critical points in $\,M_{a,b}\,$, and * (ii) $F\,$ embeds $\,M_{a,b}\,$ in $\,\mathbf{R}^{3}\,$ as a transversely convex tube. There consequently exist _minimal_ and _maximal_ heights $\,-\infty\leq A<0<B\leq\infty\,$ such that (i) and (ii) above both hold for every finite $\,a<b\,$ in the closed interval $\,[A,B]\,$. Our proof now forks in three directions, depending on whether both, neither, or exactly one of the endpoints $\,A\,$ and $\,B\,$ are finite. Case $\,-\infty<A<B<\infty\,$ (Ellipsoid). In this case, by (ii), the image of $\,M_{a,b}\,$ under $\,F\,$ is a transversely convex tube for every $\,a<b\,$ in the interval $\,(A,B)\,$. This trivially extends to $\,M_{A,B}\,$, and the resulting maximal tube clearly inherits cpo from $\,F(M)\,$. Our Collar Theorem 5.1 then says that $\,F(M_{A,B})\,$ is either the cylinder on a central oval, or quadric. We can rule out the first possibility, because on a cylinder, horizontal cross-sections are uniformly convex, and the gradient of $\,z\,$ is bounded away from zero. But these facts, by continuity, would extend slightly beyond $\,A\,$ and $\,B\,$, contradicting their maximality with respect to (i) and (ii) above. It follows that when $\,-\infty<A<B<\infty\,$, $\,F(M_{A,B})\,$ is quadric. By affine invariance, however, we lose no generality by assuming that $\,F\,$ immerses $\,M_{A,B}\,$ as a quadric surface of revolution around the $z$-axis: a vertical segment of an ellipsoid, cone, elliptic paraboloid, or a hyperboloid. On all these surfaces, horizontal cross-sections in any compact slab are uniformly convex. So the maximality of $\,A\,$ and $\,B\,$ must be dictated by condition (i) above, not (ii). The completeness of $\,M\,$, then ensures that $\,F^{*}z\,$ must have critical points on both boundaries of $\,M_{A,B}\,$. But among the quadrics listed above, $\,z\,$ has multiple critical points only on the ellipsoid, where it attains both a max and a min. The closure of $\,F(M_{A,B})\,$ must therefore be a complete ellipsoid, which, by continuity of $\,F\,$ and connectedness of $\,M\,$ must coincide with $F(M)\,$. Case $\,-A=B=\infty\,$ (Tube hyperboloid or cylinder). In this case we can immediately from the connectedness of $\,M\,$ that $\,M_{A,B}=M\,$. Moreover, since (ii) holds for every finite $\,a<0<b\,$, $\,F\,$ must embed $\,M_{-r,r}\,$ in $\,\mathbf{R}^{3}\,$ as a transversely convex tube $\,\mathcal{T}_{r}\,$ for every $\,r>0\,$. As above, $\,\mathcal{T}_{r}\,$ inherits cpo from $\,F(M)\,$, so by the Collar Theorem 5.1, $\,F\,$ maps $\,M_{-r,r}\,$ to a cylinder over some central oval, or to a non-degenerate quadric, for each $\,r>0\,$. Let $\,S\,$ denote the unique complete unbounded cylinder or quadric that extends $\,F(M_{-1,1})\,$. We then clearly have $\,F(M_{-r,r})=S\,$ in the slab $\,|z|<r\,$ for all $\,r>1\,$. But then $\,S=F(M)\,$ in its entirety, for otherwise, $\,F(M)\,$ deviates from $\,S\,$ at some finite height $\,\rho\,$, a contradition when $\,r>|\rho|\,$. The only smooth quadric that contains a horizontal oval and extends infinitely far both above and below the plane $\,z=0\,$ is the tube hyperboloid. So in this case, $\,M\,$ is either a tube hyperboloid or a cylinder. Cases $\,|A|<B=\infty\,$ or $\,|B|<|A|=\infty\,$ (Paraboloid or convex hyperboloid). Since the reflection $\,z\to-z\,$ is affine, these two cases are equivalent. So we assume $\,|A|<B=\infty\,$, and arguing as in the previous two cases, we now quickly deduce the existence of a quadric surface of revolution $\,S\,$ such that (modulo some fixed affine isomorphism) $\,F(M_{A,b})=S\,$ for all $\,b<\infty\,$. Further, here as in the doubly- finite case, the maximality of $\,A\,$ must be dictated by a critical point at height $\,A\,$. No cylinder has such a critical point, and among the quadrics, only the elliptic paraboloid and convex hyperboloid do. Clearly then, $\,S\,$ is one of these two surfaces, and $\,F(M)=S\,$. ∎ ## 6\. Application to skew loops We originally conceived our Main Theorem 5.2 above as a tool for proving the existence of skewloops on a class of negatively curved tubes. In this final section we implement that idea. ###### Definition 6.1. A skewloop is a circle differentiably immersed into $\,\mathbf{R}^{3}\,$ with no pair of parallel tangent lines. The existence of skewloops is not so obvious: Segre published the first construction in 1968 [Se]. A more recent construction and application appeared in M. Ghomi’s paper [Gh], and sparked our own interest. We coined the term _skewloop_ in [GS], a subsequent joint paper that characterized _positively_ curved quadrics in $\,\mathbf{R}^{3}\,$ as the _only_ surfaces having a point of positive curvature, but no skewloop: ###### Theorem 6.2 ([GS, 2002]). A connected $\,C^{2}\,$ surface immersed in $\,\mathbf{R}^{3}\,$ with at least one point of positive Gauss curvature admits no skewloop if and only if it is quadric. In particular, this identifies ellipsoids as the only _compact_ surfaces lacking skewloops in $\,\mathbf{R}^{3}$. Its proof made strong use of Blaschke’s result (Proposition 1.2) which, as explained in §1, applies to _convex_ surfaces only, and is fundamentally local. Our dependence on Blaschke’s theorem in [GS] thus compelled us to assume positive curvature, and at that time, we could only raise the question as to whether our skewloop-free characterization of quadrics might extend to non- positively curved surfaces [GS, Appendix B]. S. Tabachnikov, however, took a significant and interesting step toward an answer in [T], when he showed that—modulo genericity and $\,C^{2}\,$ assumptions that were later eliminated in [SS]— _negatively_ curved quadrics admit no skewloops. That still left the converse question open, however: Does lack of skewloops _characterize_ negatively curved quadrics? We can now affirm that within a large class of surfaces, it does. To do so, we merely combine results of the present paper with a lemma from [GS]: ###### Lemma 6.3 ([GS, Lemma 5.1]). Suppose a $\,C^{2}\,$ embedded surface in $\,\mathbf{R}^{3}\,$ contains no skewloop, and some affine plane cuts it transversely along an oval $\,\mathcal{O}\,$. Then $\,\mathcal{O}\,$ is central. Indeed, suppose $\,F:M\to\mathbf{R}^{3}\,$ immerses an open $\,C^{2}\,$ surface so that it cuts some affine plane transversally along an oval $\,\mathcal{O}\,$. Then $\,F\,$ clearly embeds some annular neighborhood of $\,F^{-1}(\mathcal{O})\subset M\,$ into $\,\mathbf{R}^{3}\,$ as a transversely convex tube. Such a tube either does, or does not, have cpo, and correspondingly, it either belongs to a central cylinder or quadric by Proposition 5.1, or else it contains a skewloop by Lemma 6.3. We have thus proven ###### Proposition 6.4. Suppose a $\,C^{2}$-immersed surface $\,M\subset\mathbf{R}^{3}\,$ cuts an affine plane transversally along an oval $\,\mathcal{O}$, but admits no skewloop. Then some neighborhood of $\,\mathcal{O}\,$ in $\,M\,$ belongs to a central cylinder or quadric. If we assume completeness, we get a more elegant global statement: ###### Theorem 6.5. Suppose a $C^{2}$-immersed surface $\,M\subset\mathbf{R}^{3}\,$ crosses some plane transversally along an oval. Then exactly one of the following holds: * (i) $S\,$ contains a skewloop. * (ii) $S\,$ is the cylinder over an oval. * (iii) $S\,$ is a non-cylindrical quadric. ###### Proof. Our hypotheses explicitly guarantee the existence of at least one oval $\,\mathcal{O}\,$ along which $\,M\,$ cuts an affine plane transversally. But they actually ensure that _all_ such ovals are central. For otherwise, Lemma 6.3 puts a skewloop on $\,M\,$. It follows that $\,M\,$ has cpo, and the desired conclusion then follows from our Main Theorem 5.2 ∎ ###### Corollary 6.6. Every complete embedded negatively curved surface that meets a plane transversely along an oval admits a skewloop, _unless_ it is affinely congruent to the tube hyperboloid $\,x^{2}+y^{2}-z^{2}=1\,$. ###### Proof. This follows immediately from Theorem 6.5, for among all cylinders and quadrics having a compact cross-section, only the tube hyperboloid has negative curvature. ∎ ## Acknowledgments Many thanks to the Technion—Israel Institute of Technology—for their hospitality during a sabbatical in which much of this work got done, and to the Lady Davis Foundation and Indiana University for the financial support that made our visit there possible. ## References * [1] * [Bl] W. Blaschke, _Über affine Geometrie XXII: Bestimmung der Flächen mit zentrischen ebenen Schnitten_ , Gesammelte Werke. Band 4: Affine Differentialgeometrie: Differentialgeometrie der Kreis-und Kugelgruppen. Thales-Verlag, Essen, 1985. * [Gh] M. Ghomi, _Shadows and convexity of surfaces_ , Ann. of Math. 155 281–293 (2002) * [GS] M. Ghomi & B. Solomon, Skew loops and quadric surfaces, Comment. Math. Helv. 77 (4), 767–782 (2002) * [Se] B. Segre, _Sulle coppie di tangenti fra ioro parallele relative ad una curve chuisa sghemba_ , Hommage au Professeur Lucien Godeaux, 141–167, Libraire Universitaire, Louvain (1968) * [S] B. Solomon, _Symmetric cross-sections make surfaces of revolution quadric_ , Amer. Math. Monthly 116 (4), 351–355 (2009) * [SS] J.-P. Sha & B. Solomon, _No skew branes on non-degenerate hyperquadrics_ , Math. Zeit. 257:225–229 (2007) * [T] S. Tabachnikov, _On skew loops, skew branes, and quadratic hypersurfaces_ , Moscow Math. J. 3, 681–690 (2003)
arxiv-papers
2009-04-22T16:25:10
2024-09-04T02:49:02.076023
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Bruce Solomon", "submitter": "Bruce Solomon", "url": "https://arxiv.org/abs/0904.3493" }
0904.3562
# Radial velocity study of the CP star $\epsilon$ Ursae Majoris N. A. Sokolov1,2 1Central Astronomical Observatory at Pulkovo, St. Petersburg 196140, Russia 2Isaac Newton Institute of Chile, Branch at St. Petersburg E-mail: sokolov@gao.spb.ruBased on observations collected with the ELODIE spectrograph on the 193-cm telescope at the Observatoire de Haute-Provence (CNRS), France (Accepted 2007 November 16. Received 2007 November 16; in original form 2007 July 27) ###### Abstract In this Letter, the radial velocity variability of the chemically peculiar star $\epsilon$ Ursae Majoris ($\epsilon$ UMa) from the sharp cores of the hydrogen lines is investigated. This study is based on the ELODIE archival data obtained at different phases of the rotational cycle. The star exhibits low-amplitude radial velocity variations with a period of $P$ = 5.0887 d. The best Keplerian solution yields an eccentricity $e$ = 0.503 and a minimum mass $\sim$14.7$M_{\rm Jup}$ on the hypothesis that the rotational axis of $\epsilon$ UMa is perpendicular to the orbital plane. This result indicate that the companion is the brown-dwarf with the projected semi-amplitude variation of the radial velocity $K_{\rm 2}$ = 135.9 km ${\rm s}^{\rm-1}$ and the sine of inclination times semi-major axis $a_{2}$$\sin$(i) = 0.055 au. ###### keywords: binaries: spectroscopic – stars: chemically peculiar – stars: individual: $\epsilon$ Ursae Majoris. ††pagerange: Radial velocity study of the CP star $\epsilon$ Ursae Majoris–References††pubyear: 2008 ## 1 Introduction Epsilon Ursae Majoris ($\epsilon$ UMa, HD 112185, HR 4905) is the brightest ($V$ = 1.77 mag) chemically peculiar (CP) star and has been extensively studied during the last century. Guthnick (1934) established a period of 5.d0887 d from variations in the intensity of the Ca II K line and also noticed a periodic splitting of some lines. Struve & Hiltner (1943) subsequently reported doubling of lines of Cr II, Fe II, V II and other elements at certain phases. Since the overall widths of the double lines are the same and not all lines double, they ruled out the orbital motion and instead suggested that the phenomenon is related to rotation of the star. Provin (1953) measured a double wave light variation with the same 5.d0887 period. The star is brightest when the Ca II K line intensity is near its minimum and other elements are near their maximum strength. Perhaps the most interesting and controversial aspect of $\epsilon$ UMa is its the radial velocity variations. Abt & Snowden (1973) carried out the radial velocity analysis of the 62 brightest northern CP stars for spectroscopic binaries. They were used special observing and measuring techniques of the hydrogen lines and did not find the radial velocity variations for $\epsilon$ UMa. Not surprisingly, they could not to measure the radial velocity variations because the mean internal error per spectrum of 1.2 km ${\rm s}^{-1}$ is near the limit at which the photographic technique is useful. On the other hand, Morgan et al. (1978) detected the duplicity for the system $\epsilon$ UMa with a separation of 0.053 arcsec, using speckle interferometry technique. Although, the authors noted that the observed separation corresponds to the diffraction limit of the 2.5-m Isaac Newton telescope. Woszczyk & Jasiński (1980) measured the radial velocity variations of many lines in the star and found sinusoidal variations in the radial velocities of Fe, Cr and Ti lines with amplitudes of about 20 km ${\rm s}^{-1}$ and attributed this to the existence of a spots of enhanced abundance of these elements. Several surface abundance Doppler images of $\epsilon$ UMa have been produced (Wehlau et al., 1982; Rice & Wehlau, 1990; Hatzes, 1991; Rice et al., 1997; Holmgren & Rice, 2000). Most of the published Doppler images relate to Fe, O, Ca, or Cr abundance. Recently, Lueftinger et al. (2003) determined for $\epsilon$ UMa for the first time the abundance distributions of Mn, Ti, Sr, and Mg. Attempt to determine orbital motion using these spectral lines would be impossible. However, the hydrogen lines do not show significant rotational effect in their radial velocity. They would be preferable for the measurement of binary motion if the radial velocity of the hydrogen lines could be measured with precision. In this Letter, we present the radial velocity measurement of the hydrogen lines in the spectrum of CP star $\epsilon$ UMa. The ELODIE observations of this star and data reduction are described in Sect. 2. The orbital solution derived for the satellite candidate are presented in Sect. 3. Section 4 reports discussion of our results for $\epsilon$ UMa and conclusions are presented in Sect. 5. ## 2 Observational material and data reduction Table 1: Measured radial velocities of $\epsilon$ UMa. All data are relative to the Solar system barycentre. File name | Exposure time | MJD | Phase | Radial velocity (km ${\rm s}^{-1}$) | | ---|---|---|---|---|---|--- | (s) | (2,450,000+) | | $H_{\delta}$ | $H_{\gamma}$ | $H_{\beta}$ | $H_{\alpha}$ | RVMean | $\sigma_{Mean}$ 19960204 0022 | 168.73 | 0117.9814 | 0.821 | -9.56 | -9.19 | -9.93 | -9.47 | -9.54 | 0.31 19970218 0032 | 200.81 | 0497.9778 | 0.496 | -9.06 | -8.72 | -9.67 | -9.27 | -9.18 | 0.40 19970218 0033 | 200.37 | 0497.9819 | 0.497 | -8.90 | -8.77 | -9.51 | -9.19 | -9.09 | 0.33 20000124 0030 | 60.58 | 1568.1285 | 0.795 | -9.60 | -9.07 | -9.73 | -9.48 | -9.47 | 0.29 20000124 0031 | 90.57 | 1568.1440 | 0.798 | -9.50 | -9.16 | -9.71 | -9.63 | -9.50 | 0.24 20000126 0040 | 101.56 | 1570.1447 | 0.191 | -8.11 | -8.24 | -8.99 | -8.94 | -8.57 | 0.46 20000126 0041 | 50.58 | 1570.1499 | 0.192 | -8.29 | -8.28 | -9.07 | -8.99 | -8.66 | 0.43 20000519 0012 | 120.79 | 1683.9584 | 0.557 | -9.04 | -8.82 | -9.17 | -8.99 | -9.01 | 0.14 20000520 0009 | 120.76 | 1684.8706 | 0.737 | -9.56 | -9.02 | -9.32 | -9.13 | -9.26 | 0.24 20000521 0006 | 600.78 | 1685.8694 | 0.933 | -10.14 | -9.49 | -9.71 | -9.36 | -9.68 | 0.34 20000521 0007 | 600.44 | 1685.8784 | 0.935 | -9.85 | -9.44 | -9.63 | -9.44 | -9.59 | 0.20 20000606 0017 | 30.54 | 1701.8490 | 0.073 | -8.05 | -7.89 | -9.04 | -8.55 | -8.38 | 0.52 20000607 0007 | 30.27 | 1702.8632 | 0.272 | -8.44 | -8.33 | -8.73 | -8.44 | -8.48 | 0.17 20000608 0006 | 30.53 | 1703.8467 | 0.466 | -9.09 | -8.80 | -9.24 | -8.87 | -9.00 | 0.20 20000609 0003 | 30.97 | 1704.8443 | 0.662 | -9.34 | -8.64 | -9.35 | -8.68 | -9.00 | 0.40 20000615 1417 | 300.17 | 1710.8469 | 0.841 | -9.51 | -8.94 | -9.76 | -9.08 | -9.32 | 0.38 20000615 1420 | 50.47 | 1710.8505 | 0.842 | -9.46 | -8.74 | -9.79 | -9.30 | -9.32 | 0.44 20000615 1423 | 30.76 | 1710.8608 | 0.844 | -9.61 | -8.63 | -9.77 | -9.05 | -9.27 | 0.52 20000615 1425 | 30.26 | 1710.8634 | 0.844 | -9.68 | -8.84 | -9.67 | -9.17 | -9.34 | 0.41 20000615 1426 | 30.26 | 1710.8661 | 0.845 | -9.67 | -8.99 | -10.04 | -9.13 | -9.46 | 0.49 20000616 1418 | 50.92 | 1711.8591 | 0.040 | -8.35 | -7.88 | -9.11 | -8.85 | -8.55 | 0.55 20000616 1421 | 20.71 | 1711.8630 | 0.041 | -8.17 | -7.81 | -9.17 | -8.94 | -8.52 | 0.64 20000616 1424 | 20.65 | 1711.8670 | 0.042 | -8.13 | -8.00 | -9.33 | -8.94 | -8.60 | 0.64 20000618 0006 | 30.59 | 1713.8460 | 0.431 | -8.52 | -8.45 | -9.04 | -8.80 | -8.70 | 0.27 20000618 0007 | 30.71 | 1713.8506 | 0.432 | -8.52 | -8.40 | -8.76 | -8.74 | -8.61 | 0.17 20000618 0008 | 30.97 | 1713.8542 | 0.432 | -8.43 | -8.42 | -8.84 | -8.80 | -8.62 | 0.23 20000619 0024 | 30.49 | 1714.8368 | 0.625 | -8.85 | -8.47 | -9.47 | -8.77 | -8.89 | 0.42 20000619 0025 | 30.54 | 1714.8715 | 0.632 | -9.37 | -8.68 | -9.22 | -8.76 | -9.01 | 0.34 20000619 0026 | 30.04 | 1714.8742 | 0.633 | -9.23 | -8.96 | -9.17 | -8.83 | -9.05 | 0.19 Table 2: Best Keplerian orbital solution derived for $\epsilon$ UMa Parameter | | Value | Error ---|---|---|--- P (fixed) | (d) | 5.0887 | T (periastron) | (JD-2450000) | 1743.932 | 0.161 e | | 0.503 | 0.063 ${V}_{\rm 0}$ | (km ${\rm s}^{-1}$) | -8.920 | 0.030 $\omega$ | ($\degr$) | 260.53 | 12.91 a $\sin$(i) | (${\rm 10}^{-3}$ au) | 0.256 | 0.022 K | (km ${\rm s}^{-1}$) | 0.634 | 0.067 f(m) | (${\rm 10}^{-7}$ ${\rm M}_{\odot}$) | 0.868 | 0.227 The spectra of $\epsilon$ UMa were retrieved from the ELODIE archive (Moultaka et al., 2004). This archive contains the complete collection of high- resolution echelle spectra using the ELODIE fiber-fed echelle spectrograph (Baranne et al., 1996) mounted on the 1.93-m telescope at the Haute-Provence Observatory (France). The spectra have a resolution ($\lambda$/$\triangle$$\lambda$) of about 42000. The archived signal-to-noise ratio was between $\sim$200 and $\sim$400 in the spectral region near $\lambda$ 5550 Å. In addition, eight spectra obtained 15 and 16 June 2000 at the same telescope were retrieved from the Hypercat Fits Archive (http://leda.univ-lyon1.fr/11/spectrophotometry.html). In Table 1, each spectrum is presented by its file name, exposure time, Julian date of the observations and its corresponding phase. Note that the phases were computed with the ephemeris from Table 2 (see below). Special technique of radial velocity measurement of the hydrogen lines was used and should be explained. Well known, that in slowly rotating late B-type stars the hydrogen lines have broad wings and sharp cores. For $\epsilon$ UMa the value of $v$ sin $i$ is equal 35 km ${\rm s}^{-1}$ (Lueftinger et al., 2003). Unfortunately, the wings of the hydrogen lines can be affected by different spectral lines. For example, in spectrum of $\epsilon$ UMa the wing of $H_{\beta}$ line affected by many Cr lines (Žižnovský & Zverko, 1995). On the other hand, the sharp cores of the hydrogen lines are not affected by spectral lines and the flux is formed in the upper layers of the atmosphere. Thus our technique was to use only the sharp cores of the hydrogen lines in spectra of $\epsilon$ UMa. The spectra were processed using the spectral reduction software SPE developed by S. Sergeev at Crimean Astrophysical Observatory (CrAO). The program allows detecting the variations of the centre gravity of the sharp cores of the hydrogen lines. After processing, all the spectra were corrected for the motion of the Earth around the Sun. For example, the demonstration of the positional variability of the core $H_{\alpha}$ line is presented in Fig. 1. In Table 1, each spectrum is presented by its radial velocities computed from the hydrogen lines, the mean radial velocity and errors of the mean radial velocity. Figure 1: The observed intensity profiles of the cores of $H_{\alpha}$ line obtained on May 21, 2000 (phase = 0.93) and on June 6, 2000 (phase = 0.07) marked by the solid and dashed lines, respectively. The velocity scale is given with respect to the $\lambda$ = 6562.797 Å. ## 3 Orbital parameters Orbital elements have been determined by a non-linear least-squares fitting of the mean radial velocities from Table 1 using the program BINARY writing D.H. Gudehus from Georgia State University (http://www.chara.gsu.edu/$\sim$gudehus/binary.html). The solution for a single-lined binary is modelled by up to six parameters: 1. 1. P period 2. 2. T time of periastron passage 3. 3. e eccentricity 4. 4. ${V}_{\rm 0}$ system radial velocity 5. 5. $\omega$ longitude of periastron 6. 6. a $\sin$(i) sine of inclination times semi-major axis The expected radial velocities are $RV=K[\cos{(\theta+\omega)}+e\cos{\omega}]$ (1) where $\theta$ is the angular position of the star measured from the centre of mass at a given instant. The program also calculate the projected semi- amplitude variation of the radial velocity: $K=\frac{2\pi a\sin{i}}{P\sqrt{1-e^{2}}},$ (2) though this is never used as a parameter in the solution and the mass function: $f(m)=\frac{M^{3}_{2}{\sin}^{3}i}{(M_{1}+M_{2})^{2}}.$ (3) The program BINARY gives the estimated standard deviations of the orbital parameters as well. The orbital solution of Table 2 was obtained by fitting a Keplerian orbit to the 29 ELODIE radial velocity measurements. Note that most of observations were obtained between JD=2451568 (January 2000) and JD=2451714 (June 2000) (see Table 1). Experience shows that the best Keplerian fit to the data with the fixed period P = 5.0887 d, the eccentricity e = 0.503 and the semi-amplitude K = 0.634 km ${\rm s}^{-1}$. The parameters of the best Keplerian orbital solution for $\epsilon$ UMa are presented in Table 2. In close binary system with Bp-Ap stars, there is evidence for a tendency toward synchronization between the rotational and orbital motions. This effect is thought to be produced by the tidal forces (Gerbaldi et al., 1985). The radial velocity curve is displayed in Fig. 2 with the residuals around solution. A linear trend is not observed in the residuals around the orbital solution that can be explained by the absent of a second companion in a longer-period orbit. Although, the weighted r.m.s. around the best Keplerian solution ($\sigma$(O-C)) is equal to 0.131 km ${\rm s}^{-1}$. This value is a bit large compared to the typical radial velocity measurements from the ELODIE cross-correlation function (Naef et al., 2003). Figure 2: $Top:$ Phase diagram of the radial velocity measurements and Keplerian orbital solution for $\epsilon$ UMa. $Bottom:$ Residuals around the solution. ## 4 Discussion The presence of the spots on the stellar surface of $\epsilon$ UMa can change the observed spectral line profiles and induces a periodic radial velocity signal similar to the one expected from the presence of a satellite. The hydrogen lines analysis is one of the best tools to discriminate between radial velocity variations due to changes in the spectral line shapes and variations due to the real orbital motion of the star. It is obviously of interest to compare the phase diagram of the radial velocity of $\epsilon$ UMa derived above with the phase diagram of the radial velocity computed from metallic lines. In this way, we selected the spectral region of the very prominent unblended Cr II line at $\lambda$ 4558 Å. Figure 3: Positional variations of strong photosphere lines in the spectral region of the Cr II line at $\lambda$ 4558 Å obtained on June 15, 2000 (phase = 0.84) and on January 26, 2000 (phase = 0.19) marked by the solid and dashed lines, respectively. The velocity scale is given with respect to the $\lambda$ = 4558.65 Å. Figure 3 shows the strong photosphere lines in the spectral region of the Cr II line at $\lambda$ 4558 Å obtained at phases before and after the epoch of periastron passage. The radial velocity shift of the Cr II $\lambda\lambda$ 4554, 4558 and 4565 ÅÅ lines and the Fe II $\lambda$ 4555 Å line at different phases is clearly seen. The Ti II line at $\lambda$ 4563 Å shows the line doubling that appears at phase 0.84 and disappears at phase 0.19. The maximum splitting of this line is at phase 0.04. The splitting of the lines was first observed by Struve & Hiltner (1943) in the spectrum of $\epsilon$ UMa. However, the authors concluded that the doubling is not caused by orbital motion but may be due to a combination of the physical effects with Doppler effect in a rotating star. Wade (1997) estimated the masses for 10 magnetic CP stars using the position of stars in the log$R_{\sun}$ – log$T_{\rm eff}$ plane. Position of $\epsilon$ UMa in the log$R_{\sun}$ – log$T_{\rm eff}$ plane seems to be among the most evolved CP stars and gives the value of $M_{\epsilon{\rm UMa}}$ = 3.0$\pm$0.4$M_{\sun}$. According to Lueftinger et al. (2003) the radius of $\epsilon$ UMa is equal to 4.2$\pm$0.2$R_{\sun}$ corresponding to their choice of $v\sin i$ = 35 km ${\rm s}^{\rm-1}$ and $i$ = ${\rm 45}^{\circ}$ using the trigonometric parallax measured by Hipparcos, $\pi$ = 40.30 mas (ESO, 1997) and an angular diameter of 1.561 mas. The effective temperature of $\epsilon$ UMa was taken from the paper by Sokolov (1998) and is equal to 9340$\pm$530 K. On the hypothesis that the rotational axis of $\epsilon$ UMa is perpendicular to the orbital plane we can estimate the mass of the secondary star. For the value of $M_{\rm 1}$ = 3.0$M_{\sun}$ and $i$ = ${\rm 45}^{\circ}$ Eq.(3) gives $M_{\rm 2}$ = 0.014$M_{\sun}$. This result gives a value $\sim$14.7$M_{\rm Jup}$, strongly suggesting that the companion is in the typical brown-dwarf regime. If we know the value $M_{\rm 1}$/$M_{\rm 2}$ then it is possible to estimate the projected semi-amplitude variation of the radial velocity for the companion according to formula: $K_{2}=K_{1}\frac{M_{1}}{M_{2}},$ (4) where $K_{1}$ is the projected semi-amplitude variation of the radial velocity for $\epsilon$ UMa taken from Table 2. For the value of $K_{\rm 1}$ = 0.634 km ${\rm s}^{\rm-1}$ Eq.(4) gives $K_{\rm 2}$ = 135.9 km ${\rm s}^{\rm-1}$. Thus, we can estimate the sine of inclination times semi-major axis using Eq.(2). Computation gives the value of $a_{2}$$\sin$(i) = 0.055 au. These estimates show that the proposed brown-dwarf is quite close to the surface of $\epsilon$ UMa at periastron. But, such close orbits are not new. For example, the subgiant star HD 118203 have the planet with eccentric orbit ($e$ = 0.31), the period of $P$ = 6.1335 d, and is close to its parent star ($a$ = 0.06 au) (Da Silva et al., 2005). Another way to interpret the radial velocity variations is the radial pulsation of $\epsilon$ UMa. Retter et al. (2004) are analysed observations of $\epsilon$ UMa obtained with the star tracker on the Wide Field Infrared Explorer satellite. The authors observed that a light curve has about 2 per cent amplitude of photometric variability. On the other hand, Molnar (1975) has presented ultraviolet light curves for $\epsilon$ UMa from the OAO-2 satellite which indicate that the photometric variations of this star are due to variable ultraviolet absorption effects which redistribute flux into the visible region (see his Fig. 5). Note that no colour index changes (Provin, 1953). Certainly the radial pulsation appears unlikely given that the rotational period is synchronized with the orbital period of $\epsilon$ UMa. ## 5 Conclusions The archival ELODIE high-resolution echelle spectra of $\epsilon$ UMa permit us to analyse the radial velocity variations of the sharp cores of the hydrogen lines. This allowed determining the orbital elements of binary system for the CP star $\epsilon$ UMa. The best Keplerian fit to the data shown that the rotational period is synchronized with the orbital period. We are estimated the mass of the secondary star which is equal $\sim$14.7$M_{\rm Jup}$. This result indicate that the companion is the brown-dwarf with the projected semi-amplitude variation of the radial velocity $K_{\rm 2}$ = 135.9 km ${\rm s}^{\rm-1}$ and the sine of inclination times semi-major axis $a_{2}$$\sin$(i) = 0.055 au. ## Acknowledgements The author would like to thank the referee Dr. J.B. Rice of this Letter for his extremely helpful comments. ## References * Abt & Snowden (1973) Abt H.A., Snowden M.S., 1973, ApJSS, 25, 137 * Baranne et al. (1996) Baranne A., Queloz D., Mayor M., Adrianzyk G., Knispel G., Kohler D., Lacroix D., Meunier J.-P., et al, 1996, A&AS, 119, 373 * Da Silva et al. (2005) Da Silva R., Udry S., Bouchy F., Mayor M., Moutou C., Pont F., Queloz D., Santos N.C., et al, 2005, (astro-ph/0510048) * Gerbaldi et al. (1985) Gerbaldi M., Floquet M., Hauck B., 1985, A&A, 146, 341 * Guthnick (1934) Guthnick P., 1934, Sitz. Preuss. Akad. Wiss. Berlin, 30, 506 * Hatzes (1991) Hatzes A.P., 1991, MNRAS, 253, 89 * Holmgren & Rice (2000) Holmgren D.E., Rice J.B., 2000, A&A, 364, 660 * Lueftinger et al. (2003) Lueftinger T., Kuschnig R., Piskunov N.E., Weiss W.W., 2003, A&A, 406, 1033 * Molnar (1975) Molnar M.R., 1975, AJ, 80, 137 * Morgan et al. (1978) Morgan B.L., Beddoes D.R., Scaddan R.J., Dainty J.C., 1978, MNRAS, 183, 701 * Moultaka et al. (2004) Moultaka J., Ilovaisky S.A., Prugniel P., Soubiran C., 2004, PASP, 116, 693 * Naef et al. (2003) Naef D., Mayor M., Beuzit J.L., Perrier C., Queloz D., Sivan J.P., Udry S., 2003, (astro-ph/0310261) * Provin (1953) Provin S.S., 1953, ApJ, 118, 489 * Retter et al. (2004) Retter A., Bedding T,R., Buzasi D.L., Kjeldsen H., Kiss L.L., 2004, ApJ, 601, L95 * Rice & Wehlau (1990) Rice J.B., Wehlau W.H., 1990, A&A, 233, 503 * Rice et al. (1997) Rice J.B., Wehlau W.H., Holmgren D.E., 1997, A&A, 326, 988 * Sokolov (1998) Sokolov N.A., 1998, A&AS, 130, 215 * Struve & Hiltner (1943) Struve O., Hiltner W.A, 1943, ApJ, 98, 225 * Stibbs (1950) Stibbs D.W.N., 1950, MNRAS, 110,395 * Wade (1997) Wade G.A., 1997, A&A, 325,1063 * Wehlau et al. (1982) Wehlau W., Rice J., Piskunov N., Khokhlova V., 1982, Pis’ma Astron. Zh., 8, 30 * Woszczyk & Jasiński (1980) Woszczyk A., Jasiński M., 1980, Acta Astron., 30, 331 * Žižnovský & Zverko (1995) Žižňovský J., Zverko J., 1995, Contrib. Astron. Obs. Skalnaté Pleso, 25, 39
arxiv-papers
2009-04-23T15:09:16
2024-09-04T02:49:02.090184
{ "license": "Public Domain", "authors": "N.A. Sokolov", "submitter": "Sokolov Nikolay", "url": "https://arxiv.org/abs/0904.3562" }
0904.3577
# Solving the Wheeler-DeWitt of Small Universe Shintaro Sawayama sawayama0410@gmail.com Sawayama Cram School of Physics Atsuhara 328, Fuji-city, Shizuoka prefecture 419-0201, Japan ###### Abstract We can solve the Wheeler-DeWitt equation of the small universe enough to metric becomes diagonal and take a Gaussian normal coordinate. Our previous works are concerning to this paper. In this paper, we only write how to solve the Wheeler-DeWitt equation of such universe. Our motivation is simple, that is to solve the Wheeler-DeWitt equation. Even if the Wheeler-DeWitt equation is solved, quantum gravity does not complete yet. However, this work may be one of the first step to quantum gravity. ###### pacs: 04.60.-m, 04.60.Ds ## I Introduction In the quantum gravity, there are many approaches, for example loop quantum gravityAs Rov Thi or mini-superspaceHart approachs or string approachesAL . However, quantum gravity has not completed yet. In the canonical quantum gravity, the difficulties comes from the Wheeler-DeWitt equation. At first we should solve the Wheeler-DeWittDe equation the quantum gravity does not start. In our previous work is concerning the Wheeler-DeWitt equation. Our motivation is simple to solve the Wheeler-DeWitt equation. However, Wheeler-DeWitt is difficult to solve. Because it is second order elliptic functional partial differential equation with non-linear term. The elliptic differential equation is difficult, but if we choose diagonal metric, this problem is solved. The partial differential equation is difficult, but if we use additional constraint equation, this problem is solved. The functional differential equation is difficult, but we construct how to solve the functional differential equation. The non-linear term is difficult, but we construct the method to remove this difficulty. We quantize diagonal metric universe by using Wheeler-DeWitt without approximation. We use the fact metric become diagonal by coordinate transformation and Gaussian normal coordinate. Such universe is small universe. Or we treat the Wheeler-DeWitt equation locally. Because gravity is quantize in very small universe. To treat such small universe is theoretical. In section II, we simplify the Wheeler-DeWitt equation. In section III we quantize toy model. And in this section we show the step to solve the Wheeler- DeWitt. In section IV we quantize full quantum gravity, using the obtained result in section III. In section V we summarize and conclude obtained result. ## II Simplification of the Wheeler-DeWitt For simplicity we treat the only diagonal metric universes as, $\displaystyle\begin{pmatrix}g_{00}&0&0&0\\\ 0&g_{11}&0&0\\\ 0&0&g_{22}&0\\\ 0&0&0&g_{33}.\end{pmatrix}$ (1) And in all the spacetime metrics become diagonal locally. Or we treat small universe enough to metric become diagonal. We start from decomposition of the Einstein Hilbert action of the above diagonal metric universe. The action of the above universe is written by $\displaystyle S=\int RdM=\int R[g_{\mu\mu}]dSdt.$ (2) Here $S$ is the hyper-surface with constant time. Because, our method is different from the usual Wheeler-DeWitt equation formalism, our obtained Hamiltonian constraint is a different type of the Wheeler-DeWitt equation. If we decompose this action as 3+1, then we can obtain $\displaystyle{\cal L}=\dot{q}_{ii}P^{ii}+NH-2\sqrt{q}D^{i}N_{,i}.$ (3) Here $N$ is the lapse functional and $N_{,i}$ is the sift vectors, and $H$ is the Hamiltonian constraint such that $\displaystyle H=\frac{1}{2}q_{ii}q_{jj}P^{ii}P^{jj}+{\cal R}.$ (4) Here ${\cal R}$ is the three dimensional Ricci scalar and $P^{ii}$ is the momentum whose commutation relation with $q_{ii}$ is not $i$, it is $i\sqrt{q}$. In this formulation there are not appear $q_{ij}$ and $P^{ij}$ and sift vectors and momentum constraint. So we can ignore the constraint as $[P^{ij},H]$ or $[[P^{ij},H],H]$, because we start with metric diagonal setting. In this simple case we can ignore the diffeomorphism constraints. If we write the Hamiltonian constraint in the operator representation, we obtain $\displaystyle H=\sum_{ij}\frac{1}{2}\frac{\delta^{2}}{\delta\phi_{i}\delta\phi_{j}}+{\cal R}[q_{11},q_{22},q_{33}]=0$ $\displaystyle=\sum_{ij}\frac{1}{2}\frac{\delta^{2}}{\delta\phi_{i}\delta\phi_{j}}+\sum_{i\not=j}(\hat{\phi}_{i,jj}+\hat{\phi}_{j,i}\hat{\phi}_{i,i})e^{\hat{\phi}_{i}}=0.$ (5) Here $\phi_{i}=\ln q_{ii}$. If we consider the $\phi$ were only depend $t,x_{i}$, the Hamiltonian constraint becomes, $\displaystyle H=\sum_{ij}\frac{1}{2}\frac{\delta^{2}}{\delta\phi_{i}\delta\phi_{j}}-\Lambda=0.$ (6) We use this Hamiltonian constraint in section III Because we only treat metric diagonal universe, the Hamiltonian constraint has different form from the orthodox Hamiltonian constraint. This setting is similar to mini-superspace model. If universe is small enough to apply Gaussian normal coordinate, the Hamiltonian constraint become $\displaystyle H=\sum_{ij}\frac{1}{2}\frac{\delta^{2}}{\delta\phi_{i}\delta\phi_{j}}+\sum_{i\not=j}\hat{\phi}_{i,jj}e^{\phi_{i}}=0$ (7) We treat this Hamiltonian constraint in section IV The static restriction deviated from up-to-down methodSa1 is $\displaystyle\sum_{i\not=j}\frac{\delta}{\delta\phi_{i}\delta\phi_{j}}.$ (8) ## III Simple example of Wheeler-DeWitt Before solving Eq.(7), we solve Eq.(6) for simplicity. We consider the following spacetime $\displaystyle\begin{pmatrix}-N^{2}&0&0&0\\\ 0&g_{1}(t,x)&0&0\\\ 0&0&g_{2}(t,y)&0\\\ 0&0&0&g_{3}(t,z)\end{pmatrix}.$ (9) To quantize this spacetime we take steps. The step 1 is using the static restriction we obtain special solution. The step 2 is to remove the static restriction we obtain general solution. The we carry out step 1. The Eq.(6) and Eq.(8) is consistent and simultaneously quantized. And the solution is $\displaystyle f[\phi_{1},\phi_{2},\phi_{3}]=\prod_{i}\exp(a_{i}\Lambda^{1/2}\int\delta\phi_{i})$ (10) where $\displaystyle a_{1}a_{2}+a_{1}a_{3}+a_{2}a_{3}=1$ (11) $\displaystyle a_{1}^{2}+a_{2}^{2}+a_{3}^{2}=1$ (12) Then we carry out step 2. Using the above solution as a special solution, we assume the state is a form $\displaystyle|\Psi\rangle=f[\phi_{i}]g[\phi_{i}].$ (13) And we remove the static restriction, then $g[\phi_{i}]$ should satisfy $\displaystyle\nabla(\nabla+a)g[\phi_{i}]=0$ (14) Here, $\nabla$ is defined by $\displaystyle\nabla=\sum_{i}\frac{\delta}{\delta\phi_{i}}.$ (15) And $a$ is defined by $a=\Lambda^{1/2}\sum_{i}a_{i}$ This equation can be solved easily and solution is $\displaystyle e^{-a\int\delta\phi_{1}}(-2\int\delta\phi_{1}+\int\delta\phi_{2}+\int\delta\phi_{3})+e^{-a\int\delta\phi_{2}}(-2\int\delta\phi_{2}+\int\delta\phi_{1}+\int\delta\phi_{3})$ $\displaystyle+e^{-a\int\delta\phi_{3}}(-2\int\delta\phi_{3}+\int\delta\phi_{2}+\int\delta\phi_{1})$ (16) So the quantum state of (9) is $\displaystyle|\Psi(\phi_{i})\rangle=\prod_{i}\exp(a_{i}\Lambda^{1/2}\int\delta\phi_{i})\bigg{[}e^{-a\int\delta\phi_{1}}(-2\int\delta\phi_{1}+\int\delta\phi_{2}+\int\delta\phi_{3})$ $\displaystyle+e^{-a\int\delta\phi_{2}}(-2\int\delta\phi_{2}+\int\delta\phi_{1}+\int\delta\phi_{3})+e^{-a\int\delta\phi_{3}}(-2\int\delta\phi_{3}+\int\delta\phi_{1}+\int\delta\phi_{2})\bigg{]}$ (17) ## IV Solving the Wheeler-DeWitt of small universe By the same method we can quantize following universe $\displaystyle\begin{pmatrix}-N^{2}&0&0&0\\\ 0&g_{1}(t,x,y,z)&0&0\\\ 0&0&g_{2}(t,x,y,z)&0\\\ 0&0&0&g_{3}(t,x,y,z)\end{pmatrix}$ (18) Here $x,y,z$ are Gaussian normal coordinates. The step 1 is to use a static restriction to the Eq.(7), then we obtain $\displaystyle\sum_{i}\frac{\delta^{2}}{\delta\phi_{i}^{2}}+2\phi_{i,jj}e^{\phi_{i}}=0.$ (19) Then we use parameter separation, i.e. the solution of the above equation is assumed to be written as $\displaystyle f[\phi_{i}]=f_{1}[\phi_{1}]f_{2}[\phi_{2}]f_{3}[\phi_{3}]$ (20) Then Eq. (19) becomes $\displaystyle\frac{\delta^{2}}{\delta\phi_{i}^{2}}+2\phi_{i,jj}e^{\phi_{i}}=0$ (21) Or, $\displaystyle\frac{\delta^{2}}{\delta a_{i}^{2}}+8\partial_{j}\partial^{j}\ln a_{i}=0.$ (22) Here $a_{i}=g_{i}^{1/2}$. Then we use a following equation $\displaystyle-i(\ln a_{i,jj})^{1/2}\frac{\delta}{\delta a_{i}}+i\frac{\delta}{\delta a_{i}}(\ln a_{i,jj})^{1/2}=i\delta\frac{1}{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}$ (23) Now we briefly write $\partial_{j}\partial^{j}\ln a_{i}=\ln a_{i,jj}$. Off course it is diferent, we simplisitily use the latter. Then Eq.(22) becomes $\displaystyle\frac{\delta^{2}}{\delta a_{i}^{2}}+2\sqrt{2}i(\ln a_{i,jj})^{1/2}\frac{\delta}{\delta a_{i}}-2\sqrt{2}i\frac{\delta}{\delta a_{i}}(\ln a_{i,jj})^{1/2}+8\ln a_{i,jj}=i\sqrt{2}\delta(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}$ (24) Or $\displaystyle\bigg{(}\frac{\delta}{\delta a_{i}}+2\sqrt{2}i(\ln a_{i,jj})^{1/2}\bigg{)}\bigg{(}\frac{\delta}{\delta a_{i}}-2\sqrt{2}i(\ln a_{i,jj})^{1/2}\bigg{)}=\sqrt{2}i\delta(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}.$ (25) Then we take following assumptions $\displaystyle\frac{\delta}{\delta a_{i}}+2\sqrt{2}i(\ln a_{i,jj})^{1/2}=g_{1}[a_{i}]$ (26) $\displaystyle\frac{\delta}{\delta a_{i}}-2\sqrt{2}i(\ln a_{i,jj})^{1/2}=g_{2}[a_{i}].$ (27) Here, $\displaystyle g_{1}[a_{i}]g_{2}[a_{i}]=i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}$ (28) Then second partial functional derivative become ordinal functional derivative and the equation become following $\displaystyle\frac{\delta f^{1/2}[a_{i}]}{\delta a_{i}}+2\sqrt{2}i(\ln a_{i,jj})^{1/2}f^{1/2}[a_{i}]=g_{1}[a_{i}]f^{1/2}[a_{i}]$ (29) $\displaystyle\frac{\delta f^{1/2}[a_{i}]}{\delta a_{i}}-2\sqrt{2}i(\ln a_{i,jj})^{1/2}f^{1/2}[a_{i}]=g_{2}[a_{i}]f^{1/2}[a_{i}].$ (30) From this equation we obtain $\displaystyle\frac{1}{2}\ln f[a_{i}]=\int g_{1}[a_{i}]+2\sqrt{2}i(\ln a_{i,jj})^{1/2}\delta a_{i}$ (31) $\displaystyle\frac{1}{2}\ln f[a_{i}]=\int g_{2}[a_{i}]-2\sqrt{2}i(\ln a_{i,jj})^{1/2}\delta a_{i}$ (32) We can obtain the solution $\displaystyle f[a_{i}]=\exp\bigg{(}2\int g_{1}[a_{i}]+2\sqrt{2}i(\ln a_{i,jj})^{1/2}\delta a_{i}\bigg{)}$ (33) $\displaystyle f[a_{i}]=\exp\bigg{(}2\int g_{2}[a_{i}]-2\sqrt{2}i(\ln a_{i,jj})^{1/2}\delta a_{i}\bigg{)}$ (34) Because $f[a_{i}]$ is same $\displaystyle g_{1}[a_{i}]=g_{2}[a_{i}]-4\sqrt{2}(\ln a_{i,jj})^{1/2}.$ (35) Inserting this equation to Eq.(28), we obtain $\displaystyle g_{2}[a_{i}]^{2}-4\sqrt{2}(\ln a_{i,jj})^{1/2}g_{2}[a_{i}]=i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}.$ (36) Exchangeng this equation, we obtain $\displaystyle g_{2}[a_{i}]^{2}-4\sqrt{2}(\ln a_{i,jj})^{1/2}g_{2}[a_{i}]-i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}=0.$ (37) By solving this second order function equation, we obtain $\displaystyle g_{2}[a_{i}]=2\sqrt{2}(\ln a_{i,jj})^{1/2}\pm\sqrt{8\ln a_{i,jj}+i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}}.$ (38) Inserting this equation to Eq.(34), we obtain $\displaystyle f[a_{i}]=\exp\bigg{(}\int\pm 2\sqrt{8\ln a_{i,jj}+i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}}\delta a_{i}\bigg{)}.$ (39) So the quantization of the spacetime as (18) is $\displaystyle f[a_{1},a_{2},a_{3}]=\prod_{i}\exp\bigg{(}\int\pm 2\sqrt{8\ln a_{i,jj}+i\delta\sqrt{2}(\ln a_{i,jj})^{1/2}a_{i,jj}^{-1}}\delta a_{i}\bigg{)}.$ (40) This is the special solution of quantization of the spacetime (18). Then we carry out step 2, we remove the static restriction and we assume the state is the form of the $\displaystyle|\Psi\rangle=f[a_{i}]h[a_{i}]$ (41) Then we obtain $\displaystyle\nabla(\nabla+h^{\prime}[a_{i}])h[a_{i}]=0.$ (42) Here, $\displaystyle h^{\prime}[a_{i}]=\sum_{i}\pm\sqrt{8\ln a_{i,jj}+i\delta\sqrt{2}(\ln a_{i,jj})^{1/2}a_{i,jj}^{-1}}$ (43) The functional partial derivative $\displaystyle(\nabla+h^{\prime}[a_{i}])h[a_{i}]=0$ (44) is solved analytically. The solution is $\displaystyle h[a_{i}]=\exp\bigg{(}\int^{a_{1}}h^{\prime}[a_{1}^{\prime},-a_{1}+a_{2}+a_{1}^{\prime},-a_{1}+a_{3}+a_{1}^{\prime}]\delta a_{1}^{\prime}\bigg{)}(-2\int\delta a_{1}+\int\delta a_{2}+\int\delta a_{3})$ $\displaystyle+\exp\bigg{(}\int^{a_{2}}h^{\prime}[a_{1}-a_{2}+a_{2}^{\prime},a_{2}^{\prime},-a_{2}+a_{3}+a_{2}^{\prime}]\delta a_{2}^{\prime}\bigg{)}(-2\int\delta a_{2}+\int\delta a_{1}+\int\delta a_{3})$ $\displaystyle+\exp\bigg{(}\int^{a_{3}}h^{\prime}[-a_{3}+a_{1}+a_{3}^{\prime},-a_{3}+a_{2}+a_{3}^{\prime},a_{3}^{\prime}]\delta a_{3}^{\prime}\bigg{)}(-2\int\delta a_{3}+\int\delta a_{1}+\int\delta a_{2})$ (45) So the quantum state of spacetime (18) is $\displaystyle|\Psi\rangle=\prod_{i}\exp\bigg{(}\int\pm 2\sqrt{8\ln a_{i,jj}+i\delta\sqrt{2}(\ln a_{i,jj})^{-1/2}a_{i,jj}^{-1}}\delta a_{i}\bigg{)}$ $\displaystyle\times\bigg{[}\exp\bigg{(}\int^{a_{1}}h^{\prime}[a_{1}^{\prime},-a_{1}+a_{2}+a_{1}^{\prime},-a_{1}+a_{3}+a_{1}^{\prime}]\delta a_{1}^{\prime}\bigg{)}(-2\int\delta a_{1}+\int\delta a_{2}+\int\delta a_{3})$ $\displaystyle+\exp\bigg{(}\int^{a_{2}}h^{\prime}[a_{1}-a_{2}+a_{2}^{\prime},a_{2}^{\prime},-a_{2}+a_{3}+a_{2}^{\prime}]\delta a_{2}^{\prime}\bigg{)}(-2\int\delta a_{2}+\int\delta a_{1}+\int\delta a_{3})$ $\displaystyle+\exp\bigg{(}\int^{a_{3}}h^{\prime}[-a_{3}+a_{1}+a_{3}^{\prime},-a_{3}+a_{2}+a_{3}^{\prime},a_{3}^{\prime}]\delta a_{3}^{\prime}\bigg{)}(-2\int\delta a_{3}+\int\delta a_{1}+\int\delta a_{2})\bigg{]}$ (46) This is the main result of our paper. ## V Conclusion and Discussions We quantized diagonal metric space with Gaussian normal coordinate. By solving the Wheeler-DeWitt equation, we know the form of the solution. We quantize two universe. The common feature is similarity of step 2. The step 2 is all ways solved. So the important point is to find the special solution. There are many further work. Once we should calculate the inner product and norm. If the normalization is end the state is used to calculate the averaged value. Or we should discuss problem of the norm. This open issue is very important one. And we should search the initial singularity or the black hole singularity. Our work does not end. ## References * (1) C.J.Isham and A.Ashtekar Class. Quant. Grav. 9 1433 (1992) * (2) C.Rovelli Quantum Gravity; Cambridge monographs on mathematical physics (2004) * (3) T.Thiemann gr-qc/0110034 (2001) * (4) A.Linde hep-th/0503195 (2005) * (5) S.Sawayama gr-qc/0604007 (2006) * (6) B.S.DeWitt Phys. Rev. 160 1113 (1967) * (7) J.J.Halliwell and J.B.Hartle Phys. Rev. D 43 1170 (1991)
arxiv-papers
2009-04-23T00:04:12
2024-09-04T02:49:02.095537
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Shintaro Sawayama", "submitter": "Shintaro Sawayama", "url": "https://arxiv.org/abs/0904.3577" }
0904.3670
CAS-KITPC/ITP-106 KU-TP 031 Topological Black Holes in Hořava-Lifshitz Gravity Rong-Gen Caia,***e-mail address: cairg@itp.ac.cn, Li-Ming Caob,†††e-mail address: caolm@apctp.org, Nobuyoshi Ohtac,‡‡‡e-mail address: ohtan@phys.kindai.ac.jp a Key Laboratory of Frontiers in Theoretical Physics, Institute of Theoretical Physics, Chinese Academy of Sciences, P.O. Box 2735, Beijing 100190, China Kavli Institute for Theoretical Physics China (KITPC), Chinese Academy of Sciences, P.O. Box 2735, Beijing 100190, China bAsia Pacific Center for Theoretical Physics, Pohang, Gyeongbuk 790-784, Korea cDepartment of Physics, Kinki University, Higashi-Osaka, Osaka 577-8502, Japan Abstract We find topological (charged) black holes whose horizon has an arbitrary constant scalar curvature $2k$ in Hořava-Lifshitz theory. Without loss of generality, one may take $k=1,0$ and $-1$. The black hole solution is asymptotically AdS with a nonstandard asymptotic behavior. Using the Hamiltonian approach, we define a finite mass associated with the solution. We discuss the thermodynamics of the topological black holes and find that the black hole entropy has a logarithmic term in addition to an area term. We find a duality in Hawking temperature between topological black holes in Hořava- Lifshitz theory and Einstein’s general relativity: the temperature behaviors of black holes with $k=1,0$ and $-1$ in Hořava-Lifshitz theory are respectively dual to those of topological black holes with $k=-1,0$ and $1$ in Einstein’s general relativity. The topological black holes in Hořava-Lifshitz theory are thermodynamically stable. ## 1 Introduction Recently a field theory model for a UV complete theory of gravity was proposed by Hořava [1], which is a non-relativistic renormalisable theory of gravity and reduces to Einstein’s general relativity at large scales. This theory is named Hořava-Lifshitz theory in the literature since at the UV fixed point of the theory space and time have different scalings. Since then much attention has been attracted to this gravity theory [2, 3, 4, 5, 6, 7, 8, 9], including its implications in cosmology [3, 4, 5, 7, 8, 9]. In [7] the authors find some static spherically symmetric black hole solutions in Hořava-Lifshitz theory. In the $(3+1)$-dimensional ADM formalism, where the metric can be written as $ds^{2}=-N^{2}dt^{2}+g_{ij}(dx^{i}+N^{i}dt)(dx^{j}+N^{j}dt),$ (1.1) and for a spacelike hypersurface with a fixed time, its extrinsic curvature $K_{ij}$ is $K_{ij}=\frac{1}{2N}(\dot{g}_{ij}-\nabla_{i}N_{j}-\nabla_{j}N_{i}),$ (1.2) where a dot denotes a derivative with respect to $t$ and covariant derivatives defined with respect to the spatial metric $g_{ij}$, the action of Hořava- Lifshitz theory is [1] $\displaystyle I$ $\displaystyle=$ $\displaystyle\int dtd^{3}x\sqrt{g}N\left(\frac{2}{\kappa^{2}}(K_{ij}K^{ij}-\lambda K^{2})+\frac{\kappa^{2}\mu^{2}(\Lambda R-3\Lambda^{2})}{8(1-3\lambda)}+\frac{\kappa^{2}\mu^{2}(1-4\lambda)}{32(1-3\lambda)}R^{2}\right.$ (1.3) $\displaystyle\left.-\frac{\kappa^{2}\mu^{2}}{8}R_{ij}R^{ij}+\frac{\kappa^{2}\mu}{2\omega^{2}}\epsilon^{ijk}R_{il}\nabla_{j}R^{l}_{\ k}-\frac{\kappa^{2}}{2\omega^{4}}C_{ij}C^{ij}\right),$ where $\kappa^{2}$, $\lambda$, $\mu$, $\omega$ and $\Lambda$ are constant parameters and the Cotten tensor, $C_{ij}$, is defined by $C^{ij}=\epsilon^{ikl}\nabla_{k}\left(R^{j}_{\ l}-\frac{1}{4}R\delta^{j}_{l}\right)=\epsilon^{ikl}\nabla_{k}R^{j}_{\ l}-\frac{1}{4}\epsilon^{ikj}\partial_{k}R.$ (1.4) In (1.3), the first two terms are the kinetic terms, while the others give the potential of the theory in the so-called “detailed-balance” form. Comparing the action to that of general relativity, one can see that the speed of light, Newton’s constant and the cosmological constant are $c=\frac{\kappa^{2}\mu}{4}\sqrt{\frac{\Lambda}{1-3\lambda}},\ \ G=\frac{\kappa^{2}c}{32\pi},\ \ \tilde{\Lambda}=\frac{3}{2}\Lambda,$ (1.5) respectively. Let us notice that when $\lambda=1$, the first three terms in (1.3) could be reduced to the usual ones of Einstein’s general relativity. However, in Hořava-Lifshitz theory, $\lambda$ is a dynamical coupling constant, susceptible to quantum correction [1]. In addition, we see from (1.5) that when $\lambda>1/3$, the cosmological constant $\Lambda$ must be negative. However, the cosmological constant can be positive if we make an analytic continuation $\mu\to i\mu,w^{2}\to-iw^{2}$ [7]. In this paper, we consider the former case with negative cosmological constant. For later convenience, we rewrite the action (1.3) as follows [7]: $\displaystyle I$ $\displaystyle=$ $\displaystyle\int dtd^{3}x({\cal L}_{0}+{\cal L}_{1}),$ (1.6) $\displaystyle{\cal L}_{0}$ $\displaystyle=$ $\displaystyle\sqrt{g}N\left\\{\frac{2}{\kappa^{2}}(K_{ij}K^{ij}-\lambda K^{2})+\frac{\kappa^{2}\mu^{2}(\Lambda R-3\Lambda^{2})}{8(1-3\lambda)}\right\\},$ $\displaystyle{\cal L}_{1}$ $\displaystyle=$ $\displaystyle\sqrt{g}N\left\\{\frac{\kappa^{2}\mu^{2}(1-4\lambda)}{32(1-3\lambda)}R^{2}-\frac{\kappa^{2}}{2\omega^{4}}\left(C_{ij}-\frac{\mu\omega^{2}}{2}R_{ij}\right)\left(C^{ij}-\frac{\mu\omega^{2}}{2}R^{ij}\right)\right\\}.$ The equations of motion for the action are given in [5, 7], but they are very lengthy and we will not reproduce them here. In this note we are interested in black hole solutions in the action (1.6). Considering the static, spherically symmetric solutions with the metric ansatz $ds^{2}=-N^{2}(r)dt^{2}+\frac{dr^{2}}{f(r)}+r^{2}(d\theta^{2}+\sin^{2}\theta d\phi^{2}).$ (1.7) Without the term ${\cal L}_{1}$, the solution is the just the (A)dS Schwarzschild black hole solution with metric functions [7] $N^{2}(r)=f(r)=1-\frac{\Lambda}{2}r^{2}-\frac{m}{r}.$ (1.8) With the term ${\cal L}_{1}$, a general static, spherically symmetric black hole solution with an arbitrary $\lambda$ is also found in [7], but the solution is elusive. We discuss the general solution in the appendix. Of particular interest is the case with $\lambda=1$, on which we focus in the following. The solution is then given by $N^{2}=f=1+x^{2}-\alpha\sqrt{x},$ (1.9) where $x=\sqrt{-\Lambda}r$ and $\alpha$ is an integration constant. This solution is asymptotically $AdS_{4}$ and has a singularity at $x=0$ if $\alpha\neq 0$. The singularity could be covered by black hole horizon at $x_{+}$, the largest root of the equation $f=0$ if $\alpha>0$. The Hawking temperature of the black hole horizon is easily given by [7] $T=\frac{3x_{+}^{2}-1}{8\pi x_{+}}\sqrt{-\Lambda}.$ (1.10) Note that here we have corrected a typo in [7]. One can see from (1.10) that there exists an extremal limit, $x_{+}=1/\sqrt{3}$, where the temperature vanishes. Another remarkable point one can see by comparing the solution (1.9) and (1.8) is that general relativity is not always recovered at large distance [7]. In addition, one may naively expect that the mass of the black hole solution (1.9) is divergent due to the square root term. The black hole solution (1.9) is obtained from the action (1.6) in the detailed balance [1]. The authors in [7] also considered black hole solution in Hořava-Lifshitz theory without the condition of the detailed balance, namely in the theory given by ${\cal L}={\cal L}_{0}+(1-\epsilon^{2}){\cal L}_{1},$ (1.11) where $\epsilon$ is a constant. In this theory, the black hole solution they found turns to be $N^{2}=f=1+\frac{x^{2}}{1-\epsilon^{2}}-\frac{\sqrt{\alpha^{2}(1-\epsilon^{2})x+\epsilon^{2}x^{4}}}{1-\epsilon^{2}}.$ (1.12) In the large distance limit, the solution reduces to $f=1+\frac{x^{2}}{1+\epsilon}-\frac{\alpha^{2}}{2\epsilon x}+{\cal O}(x^{-4}).$ (1.13) The authors in [7] suggest that the solution has a finite mass for non- vanishing $\epsilon$, while it becomes divergent as $\epsilon=0$. In the latter case, the solution goes back to the one (1.9). Furthermore, when $\epsilon=1$, the solution becomes the (A)dS Schwarzschild black hole solution (1.8). In this note we are going to discuss thermodynamics of the black hole solutions (1.9) and (1.12), which have not been studied in [7]. Since the solutions (1.9) and (1.12) are asymptotically AdS, we will generalize those solutions to the case of topological black holes with any constant scalar curvature horizon [10, 11, 12, 13]. We will also discuss the topological charged black holes in Hořava-Lifshitz theory by including Maxwell field. ## 2 Topological black holes and thermodynamics In this section we first generalize the spherically symmetric black hole solution (1.9) to the topological black hole case with arbitrary constant scalar curvature horizon. The black hole solution is of the metric ansatz $ds^{2}=-\tilde{N}^{2}(r)f(r)dt^{2}+\frac{dr^{2}}{f(r)}+r^{2}d\Omega_{k}^{2},$ (2.1) where $d\Omega_{k}^{2}$ denotes the line element for an 2-dimensional Einstein space with constant scalar curvature $2k$. Without loss of generality, one may take $k=0$, $\pm 1$, respectively. Following [7], substituting the metric (2.1) into (1.6), we find $\displaystyle I$ $\displaystyle=$ $\displaystyle\frac{\kappa^{2}\mu^{2}\Lambda\Omega_{k}}{8(1-3\lambda)}\int dtdr\tilde{N}\left\\{-3\Lambda r^{2}-2(f-k)-2r(f-k)^{\prime}\right.$ (2.2) $\displaystyle~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}~{}\left.+\frac{(\lambda-1)f^{\prime 2}}{2\Lambda}+\frac{(2\lambda-1)(f-k)^{2}}{\Lambda r^{2}}-\frac{2\lambda(f-k)}{\Lambda r}f^{\prime}\right\\},$ where a prime denotes the derivative with respect to $r$ and $\Omega_{k}$ is the volume of the 2-dimensional Einstein space. Again, we consider the solution in the case of $\lambda=1$. In that case, we have $I=\frac{\kappa^{2}\mu^{2}\sqrt{-\Lambda}\Omega_{k}}{16}\int dtdx\tilde{N}\left(x^{3}-2x(f-k)+\frac{(f-k)^{2}}{x}\right)^{\prime}.$ (2.3) Note that here $x=\sqrt{-\Lambda}r$ and a prime becomes the derivative with respect to $x$. From the action, we obtain the equations of motion $\displaystyle 0=\tilde{N}^{\prime},$ $\displaystyle 0=(x^{3}-2x(f-k)+\frac{(f-k)^{2}}{x})^{\prime}.$ (2.4) From the first equation, we have $\tilde{N}=N_{0}$, a constant. One can set $N_{0}=1$ by rescaling the time coordinate $t$. From the second one, one can obtain $x^{3}-2x(f-k)+\frac{(f-k)^{2}}{x}=c_{0}$, here $c_{0}$ is an integration constant. Solving this yields $f(r)=k+x^{2}-\sqrt{c_{0}x}.$ (2.5) Note that $c_{0}$ should be positive here. When $k=1$, the solution reduces to the one given by [7]. Thus we generalize the solution in [7] to the case of topological black holes with arbitrary $k$. In addition, let us stress here that although we have obtained the black hole solution through the minisuperspace approach, it has been checked that the solution (2.5) with $N_{0}=1$ indeed satisfies the equations of motion given in [7]. A remarkable property of black holes is that they are associated with thermodynamics. Now we are going to discuss thermodynamics of the black hole solution (2.5), which has not yet been discussed. Comparing to the AdS Schwarzschild black hole solution, one may naively expect that the mass of the solution (2.5) is divergent and one could not define a finite mass for this solution. However, this conclusion is not true. In fact, such non-standard asymptotic behavior also appears for the black hole solutions in the so-called dimensionally continued gravity [14, 13]. For the dimensionally continued black hole solutions, a finite mass can be obtained by using the Hamiltonian approach. We find that this approach also works for the Hořava-Lifshitz theory. Note that the action (2.3) can be written as $I=\frac{\kappa^{2}\mu^{2}\sqrt{-\Lambda}\Omega_{k}}{16}(t_{2}-t_{1})\int dx\tilde{N}\left(x^{3}-2x(f-k)+\frac{(f-k)^{2}}{x}\right)^{\prime}+B,$ (2.6) where $B$ is a surface term, which must be chosen so that the action has an extremum under variations of the fields with appropriate boundary conditions. One demands that the fields approach the classical solutions at infinity. Varying the action (2.6), one finds the boundary term $\delta B=-(t_{2}-t_{1})N_{0}\delta M.$ (2.7) The boundary term $B$ is the conserved charge associated to the “improper gauge transformations” produced by time evolution [15]. Here $M$ and $N_{0}$ are a conjugate pair. Therefore when one varies $M$, $N_{0}$ must be fixed. Thus the boundary term should be in the form $B=-(t_{2}-t_{1})N_{0}M+B_{0},$ (2.8) where $B_{0}$ is an arbitrary constant, which should be fixed by some physical consideration; for example, mass vanishes when black hole horizon goes to zero. For details, see [14]. According to this Hamiltonian approach, we get the mass of the solution (2.5) as $M=\frac{\kappa^{2}\mu^{2}\sqrt{-\Lambda}\Omega_{k}}{16}c_{0}.$ (2.9) Note that here $\Lambda$ is negative, therefore the black hole mass is always positive because we have already set $c_{0}>0$. One can easily obtain the Hawking temperature of the black hole, either by directly calculating the surface gravity at the horizon, or by requiring the absence of the conical singularity at the horizon of the Euclidean black hole. Both methods give the same result $T=\frac{3x_{+}^{2}-k}{8\pi x_{+}}\sqrt{-\Lambda}.$ (2.10) The next step is to get the entropy associated with the topological black hole. In Einstein’s general relativity, entropy of black hole is always given by one quarter of black hole horizon area. But in higher derivative gravities, in general, the area formula breaks down. Here we will obtain the black hole entropy by using the first law of black hole thermodynamics with assumption that as a thermodynamical system [11, 12, 13, 14], the first law always keeps valid: $dM=TdS$. Integrating this relation yields $S\equiv\int T^{-1}dM+S_{0}=\int T^{-1}\frac{dM}{dx_{+}}dx_{+}+S_{0},$ (2.11) where $S_{0}$ is an integration constant, which should be fixed by physical consideration. Through (2.11), we obtain $\displaystyle S$ $\displaystyle=$ $\displaystyle\frac{\pi\kappa^{2}\mu^{2}\Omega_{k}}{4}\left(x_{+}^{2}+2k\ln x_{+}\right)+S_{0},$ (2.12) $\displaystyle=$ $\displaystyle\frac{c^{3}}{4G}\left(A-\frac{k\Omega_{k}}{\Lambda}\ln\frac{A}{A_{0}}\right),$ where the Newton’s constant and speed of light are given in (1.5), $A=\Omega_{k}r_{+}^{2}$ is the black hole horizon area, and $A_{0}$ is a constant of dimension of length squared. The leading term is just one quarter of horizon area in units of $c=G=1$, which should be the contribution from the ${\cal L}_{0}$ term. The second term is a logarithmic function, therefore we cannot fix the integration constant $S_{0}$ or $A_{0}$, unfortunately, by some physical consideration, for example, black hole entropy should vanish when black hole horizon goes to zero. The integration constant $S_{0}$ could be fixed by counting micro degrees of freedom in some quantum theory of gravity like string theory. An interesting fact is that such a term often appears in the quantum correction of black hole entropy. In addition, when $k=0$, namely, for black hole with Ricci flat horizon, the logarithmic term disappears. Thus, the area formula of black hole entropy is recovered in this case. It might be a universal result that the area formula still holds for Ricci flat black holes in higher derivative gravity theories [11, 12, 13]. Two additional points are worth stressing here. One is on the temperature (2.10). For $k=1$, as pointed out in [7], there is an extremum at $x_{+}=1/\sqrt{3}$, where the temperature vanishes, and it corresponds to an extremal black hole. For $k=0$, the temperature $T=3x_{+}\sqrt{-\Lambda}/8\pi$. In these two cases, the temperature always monotonically increases as the horizon $x_{+}$ grows. For $k=-1$, the inverse temperature starts from zero at $x_{+}=0$, monotonically increases and reaches a maximal value, $\beta=1/T=4\pi/\sqrt{-3\Lambda}$ at $x_{+}=1/\sqrt{3}$, then monotonically decreases as $x_{+}$ grows. It is interesting to compare these temperature behaviors of the topological black holes in Hořava-Lifshitz theory with those for topological black holes in Einstein’s general relativity (the latter could be obtained by replacing $1$ by $k$ in (1.8)). The temperature for the topological black holes in Einstein’s general relativity is $T_{\rm TSch}=\frac{\sqrt{-\Lambda}}{8\pi x_{+}}(3x_{+}^{2}+2k).$ (2.13) We see that except for the coefficient difference in front of the horizon curvature constant $k$, there is a duality relation in these two temperatures: the temperature behaviors of black holes in Hořova-Lifshitz theory in the cases of $k=1$,$0$ and $-1$, are dual to the cases of $k=-1$, $0$ and $1$ in Einstein’s general relativity, respectively. Note that for topological black holes in Einstein’s general relativity [10], in the cases of $k=0$ and $k=-1$, the black holes are always thermodynamically stable, while in the case of $k=1$, the small black hole with $x_{+}<\sqrt{2/3}$ is thermodynamically unstable and it becomes thermodynamically stable for large horizon radius $x_{+}>\sqrt{2/3}$. However, a close check tells us that in the case of $k=-1$, there exists a minimal horizon at $x_{+}=1$ for the topological black hole in Hořava-Lifshitz theory, which can be seen from the metric function $f(r)$ in (2.5), namely for the case of $c_{0}=0$. This is just the massless black hole in AdS space. Thus in the range $x_{+}\in[1,\infty)$, the temperature of the topological black hole is also a monotonically increasing function of $x_{+}$. Thus the unstable phase for the topological black hole with $k=-1$ in Hořava-Lifshitz theory does not appear, and the black hole is always thermodynamically stable. To see this more clearly, let us calculate heat capacity of black hole, defined as $C=dM/dT$. The heat capacity of the black hole in Hořava-Lifshitz gravity is $C=\frac{\pi\kappa^{2}\mu^{2}\Omega_{k}}{2}\frac{(3x_{+}^{2}-k)(x_{+}^{2}+k)}{3x_{+}^{2}+k}.$ (2.14) We see that for the cases $k=1$ and $k=0$, the heat capacity is always positive, which implies that the black hole is local thermodynamically stable, while in the case of $k=-1$, if $x_{+}>1$, it is also positive. For comparison, we give the heat capacity for the topological AdS black hole in Einstein’s general relativity $C_{\rm TSch}=\frac{\pi\kappa^{2}\mu^{2}\Omega_{k}}{2}\frac{3x_{+}^{2}+2k}{3x_{+}^{2}-2k}x_{+}^{2}.$ (2.15) When $k=0$ and $-1$, it is always positive while when $k=1$, it is negative for $x_{+}^{2}<2/3$, positive for $x_{+}^{2}>2/3$ and diverges at $x_{+}^{2}=2/3$. Another interesting question is whether there exists the Hawking-Page phase transition associated with the black holes in Hořava-Lifshitz gravity. It is well known that there is a Hawking-Page transition for static, spherically symmetric AdS-Schwarzschild black hole (the case of $k=1$) between a large AdS black hole and thermal gas in AdS space [16]. On the other hand, for the cases of $k=0$ and $k=-1$ topological black hole in Einstein’s general relativity, the Hawking-Page phase transition does not exist. To discuss the Hawking-Page transition, one has to calculate the Euclidean action or free energy of the black hole. The Euclidean action has a relation to the free energy by $I=\beta F$, here $\beta$ is the inverse temperature of the black hole. By definition, the free energy $F$ is given by $F=M-TS$. By using (2.9), (2.10) and (2.12), we find $F=\frac{\kappa^{2}\mu^{2}\Omega_{k}\sqrt{-\Lambda}}{32x_{+}}\left(-x_{+}^{4}+5kx_{+}^{2}+2k^{2}-6kx_{+}^{2}\ln x_{+}+2k^{2}\ln x_{+}\right)-TS_{0}.$ (2.16) Due to the uncertainty of $S_{0}$, we cannot determine the signature of the free energy. However, if one can neglect the term $S_{0}$, we see the free energy is negative for large enough horizon radius, which means that large black holes in Hořava-Lifshitz gravity is thermodynamically stable globally. Now we turn to the case without the detailed balance condition, namely $\epsilon^{2}\neq 0$. Replacing (2.3) we have $I=\frac{\kappa^{2}\mu^{2}\sqrt{-\Lambda}\Omega_{k}}{16}\int dtdx\tilde{N}\left(x^{3}-2x(f-k)+(1-\epsilon^{2})\frac{(f-k)^{2}}{x}\right)^{\prime}.$ (2.17) In this case, one has the solution $\displaystyle\tilde{N}=N_{0},$ $\displaystyle f(r)=k+\frac{x^{2}}{1-\epsilon^{2}}-\frac{\sqrt{\epsilon^{2}x^{4}+(1-\epsilon^{2})c_{0}x}}{1-\epsilon^{2}}.$ (2.18) Again, $c_{0}$ is an integration constant and $N_{0}$ could be set to one. Similar to the case of $\epsilon^{2}=0$, we find the mass of the solution is $M=\frac{\kappa^{2}\mu^{2}\Omega_{k}\sqrt{-\Lambda}}{16}c_{0},$ (2.19) and $c_{0}$ can be expressed in terms of black hole horizon radius $x_{+}$, $c_{0}=\frac{x_{+}^{4}+2kx_{+}+(1-\epsilon^{2})k^{2}}{x_{+}}.$ (2.20) The Hawking temperature of the black hole is found to be $T=\frac{\sqrt{-\Lambda}}{8\pi}\frac{3x_{+}^{4}+2kx_{+}^{2}-(1-\epsilon^{2})k^{2}}{x_{+}(x_{+}^{2}+(1-\epsilon^{2})k)}.$ (2.21) With the mass and temperature, we obtain the entropy of the black hole $\displaystyle S$ $\displaystyle=$ $\displaystyle\frac{\pi\kappa^{2}\mu^{2}\Omega_{k}}{4}\left(x_{+}^{2}+2k(1-\epsilon^{2})\ln x_{+}\right)+S_{0},$ (2.22) $\displaystyle=$ $\displaystyle\frac{c^{3}}{4G}\left(A-(1-\epsilon^{2})\frac{k\Omega_{k}}{\Lambda}\ln\frac{A}{A_{0}}\right).$ When $\epsilon^{2}=0$, it goes back to (2.12), while it reduces to the well- known area formula for $\epsilon^{2}=1$, as expected, since in that case, the effect of higher derivative terms disappears. Now let us discuss the behavior of the temperature (2.21). (i) When $k=0$, the temperature is independent of $\epsilon^{2}$, given by $T=\frac{3\sqrt{-\Lambda}}{8\pi}x_{+}.$ (2.23) Clearly it is a monotonically increasing function of $x_{+}$ (ii) When $k=-1$ and $\epsilon^{2}<1$, an extremal black hole with $T=0$ is obtained at $x_{+}^{2}=(1+\sqrt{1+3(1-\epsilon^{2})})/3$. While to keep the denominator in (2.21) positive, one has to have $x_{+}^{2}>(1-\epsilon^{2})$, which is always smaller than $(1+\sqrt{1+3(1-\epsilon^{2})})/3$. This indicates that there does exist an extremal black hole in this case with the minimal horizon radius $x_{+\rm min}^{2}=(1+\sqrt{1+3(1-\epsilon^{2})})/3$. When $\epsilon^{2}>1$, according to (2), the minimal horizon radius is $x_{+}^{2}=1+\epsilon$. In both cases of $\epsilon^{2}>1$ and $<1$, the temperature of the black hole is a monotonically increasing function of $x_{+}$ in the physical regime. (iii) When $k=1$, let us first consider the case of $\epsilon^{2}<1$. A vanishing temperature happens at $x^{2}_{+\rm min}=(-1+\sqrt{1+3(1-\epsilon^{2})})/3$. When $\epsilon^{2}>1$, there does not exist an extremal black hole, but keep the temperature positive, a physical horizon radius must obey $x_{+}^{2}>\epsilon^{2}-1$. As the case of $k=-1$ with any $\epsilon^{2}$, the temperature of the black hole is a monotonically increasing function of $x_{+}$ in the physical regime, again. In summary, the case with $\epsilon^{2}\neq 0$ is similar to the case with $\epsilon^{2}=0$, the Hawking temperature of the black holes with any $k$ is always a monotonically increasing function of horizon radius $x_{+}$ in the physical regime. This implies that the topological black holes in Hořava- Lifshitz theory are thermodynamically stable. Note that when $\epsilon^{2}=1$, the situation is reduced to the case of the well-known topological AdS Schwarzschild black holes [10]. ## 3 Topological charged black holes In this section we consider the charged generalization of the topological black hole found in Sec. 2. To give a universal result, we assume $\epsilon^{2}\neq 0$. Following [14, 13], the Hamiltonian action for the Maxwell field can be written as $I_{\rm em}=\int dtd^{3}x\left[p^{i}\dot{A}_{i}-\frac{1}{2}N\left(\alpha g^{-1/2}p^{i}p_{i}+\frac{g^{1/2}}{2\alpha}F_{ij}F^{ij}\right)+\varphi p^{i},_{i}\right]+B_{\rm em},$ (3.1) where $p^{i}$ is the momentum conjugate of the spatial components of the Maxwell field $A_{i}$, $\varphi=A_{0}$, $B_{\rm em}$ is a boundary term, $N$ is the lapse function, and $\alpha$ is a parameter to be fixed shortly. Considering the static topological black hole solution with the metric ansatz (2.1), the action (3.1) is reduced to $I_{\rm em}=\frac{\Omega_{k}}{\alpha}\int dtdr\left(-\frac{1}{2}\tilde{N}r^{2}p^{2}+\varphi(r^{2}p)^{\prime}\right)+B_{\rm em},$ (3.2) where $p=\alpha p^{r}/r^{2}\gamma^{1/2}$ and $\gamma$ is the determinate of the 2-dimensional Einstein space $d\Omega^{2}_{k}$. Note that here the solution without magnetic charge $F_{ij}=0$ has been assumed. To be consistent with (2.17), we set $x=\sqrt{-\Lambda}r$, The action (3.2) then becomes $I_{\rm em}=\frac{\Omega_{k}}{\alpha\sqrt{-\Lambda}}\int dtdx\left(-\frac{1}{2}\tilde{N}x^{2}\tilde{p}^{2}+\varphi(x^{2}\tilde{p})^{\prime}\right)+B_{\rm em},$ (3.3) where a prime denotes derivative with respective to $x$ and $\tilde{p}=p/\sqrt{-\Lambda}$. Now we set $\alpha^{-1}=-\frac{\kappa^{2}\mu^{2}\Lambda}{16}.$ (3.4) Combining (2.17) and (3.4), we have $I=\frac{\kappa^{2}\mu^{2}\sqrt{-\Lambda}\Omega_{k}}{16}\int dtdx\left(\tilde{N}(U^{\prime}-\frac{1}{2}x^{2}\tilde{p}^{2})+\varphi(x^{2}\tilde{p})^{\prime}\right)+B,$ (3.5) where $U=x^{3}-2x(f-k)+(1-\epsilon^{2})\frac{(f-k)^{2}}{x}.$ From the action (3.5) we obtain the equations of motion $\displaystyle U^{\prime}=\frac{1}{2}x^{2}\tilde{p}^{2},\ \ \ (x^{2}\tilde{p})^{\prime}=0,$ (3.6) $\displaystyle\varphi^{\prime}=-\tilde{N}\tilde{p},\ \ \ \tilde{N}^{\prime}=0,$ which have the solution $\displaystyle\tilde{N}=N_{0},\ \ \ \ \varphi=\frac{N_{0}q}{x}+\varphi_{0},$ $\displaystyle\tilde{p}=\frac{q}{x^{2}},\ \ \ \ U=-\frac{q^{2}}{2x}+c_{0}.$ (3.7) Here $N_{0}$, $\varphi_{0}$, $c_{0}$ and $q$ are integration constants, their physical meanings are clear. Physical electric charge and mass of the solution are $Q=\frac{\kappa^{2}\mu^{2}\Omega_{k}\sqrt{-\Lambda}}{16}q,\ \ \ M=\frac{\kappa^{2}\mu^{2}\Omega_{k}\sqrt{-\Lambda}}{16}c_{0},$ (3.8) respectively, and the metric function $f$ is given by $f(r)=k+\frac{x^{2}}{1-\epsilon^{2}}-\frac{\sqrt{\epsilon^{2}x^{4}+(1-\epsilon^{2})(c_{0}x-q^{2}/2)}}{1-\epsilon^{2}},$ (3.9) while $\tilde{N}=N_{0}$ could be set to one. Taking the limit $\epsilon\to 1$, the solution is reduced to $f(r)=k+\frac{x^{2}}{2}-\frac{c_{0}}{2x}+\frac{q^{2}}{4x^{2}},$ (3.10) as expected, it is just the AdS Reissner-Nordström black hole solution. The Hawking temperature of the black hole is $T=\frac{\sqrt{-\Lambda}(3x_{+}^{4}+2kx_{+}^{2}-(1-\epsilon^{2})k^{2}-q^{2}/2)}{8\pi x_{+}(x_{+}^{2}+(1-\epsilon^{2})k)}.$ (3.11) Putting the temperature (3.11) and mass (3.8) into the first law of black hole thermodynamics, it is easy to check that one reproduces the entropy (2.22), the charge $q$ does not appear explicitly in the expression of black hole entropy in terms of horizon radius. This is consistent with the fact that black hole entropy is a function of horizon geometry. The behavior of the temperature can be analyzed as the case without the electric charge, but we do not repeat here. Instead we only point out that due to the appearance of the electric charge, extremal black holes with vanishing temperature always exist within reasonable parameter regime. ## 4 Conclusion In this paper we found topological (charge) black hole solutions with arbitrary constant scalar curvature horizon in Hořava-Lifshitz theory, generalizing the static, spherically symmetric black hole solutions in [7]. Although there is a square root term in the metric function $f(r)$, we can define a finite mass associated with the black hole solution by use of the Hamiltonian approach. We have calculated the Hawking temperature of the black hole and the black hole entropy by using the first law of black hole thermodynamics, and found that, except for the well-known horizon area term, the black hole entropy has a logarithmic term. Such a logarithmic term often occurs on the occasion of considering quantum corrections to black hole entropy. In our entropy expression, there is a undetermined constant $S_{0}$. To fix the constant entropy $S_{0}$, one has to invoke quantum theory of gravity. We find that the temperature behavior of the topological black holes in Hořava-Lifshitz theory is very interesting. Indeed there is a duality for temperature between topological black holes in Hořava-Lifshitz theory and topological black holes in Einstein’s general relativity. The temperatures of topological black holes with $k=1$, $0$ and $-1$ in Hořava-Lifshitz theory are dual to those of black holes with $k=-1$, $0$ and $1$ in Einstein’s general relativity, respectively. In this paper we have only considered thermodynamics of topological black holes in Hořava-Lifshitz theory with $\lambda=1$. It is of great interest to see whether one can find a way to study thermodynamics for the general topological black holes in the theory with $\lambda\neq 1$. ## Acknowledgments This work was supported partially by grants from NSFC, China (No. 10821504 and No. 10525060), a grant from the Chinese Academy of Sciences with No.KJCX3-SYW-N2, the Grant-in-Aid for Scientific Research Fund of the JSPS No. 20540283, and the Japan-U.K. Research Cooperative Program. ## Appendix A Appendix: Topological black holes for general $\lambda$ Here we briefly discuss topological black hole solution with a general $\lambda$. In terms of the new function $F$ defined by $\displaystyle F(r)=k-\Lambda r^{2}-f(r),$ (A.1) the action (2.2) takes the form $\displaystyle I=\frac{\kappa^{2}\mu^{2}\Omega_{k}}{8(1-3\lambda)}\int dtdr\tilde{N}\left\\{\frac{(\lambda-1)}{2}F^{\prime 2}-\frac{2\lambda}{r}FF^{\prime}+\frac{(2\lambda-1)}{r^{2}}F^{2}\right\\}.$ (A.2) The equations of motion are then $\displaystyle 0=\left(\frac{2\lambda}{r}F-(\lambda-1)F^{\prime}\right)\tilde{N}^{\prime}+(\lambda-1)\left(\frac{2}{r^{2}}F-F^{\prime\prime}\right)\tilde{N},$ (A.3) $\displaystyle 0=(\lambda-1)r^{2}F^{\prime 2}-4\lambda rFF^{\prime}+2(2\lambda-1)F^{2}.$ (A.4) The latter is easily solved to give [7] $\displaystyle F(r)=\alpha r^{\frac{2\lambda\pm\sqrt{2(3\lambda-1)}}{\lambda-1}},$ (A.5) and then the first gives $\displaystyle\tilde{N}=\beta r^{-\frac{1+3\lambda\pm 2\sqrt{2(3\lambda-1)}}{\lambda-1}},$ (A.6) where $\alpha$ and $\beta$ are both integration constants. When $\alpha=0$ or $F=0$, Eq. (A.3) does not restrict $\tilde{N}$. Note that the exponent of Eq. (A.5) for the negative branch is always less than 2 for positive $\lambda$, and thus the $r^{2}$ term in the metric function (A.1) dominates at large distances. The other branch gives a power larger than 2. We are interested in the solutions with asymptotic AdS behavior. In that case, we should look at the negative branch with constant $\tilde{N}$. It follows from Eq. (A.3) that either $\lambda=1$ or $F^{\prime\prime}=\frac{2}{r^{2}}F$. The latter leads to $F\sim r^{2}$ or $1/r$; the first one does not satisfy (A.4), and the second solution requires $\lambda=1/3$, which may be of some interest [1], but the action (1.3) appears singular. So we discuss $\lambda=1$ case mainly in this paper. ## References * [1] P. Horava, arXiv:0901.3775 [hep-th]. * [2] P. Horava, JHEP 0903, 020 (2009) [arXiv:0812.4287 [hep-th]]; M. Visser, arXiv:0902.0590 [hep-th]; L. Maccione, A. M. Taylor, D. M. Mattingly and S. Liberati, arXiv:0902.1756 [astro-ph.HE]; P. R. S. Carvalho and M. M. Leite, arXiv:0902.1972 [hep-th]; P. Horava, arXiv:0902.3657 [hep-th]; A. Volovich and C. Wen, arXiv:0903.2455 [hep-th]; A. Jenkins, arXiv:0904.0453 [gr-qc]. * [3] T. Takahashi and J. Soda, arXiv:0904.0554 [hep-th]. * [4] G. Calcagni, arXiv:0904.0829 [hep-th]. * [5] E. Kiritsis and G. Kofinas, arXiv:0904.1334 [hep-th]. * [6] J. Kluson, arXiv:0904.1343 [hep-th]. * [7] H. Lu, J. Mei and C. N. Pope, arXiv:0904.1595 [hep-th]. * [8] S. Mukohyama, arXiv:0904.2190 [hep-th]. * [9] R. Brandenberger, arXiv:0904.2835 [hep-th]. * [10] J. P. S. Lemos, Phys. Lett. B 353, 46 (1995) [arXiv:gr-qc/9404041]; J. P. S. Lemos and V. T. Zanchin, Phys. Rev. D 54, 3840 (1996) [arXiv:hep-th/9511188]; C. G. Huang and C. B. Liang, Phys. Lett. A 201, 27 (1995); R. G. Cai and Y. Z. Zhang, Phys. Rev. D 54, 4891 (1996) [arXiv:gr-qc/9609065]; S. Aminneborg, I. Bengtsson, S. Holst and P. Peldan, Class. Quant. Grav. 13, 2707 (1996) [arXiv:gr-qc/9604005]; R. B. Mann, Class. Quant. Grav. 14, L109 (1997) [arXiv:gr-qc/9607071]; D. R. Brill, J. Louko and P. Peldan, Phys. Rev. D 56, 3600 (1997) [arXiv:gr-qc/9705012]. L. Vanzo, Phys. Rev. D 56, 6475 (1997) [arXiv:gr-qc/9705004]; R. G. Cai, J. Y. Ji and K. S. Soh, Phys. Rev. D 57, 6547 (1998) [arXiv:gr-qc/9708063]; D. Klemm, V. Moretti and L. Vanzo, Phys. Rev. D 57, 6127 (1998) [Erratum-ibid. D 60, 109902 (1999)] [arXiv:gr-qc/9710123]; D. Birmingham, Class. Quant. Grav. 16, 1197 (1999) [arXiv:hep-th/9808032]; R. Aros, R. Troncoso and J. Zanelli, Phys. Rev. D 63, 084015 (2001) [arXiv:hep-th/0011097]. M. Cvetic, S. Nojiri and S. D. Odintsov, Nucl. Phys. B 628, 295 (2002) [arXiv:hep-th/0112045]; Y. M. Cho and I. P. Neupane, Phys. Rev. D 66, 024044 (2002) [arXiv:hep-th/0202140]; I. P. Neupane, Phys. Rev. D 67, 061501 (2003) [arXiv:hep-th/0212092]. * [11] R. G. Cai, Phys. Rev. D 65, 084014 (2002) [arXiv:hep-th/0109133]; R. G. Cai and Q. Guo, Phys. Rev. D 69, 104025 (2004) [arXiv:hep-th/0311020]; Z. K. Guo, N. Ohta and T. Torii, Prog. Theor. Phys. 120, 581 (2008) [arXiv:0806.2481 [gr-qc]]. Z. K. Guo, N. Ohta and T. Torii, Prog. Theor. Phys. 121, 253 (2009) [arXiv:0811.3068 [gr-qc]]; N. Ohta and T. Torii, arXiv:0902.4072 [hep-th]; * [12] R. G. Cai, Phys. Lett. B 582, 237 (2004) [arXiv:hep-th/0311240]. * [13] R. G. Cai and K. S. Soh, Phys. Rev. D 59, 044013 (1999) [arXiv:gr-qc/9808067]. * [14] M. Banados, C. Teitelboim and J. Zanelli, Phys. Rev. D 49, 975 (1994) [arXiv:gr-qc/9307033]. * [15] T. Regge and C. Teitelboim, Annals Phys. 88, 286 (1974). * [16] S. W. Hawking and D. N. Page, Commun. Math. Phys. 87, 577 (1983).
arxiv-papers
2009-04-23T12:59:17
2024-09-04T02:49:02.101803
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Rong-Gen Cai, Li-Ming Cao, Nobuyoshi Ohta", "submitter": "Rong-Gen Cai", "url": "https://arxiv.org/abs/0904.3670" }
0904.3706
# Recent Results from the MINOS experiment Milind V. Diwan ###### Abstract MINOS is an accelerator neutrino oscillation experiment at Fermilab. An intense high energy neutrino beam is produced at Fermilab and sent to a near detector on the Fermilab site and also to a 5 kTon far detector 735 km away in the Soudan mine in northern Minnesota. The experiment has now had several years of running with millions of events in the near detector and hundreds of events recorded in the far detector. I will report on the recent results from this experiment which include precise measurement of $|\Delta m^{2}_{32}|$, analysis of neutral current data to limit the component of sterile neutrinos, and the search for $\nu_{\mu}\to\nu_{e}$ conversion. The focus will be on the analysis of data for $\nu_{\mu}\to\nu_{e}$ conversion. Using data from an exposure of $3.14\times 10^{20}$ protons on target, we have selected electron type events in both the near and the far detector. The near detector is used to measure the background which is extrapolated to the far detector. We have found 35 events in the signal region with a background expectation of $27\pm 5(stat)\pm 2(syst)$. Using this observation we set a $90\%$ C.L. limit of $\sin^{2}2\theta_{13}<0.29$ for $\delta_{cp}=0$ and normal mass hierarchy. Further analysis is under way to reduce backgrounds and improve sensitivity. Physics Department, Brookhaven National Laboratory Upton, NY 11973, USA E-mail: diwan@bnl.gov April 20, 2009 ## 1 Introduction In the current picture of neutrino oscillations, three flavors of neutrinos are related to three mass states by the Pontecorvo-Maki-Nakagawa-Sakata mixing matrix ?,?). The mixing can be described by two $\Delta m^{2}$ parameters ($|\Delta m^{2}_{32}|$, $|\Delta m^{2}_{21}|$), three mixing angles ($\theta_{23}$, $\theta_{12}$, and $\theta_{13}$) and a CP violating phase ($\delta_{cp}$)?). The oscillation phenomena naturally falls into two domains: the atmospheric neutrino oscillations, and Solar neutrino oscillations ?). The atmospheric neutrino oscillations are well-described by $\nu_{\mu}\rightarrow\nu_{\tau}$ oscillations, with parameters $\sin^{2}2\theta_{23}>0.92$ and $1.9\times 10^{-3}<|\Delta m_{32}^{2}|<3.0\times 10^{-3}~{}{\rm eV}^{2}$ at 90$\%$ C.L ?). The K2K experiment and MINOS have confirmed the atmospheric neutrino oscillations with accelerator beams ?,?) Solar $\nu_{e}\rightarrow\nu_{\mu,\tau}$ oscillations are described by $\sin^{2}2\theta_{12}=0.86^{+0.03}_{-0.04}$ and $\Delta m_{21}^{2}=8.0^{+0.4}_{-0.3}\times 10^{-5}~{}{\rm eV}^{2}$ are also consistent with multiple observations ?,?), and are confirmed by disappearance of reactor $\bar{\nu}_{e}$?). As yet, very little is known about either $\theta_{13}$ or $\delta_{cp}$, although lack of observed disappearance of reactor $\bar{\nu}_{e}$ over a few km baseline?) has shown that $\theta_{13}$ must be small: $\sin^{2}2\theta_{13}<0.19$ at $90\%$ C.L. Furthermore, the sign of $|\Delta m^{2}_{32}|$ (or the ordering of the mass eigenstates) is unknown. The sign of $\Delta m^{2}_{12}$ is known using the strong matter effects that must be considered when analyzing neutrinos from the Sun. Determination of the unknowns in neutrino mixing needs further experiments in the oscillation range of $|\Delta m^{2}_{32}|$ for conversion of muon and electron type neutrinos into each other. For our present discussion, it is useful to exhibit an approximate analytic formula for the oscillation of $\nu_{\mu}\to\nu_{e}$ for 3-generation mixing obtained with the simplifying assumption of constant matter density ?,?). Assuming a constant matter density, the oscillation of $\nu_{\mu}\rightarrow\nu_{e}$ in the Earth for 3-generation mixing is described approximately by Equation LABEL:qe1. In this equation $\alpha=\Delta m^{2}_{21}/\Delta m^{2}_{31}$, $\Delta=\Delta m^{2}_{31}L/4E$, $\hat{A}=2VE/\Delta m^{2}_{31}$, $V=\sqrt{2}G_{F}n_{e}$. $n_{e}$ is the density of electrons in the Earth. Recall that $\Delta m^{2}_{31}=\Delta m^{2}_{32}+\Delta m^{2}_{21}$. Also notice that $\hat{A}\Delta$, which has absolute value of $LG_{F}n_{e}/\sqrt{2}$, is sensitive to the sign of $\Delta m^{2}_{31}$. $\displaystyle P(\nu_{\mu}\rightarrow\nu_{e})$ $\displaystyle\approx$ $\displaystyle\sin^{2}\theta_{23}{\sin^{2}2\theta_{13}\over(\hat{A}-1)^{2}}\sin^{2}((\hat{A}-1)\Delta)$ $\displaystyle+\alpha{\sin\delta_{CP}\cos\theta_{13}\sin 2\theta_{12}\sin 2\theta_{13}\sin 2\theta_{23}\over\hat{A}(1-\hat{A})}\sin(\Delta)\sin(\hat{A}\Delta)\sin((1-\hat{A})\Delta)$ $\displaystyle+\alpha{\cos\delta_{CP}\cos\theta_{13}\sin 2\theta_{12}\sin 2\theta_{13}\sin 2\theta_{23}\over\hat{A}(1-\hat{A})}\cos(\Delta)\sin(\hat{A}\Delta)\sin((1-\hat{A})\Delta)$ $\displaystyle+\alpha^{2}{\cos^{2}\theta_{23}\sin^{2}2\theta_{12}\over\hat{A}^{2}}\sin^{2}(\hat{A}\Delta)$ For anti-neutrinos, the second term in Equation LABEL:qe1 has the opposite sign. It proportional to the CP violating quantity $\sin\delta_{CP}$. An accelerator experiment using high energy neutrinos, a sufficiently long baseline, and the ability to detect $\nu_{\mu}\to\nu_{e}$ conversion with low backgrounds and high statistics, has sensitivity to all four terms in Equation LABEL:qe1. The first term dominates the sensitivity to the unknown parameter $\theta_{13}$. MINOS is the first high energy accelerator experiment so far to have sensitivity to more than the first term in Equation LABEL:qe1. In the following we describe an analysis of the MINOS data to reduce backgrounds to allow the observation of $\nu_{\mu}\to\nu_{e}$. ## 2 MINOS beam and detector The MINOS detectors ?) and the NuMI beam line ?) are described elsewhere. In brief, NuMI is a conventional two-horn-focused neutrino beam with a 675 m long decay tunnel. The neutrino beam goes through the Earth to upper Minnesota over a distance of 735 km to the far detector. The horn current and position of the hadron production target relative to the horns can be configured to produce different $\nu_{\mu}$ energy spectra. In figure 1 we show the spectrum of all $\nu_{\mu}$ events in the fiducial volume for the horn-on and horn-off configurations. Several beam configurations with different mean energies have been used for studying backgrounds and systematics: in particular, the horn- off configuration has been particularly useful for the $\nu_{e}$ search. The high energy, $\sim 5-10GeV$, obtained by moving the production target, as well as intermediate energy configurations have been used for the analysis of the beam systematics for the muon neutrino disappearance data. Most of the physics data has been in the low energy (horn-on) configuration in which the peak of the spectrum is $\sim 3GeV$. In the low energy configuration, $92.9\%$ of the flux is $\nu_{\mu}$, $5.8\%$ is $\bar{\nu}_{\mu}$ and $1.3\%$ is the $\nu_{e}/\bar{\nu}_{e}$ contamination. Figure 1: (in color) Spectrum of all muon neutrino events in the MINOS near detector fiducial volume for the horn on and horn off configurations. MINOS consists of two detectors: a 0.98 kt Near Detector (ND) 1.04 km from the NuMI target; and a 5.4 kt Far Detector (FD) 735 km from the target. Both are segmented, magnetized calorimeters that permit particle tracking, optimized for neutrino energy range of $1<E_{\nu}<50{\rm GeV}$. The curvature of muons produced in $\nu_{\mu}+\mbox{Fe}\rightarrow\mu^{-}+X$ interactions aaaApproximately 5% of the neutrino interactions occur in aluminum and scintillator. is used for energy determination of muons that exit the detector and to distinguish the $\nu_{\mu}$ component of the beam from the contamination. The energy of muons contained in the detector is measured by their range. The muon and shower energies are added to obtain the reconstructed muon neutrino energy ($E_{reco}=E_{\mu}+E_{h}$) with a resolution given by $\Delta p_{\mu}/p_{\mu}\approx 10\%$ and $\Delta E_{h}/E_{h}\approx 56\%/\sqrt{E_{h}}$. For electron neutrino detection the relevant parameters of the detector concern the calorimetric segmentation. Both the near and far detectors have identical segmentation of 1 inch (1.44 radiation length) steel and 1 cm thick plastic scintillator. Transversely the scintillator is in strips of 4.1 cm width, corresponding to Moliere radius of 3.7 for electromagnetic showers. The scintillator is read by wavelength shifting fibers into multianode PMTs. The scintillator strips range in length from a maximum of 8 meters in the far detector down to $\sim$ 1 m in the near detector. The light yield is on the average $\sim$6 photo-electrons for a minimum ionizing particles. Although the near and far detectors have identical granularity, there are important differences: the light yield, the type of PMT used (Hamamtsu M16 in the far, and Hamamatsu M64 in the near), the cross talk between channels in the PMTs, and multiplexing of scintillator strips onto the PMT pixels ?). These differences are carefully calibrated using cosmic rays and simulated in the Monte Carlo programs to limit the near and far differences. After electron particle identification and selection cuts as described below, the energy resolution for $\nu_{e}$ events is $\sim 30\%/\sqrt{E}$. ## 3 Data Reduction This note describes results from data recorded between May 2005, and July 2007. Over this period, a total of $3.36\times 10^{20}$ protons on target (POT) were accumulated. A $1.27\times 10^{20}$ POT subset of this exposure (hereafter referred to as Run I) forms the data set from Ref ?). In Run I and for most of the new running period (Run II), the beam line was configured to enhance $\nu_{\mu}$ production with energies 1-5 GeV (the low-energy configuration). An exposure of $0.15\times 10^{20}$ POT was accumulated with the beam line configured to enhance the $\nu_{\mu}$ energy spectrum at 5-10 GeV (the high-energy configuration). The Run II data were collected with a replacement target of identical construction due to failure of the motion system of the first target. The new target was found to be displaced longitudinally $\sim$1 cm relative to the first target, resulting in a 30 MeV shift in the neutrino spectrum. This effect is incorporated in the Monte Carlo simulation, and the Run I and Run II data sets are analyzed separately to account for this shift. The data reduction has several components: cuts are first applied to remove data from periods of bad detector and beam conditions. After event reconstruction, preselection cuts select events that are enriched in the types of events that are under analysis: negative or positive muons, electrons or neutral currents. These cuts are performed as identically as possible for the near and far detectors. Differences are accounted for in the Monte Carlo. After the preselection, particle identification cuts are applied to extract a pure sample of the events under consideration. The muon and neutral current analysis has been described in detail in previous publications ?,?). For the electron analysis the selected sample of data (the low energy horn on configuration) corresponds to $3.14\times 10^{20}$ protons on target for the far detector. The near detector data was sampled uniformly and scaled to correspond to $10^{19}$ protons on target. Reconstructed events were chosen within the well calibrated parts of the detectors corresponding to fiducial masses of 29 ton and 4 kton for the near and far detectors, respectively, within the 10 $\mu$sec beam pulse gate to reject cosmic ray events. After these cuts cosmics contribute $<0.5$ event background in the final sample. The $\nu_{e}$ preselection cuts selected an initial sample of events with single electromagnetic showers according to the reconstruction algorithm and rejected events with any tracks longer than 25 planes. A second cut examined planes with track-like hits, and eliminated events with more than 16 planes with such hits. After the precuts, the event sample is composed of $\sim 30\%$ $\nu_{\mu}$ CC events in which the muon is too short to be rejected, $\sim 65\%$ NC events, and about $\sim 5\%$ $\nu_{e}$ events from the beam contamination. ## 4 Selection of Electron Neutrinos After preselection, further rejection of neutral current, and muon charged current events is needed. To achieve this rejection we use the short compact nature of the electromagnetic showers compared to the diffuse nature of hadronic showers. We have developed two software algorithms to examine each candidate event and classify it as a potential electron neutrino signal or background. Selection ANN We use the pattern of energy deposition, after eliminating hits with less than 2 photo-electrons, to characterize each event by several parameters. The artificial neural network (ANN) algorithm combines 11 such reconstructed quantities that exhibit signal and background separation. Some of these quantities are the maximum energy fraction in 4 planes, fraction of energy in a 3 strip wide road, the RMS of transverse energy deposition, etc. The output from the ANN is between 0 (background like) and 1 (signal-like). With a cut at 0.7, the efficiency for the signal, after preselection, is expected to be approximately 41%; the expected neutral current and $\nu_{\mu}$CC rejection efficiency is $\sim 92.3\%$ and $\geq 99.4\%$, respectively. Selection LEM The second discrimination technique is a novel approach called Library Event Matching (LEM) selection in which each event candidate is compared to a large library of simulated $\nu_{e}$-CC and NC events. The best 50 library matches are found for each candidate event, by considering the probability that two different energy deposition patterns in the detector originated from the same neutrino interaction. This computationally intensive technique can be carried out because the size of the events is generally small, and all the strip information can be used. Three variables are constructed: the fraction of these matches that are $\nu_{e}$-CC events, the mean hadronic $y$ of the best matches, and the mean fractional charge $q$ matched within those best matches. A likelihood is then formed from these variables as a function of energy. With a cut at 0.65, the efficiency for the signal, after preselection, is expected to be approximately 46%; the expected neutral current and $\nu_{\mu}$CC rejection efficiency is $\sim 92.9\%$ and $\geq 99.3\%$, respectively. The two selection algorithms rely on very different techniques, provide different signal to background ratios, and are sensitive to different systematic uncertainties. Assuming the signal is at the Chooz limit, LEM has the potential to achieve a better signal to background ratio (1:3) compared to ANN (1:4), but it is more sensitive to systematic uncertainties on the relative energy calibrations in the near and far detectors. Both algorithms select predominantly NC events and higher y, $\nu_{\mu}$ CC events. The background consists mainly of deep inelastic scattering events, with nearly half of the background showers containing a single $\pi^{0}$. In the analysis reported here, the ANN selected sample is used to derive the final results, but the LEM selection is examined as a cross check. ## 5 Calculation of Backgrounds The rate and spectrum of events selected as electron like in the near detector are used to predict the number of background events expected in the far detector. Figure 2 shows the distribution of ANN PID and LEM PID for the near detector data. The plots also show the prediction from the Monte Carlo which deviates from the data. This level of deviation is within the systematic errors due to cross section and hadronic shower modeling uncertainties. The Monte Carlo is based on past data ?) with much lower statistics in the MINOS energy region, and therefore while the Monte Carlo can be used for understanding ratios, and relative changes, the MINOS near data itself must be used to determine the normalization of the background in the far detector. Figure 2: (in color) The ANN PID distribution for the near detector data (left). The LEM PID distribution for the near detector data (right). The plots show the chosen cuts for selection of $\nu_{e}$-like events. The near detector background spectrum has three different components, NC events, $\nu_{\mu}$-CC events and beam $\nu_{e}$ events. At lowest order the far detector background calculation is the near detector event rate (5524 events per $10^{19}$ POT for ANN) multiplied by the energy averaged far/near ratio of the neutrino flux $\sim 1.3\times 10^{-6}$ and the ratio of the fiducial masses $4{\rm kton}/29{\rm ton}$. However, the $\nu_{\mu}$ charged current component of the background is affected by oscillations, and therefore a more sophisticated calculation is needed. For such a calculation we need to separate the background components and extrapolate them separately to the far detector. The far detector will also have a small component from $\nu_{\tau}$ events which will be calculated by Monte Carlo. The components of the background are determined using the horn off data sample recorded in the ND. Applying the $\nu_{e}$ selection to data taken with the focusing horns turned off (horn-off) provides a neutral current enriched sample. The higher mean energy spectrum (see figure 1) of the horn-off sample allows almost complete rejection of the $\nu_{\mu}$ charged current events because the muons tend to be longer. These data are used in conjunction with the standard low energy beam configuration data (horn-on) to extract the individual NC and CC-$\nu_{\mu}$ components of the samples as a function of reconstructed energy. The Monte Carlo is used to calculate the ratios $r_{NC}$ and $r_{CC}$, which are the ratios of the horn-off to horn-on configurations for NC or CC events, respectively. An additional input from the Monte Carlo is the small contamination of $\nu_{e}$ events in the beam. With this information a calculation is performed for every energy bin to extract the CC and NC composition in both horn on and horn off spectra. Figure 3 shows the final result for the ANN selection. Integrating over the energy spectrum, the ND background is 57$\pm$5% NC, 32$\pm$7% $\nu_{\mu}$-CC and 11$\pm$3% intrinsic beam $\nu_{e}$-CC events. The errors on the NC and $\nu_{\mu}$-CC components arise from the statistics of the horn-off data and systematics on the ratios; the uncertainty on the beam $\nu_{e}$-CC includes systematic errors from the beam flux, cross-section and selection efficiency for electrons. Figure 3: (in color) Separation of the types of backgrounds in the near detector data. A calculation is performed using the horn-off data which is enriched in NC events because of the higher energy neutrino spectrum (see text). Large fraction of the error is due to the statistics of the horn-off sample. This is for the ANN selection, results are similar for the alternate selection (LEM). After decomposing the Near Detector energy spectrum into its background components, each background spectrum is multiplied by the ratio of the Far to Near ratio from the MC simulation for each component to provide a prediction of the FD spectrum for that component. The far/near ratios are shown in figure 4 for the ANN selection. The MC simulations take into account differences in the spectrum of events at the ND and FD due to the beam line geometry as well as possible differences in detector calibrations and topological response. Oscillations are included when predicting the $\nu_{\mu}$-CC component. The smaller $\nu_{\tau}$-CC and beam $\nu_{e}$-CC components are calculated by Monte Carlo using the expected energy spectrum in the FD. All background components are then added together and summed over the energy range to provide the total predicted background in the Far Detector. The detailed modeling of all far/near differences change the background prediction from the lowest order by $\sim$10%. We expect a total background of 26.6 events for the ANN selection, of which 18.2 are NC, 5.1 are $\nu_{\mu}$-CC, 2.2 are beam $\nu_{e}$ and 1.1 are $\nu_{\tau}$ for $3.14\times 10^{20}$ POT bbbUsing $\Delta m^{2}_{32}$=$2.43\times 10^{-3}{\rm eV^{2}}$, $\sin^{2}2\theta_{23}=1.0$, and $\sin^{2}2\theta_{13}=0.$. With LEM, we expect 21.4 background events, with 14.8 NC, 2.9 $\nu_{\mu}$-CC, 1.1 beam $\nu_{e}$ and 2.7 $\nu_{\tau}$. Figure 4: (in color) Monte Carlo calculation of the far/near ratios for NC and CC background components. The calculation includes effects of beamline geometry (including the $1/r^{2}$ loss), fiducial mass, difference in spetra, detector calibrations, and differences in the analysis efficiencies. Plots are similar for the alternate selection (LEM). The effects of systematic errors were evaluated by generating modified MC samples, and quantifying the change in the number of predicted background events in the Far Detector using Far to Near ratios from the modified samples relative to the unmodified case. Many uncertainties, including those that affect neutrino interaction physics, shower hadronization, intranuclear re- scattering, and absolute energy scale errors affect the events in both detectors in a similar manner and largely cancel. Other effects give rise to Far/Near differences such as relative event rate normalization, calibration errors, reconstruction differences between the detectors and low level modeling of each detector. The individual systematic errors are added in quadrature along with the systematic error arising from the decomposition of the background sources in the ND to give an overall systematic error of 7.3% on the number of background events selected with the ANN selection. The LEM selection is more sensitive to uncertainties in the PMT gains, relative energy calibration and crosstalk. The total systematic error on the number of background events selected by the LEM technique is 12.0%. ### 5.1 Examination of events outside the signal region and other checks Three main checks are performed by utilizing an independent data set obtained from $\nu_{\mu}$ charged current events in which the muon is removed in software and the remaining hadronic shower is analyzed as if it is a complete neutrino event. This procedure is carried out on data and MC and the $\nu_{e}$ selections are applied to both. The discrepancy between muon-removed data and MC simulation is similar to that found in the standard sample as a function of reconstructed energy and of many different reconstructed shower topology variables used in the selections. In the first check, the muon-removed data is used to obtain the relative contributions of the background components present in the ND data spectrum. The number of selected NC events in the MC simulation of the standard sample is scaled in each energy bin by the ratio of the number of events in the muon- removed data to the muon-removed simulation. Once the number of NC events is determined, the number of $\nu_{\mu}$-CC events selected in each reconstructed energy bin in the data is determined using $N_{CC}=N^{data}_{total}-N_{NC}-N_{\nu_{e}}$, in which the number of beam $\nu_{e}$ events are obtained from the MC. The background components as derived from the muon-removed sample agree well with those obtained from the horn-off method. In the second check, we treat the muon removed data from the near and far detectors as if they are real events and perform a complete analysis. From the near data we create a prediction for the far detector and count the number in the far detector. Using this procedure we predicted $29\pm 5(stat)\pm 2(syst)$ events for the ANN selection and observed 39 events. For the LEM selection the prediction was $17\pm 4(stat)\pm 2(stat)$ and the observation was 25. The observed excess in this sample, which contains no electron signal events, was a cause of concern, however, upon examination of the full distribution with and without the particle ID cut, it was considered likely to be a statistical fluctuation. This issue will be explored with the larger data sample being acquired at this time. In the third check, we estimate the efficiency for selecting $\nu_{e}$-CC events. We use the sample of muon removed events and embed a simulated electron of the same momentum as the removed muon. Test beam measurements indicate that electrons are well simulated in the MINOS detectors. Data from the test beam ?) was analyzed using the same selection cuts and agrees with Monte Carlo within 2.6% for ANN and 2.2% for LEM. sxs Comparisons between muon-removed data and simulated samples of events with embedded electrons indicate that the selection efficiency of $\nu_{e}$ signal events is well modeled by the MC. The algorithms focus on the EM core of the shower and are not affected by hadronic shower modeling discrepancies. The difference between the data and the MC is used as a correction to the signal selection efficiency and it is -0.3% for ANN and -5.3% for LEM. The selection efficiency of the ANN selection is calculated to be 41.4$\pm$1.4% and for LEM is 45.2$\pm$1.5%. The prediction of the backgrounds in the FD and the systematic uncertainties on that prediction were established before examining the data in the FD. Some additional checks were performed before opening the signal region. The number of events passing the preselection cuts, but failing the $\nu_{e}$-CC selection cuts were compared to the expectation. In the FD data, 146 events were observed below the ANN selection cut, with an expectation of $132\pm 12{\rm(stat)}\pm 8{\rm(syst)}$. The events below the LEM cut totaled 176 events compared to an expectation of $157\pm 13{\rm(stat)}\pm 3{\rm(syst)}$. Both observations deviate from the background prediction by approximately $1\sigma$ assuming no signal events in this part of the data. ## 6 Results for $\nu_{\mu}\to\nu_{e}$ After examining the sideband data sets, we proceeded to count the number of events passing the predetermined selection cut. We observe $35$ events in the FD when using the $\nu_{e}$ selection based on the ANN algorithm, with a background expectation of $27\pm 5{\rm(stat.)}\pm 2{\rm(syst.)}$. With LEM (the secondary selection) we observe $28$, with a background expectation of $22\pm 5{\rm(stat.)}\pm 3{\rm(syst.)}$. The distributions are shown in Fig. 5 and 6. Figure 5: (in color) Distribution of far detector events for the ANN PID. Left shows the ANN PID distribution. Right shows the energy distribution after the PID cut. The plots below show the data minus the background prediction with the expected distribution of the signal if all the excess is interpreted as signal. Figure 6: (in color) Distribution of far detector events for the LEM PID. Left shows the LEM PID distribution. Right shows the energy distribution after the PID cut. The plots below show the data minus the background prediction with the expected distribution of the signal if all the excess is interpreted as signal. Figure 7 shows the 90% confidence level interval in the $\sin^{2}2\theta_{13}$ and $\delta_{CP}$ plane for each mass hierarchy using our observation for ANN PID. To set this limit we have used only the total observed number of events; detailed fitting of the data distributions was not performed for this result. We use the current best fit value of $|\Delta m^{2}_{32}|$=2.43$\times 10^{-3}$ ${\rm eV^{2}}$ and $\sin^{2}\left(2\theta_{23}\right)$=1.0 for this calculation. Fluctuations (Poisson) and systematic effects (Gaussian) are incorporated via the Feldman-Cousins approach ?). The oscillation probability is computed using a full 3-flavor neutrino mixing framework that includes matter effects. Figure 7: The 90% confidence interval in the $\sin^{2}\left(2\theta_{13}\right)$ and $\delta_{CP}$ plane using the ANN PID results. Black lines show the best fit to our data in both the normal hierarchy (solid) and inverted hierarchy (dotted). Blue (red) lines show the 90 C.L. boundaries for the normal (inverted) hierarchy. ## 7 Updates to MINOS measurement of $\nu_{\mu}$ disappearance MINOS has recently reported updated measurements of $\nu_{\mu}$ disappearance ?) on the same data set that was described above (the high energy spectrum data was also included). We observed 848 $\nu_{\mu}$-CC events in the far detector across the energy range of 0 to 120 GeV compared to the expectation of $1065\pm 60(syst)$. The observed spectrum is shown in figure 8. The same figure also shows the confidence interval in the $\sin^{2}2\theta_{23}$ versus $|\Delta m^{2}_{32}|$ plane. We obtain $|\Delta m^{2}_{32}|=2.43\pm 0.13\times 10^{-3}eV^{2}$ at 68 % C.L. and the mixing angle of $\sin^{2}2\theta_{23}>0.90$ at 90% C.L. At present time the measurement of $|\Delta m^{2}_{32}|$ is dominated by MINOS and the measurement of the mixing angle is dominated by Super-Kamiokande. Figure 8: (in color) Measurement of MINOS for the disappearance of muon neutrinos. While the disappearance of $\nu_{\mu}$ from the atmosphere and the NuMI/MINOS beam experiment is largely explained by 3 generation neutrino mixing with $\nu_{\mu}\to\nu_{\tau}$ as the mechanism, any small admixture of sterile neutrinos is still an experimental issue. MINOS performed a search for disappearance of active neutrinos using neutral current interactions ?). The final spectrum of neutral current events and the prediction based on near detector data is shown in figure 9. No anomalous depletion in the reconstructed energy spectrum is observed. Assuming oscillations occur at a single mass-squared splitting, a fit to the neutral- and charged-current energy spectra limits the fraction of $\nu_{\mu}$ oscillating to a sterile neutrino to be below 0.68 at 90% confidence level. Electron neutrinos can constitute a background to the neutral current analysis, therefore any possible contribution from $\nu_{e}$ appearance at the current experimental bound leads to a less stringent limit. Figure 9: (in color) Measurement of Neutral Current spectrum in MINOS. ## 8 Conclusions In summary, we report the first results of a search for $\nu_{e}$ appearance in the MINOS experiment. The observed rate of events in the Far Detector after $\nu_{e}$ selection for $3.14\times 10^{20}{\rm\,POT}$ is consistent with the background expectation within 1.5 standard deviations. For this data set, assuming $|\Delta m^{2}_{32}|$=2.43$\times 10^{-3}$ ${\rm eV^{2}}$, $\sin^{2}\left(2\theta_{23}\right)$=1.0, and $\delta_{CP}=0$, we set an upper limit of $\sin^{2}(2\theta_{13})<0.29$ at 90% C.L. for the normal hierarchy and $\sin^{2}(2\theta_{13})<0.42$ for the inverted hierarchy. ## 9 Acknowledgements This was prepared for the proceedings of the XIII International Workshop on Neutrino Telescopes at the Istituto Veneto di Scienze, Lettere ed Arti in Venice held on March 10-13, 2009. The presentation was on behalf of the MINOS collaboration. This work was supported by the US Department of Energy under contract number DE-AC02-98CH10886. ## References * [1] B. Pontecorvo, JETP 34, 172 (1958). * [2] Z. Maki, M. Nakagawa, and S. Sakata, Prog. Theor. Phys. 28, 870 (1962). * [3] W.M. Yao et al., J. Phys. G 33, 1 (2006). * [4] Y. Ashie et al., Phys. Rev. Lett. 93, 101801 (2004); Phys. Rev. D71, 11 2005 (2005). * [5] M.H. Ahn et al, Phys Rev D 74 072003 (2006). * [6] D.G. Michael et al., Phys. Rev. Lett. 97, 191801 (2006); * [7] J. Hosaka et al., Phys. Rev. D73, 112001 (2006). * [8] S.N. Ahmed et al., Phys. Rev. Lett. 92, 181301 (2004). * [9] T. Araki et al., Phys. Rev. Lett. 94, 081801 (2005). * [10] M. Apollonio et al., Eur. Phys. J., C27, (2003)331. * [11] M. Freund, Phys.Rev. D64 (2001) 053003; M. Freund, P. Huber, M. Lindner, Nucl.Phys. B615 (2001) 331-357; * [12] A. Cervera, et al., Nucl. Phy. B579(2000) 17. * [13] D.G. Michael et al., Nucl. Instrum. Meth. A596:190-228, 2008 * [14] S. Kopp, Proc. 2005 IEEE Part. Accel. Conf., May 2005, Fermilab-Conf-05-093-AD and arXiv:physics/0508001. * [15] P. Adamson et al, Phys. Rev. D77, 072002 (2008). * [16] P. Adamson et al., Phys. Rev. Lett 101: 221804, 2008. * [17] H. Gallagher, Nucl. Phys. B (Proc. Suppl.) 112, 188 (2002); update at arXiv:0806.2119 (2008). * [18] P. Adamson et al., Nucl. Inst. & Meth. A556, 119 (2006). * [19] P. Adamson et al., Phys. Rev. Lett 101, 131802, 2008.
arxiv-papers
2009-04-23T19:15:27
2024-09-04T02:49:02.109581
{ "license": "Public Domain", "authors": "Milind V. Diwan", "submitter": "Milind Vaman Diwan", "url": "https://arxiv.org/abs/0904.3706" }
0904.3797
# Internet Traffic Periodicities and Oscillations: A Brief Review Reginald D. Smith Bouchet-Franklin Research Institute, PO Box 10051, Rochester, NY 14610 rsmith@bouchet-franklin.org (April 23, 2009) ###### Abstract Internet traffic displays many persistent periodicities (oscillations) on a large range of time scales. This paper describes the measurement methodology to detect Internet traffic periodicities and also describes the main periodicities in Internet traffic. ###### keywords: internet traffic, packets, FFT, wavelets, periodicities ††journal: Computer Networks ## 1 Introduction Internet traffic has exploded in the last fifteen years as an area of intense theoretical and experimental research. As the largest engineered infrastructure and information system in human history, the Internet’s staggering size and complexity are reinforced by its decentralized and self- organizing structure. Using packets of encapsulated data and a commonly agreed protocol suite, the Internet has far outgrown its origins as ARPANET whose traffic has demanded new models and ways of thinking to understand and predict. Amongst the earliest discoveries were the researches of Leland and Wilson [1] who identified the non-Poisson nature of Internet traffic. This was followed by the seminal paper of Leland, Taqqu, Willinger, and Wilson [2] which proved that Internet packet interarrival times are both self-similar and portray long-range dependence. Though self-similarity is present at all time scales, it is most well-defined when traffic is stationary, an assumption that can only last a few hours at the most. The lack of stationarity on long time scales is due to one of the most widely known periodicities (or oscillations) in Internet traffic, the diurnal cycle with 12 and 24 hour peaks. Internet periodicities are not new and have been well-studied since the earliest days of large-scale measurements of packet traffic, however, they rarely receive primary attention in discussions of traffic and are often mentioned only as an aside or a footnote. Gradually, however, they are gaining more attention. This new area of research has been dubbed _network spectroscopy_ [3] or _Internet spectroscopy_. In this paper, they will take front and center as the most important periodicities, as well as the techniques to measure them, are described. ## 2 Detection Methodologies Identifying periodicities in Internet traffic is, in general, not markedly different from standard spectral analysis of any time series. The same cautions apply with sampling rates and the Nyquist theorem to determine the highest identifiable frequency as well as to be aware of possible aliasing. In addition, the sampling period is important due to the large ranges of magnitudes the periods of Internet periodicities occupy. The standard method is covered in [4, 5]. A continuous time series is collected and binned with a sampling rate $p$ where the number of packets arriving every $p$ interval seconds are counted. Next, to remove the DC component of the signal, every time step has the mean of the entire time series subtracted from it. Next you calculate the autocovariance (ACVF) of the adjusted time series. where for a time series of $N$ sampling periods (total sampling time $pN$) the ACVF, $c$ at lag, $k$ is defined as $c(k)=\sum^{N-k-1}_{t=0}(X(t)-\overline{X})(X(t+k)-\overline{X})$ (1) with a typical lag range chosen of $0<k<N/2$. Finally, a Fourier transform is taken of the ACVF with maximum lag $M$ and the periodogram created from the absolute value (amplitude) of the Fourier series $P(f)=\left|\sum^{M-1}_{k=0}c(k)e^{-i2\pi fk}\right|$ (2) A resulting periodogram (see figure 1) has several typical features. First, low frequency $1/f$ noise can be present, again testifying to the self-similar nature of the traffic. This can sometimes obscure low-frequency periodicities in the data. Second, are any periodicities, their harmonics, and occasionally even small peaks perhaps representing nonlinear mixing of a sort between two periodicities, often with periods of different orders of magnitude. ### 2.1 Wavelet methods Given the nonstationary nature of Internet traffic and the frequent presence of transients, methods based on the Fourier transform can only given an incomplete view of the periodic dynamics of Internet traffic. In particular, especially for rapidly changing periodicities such as those caused by RTT of flows, periodicities may only be temporary before shifting, disappearing, or being displaced. Wavelet methods have been developed in great theoretical and practical detail in the last several decades to allow for the analysis of a signal’s periodic nature on multiple times scales. Wavelet techniques will not be covered here in detail though there are many good references [6, 7, 8, 9]. The continuous wavelet function on the signal $x(t)$, here an Internet traffic trace, is given for a mother wavelet, $\psi$ with $a$ representing a stretching coefficient (scale) and $b$ represents a translation coefficient (time) $T(a,b)=\frac{1}{\sqrt{a}}\int^{\infty}_{-\infty}x(t)\psi^{*}\left(\frac{t-b}{a}\right)dt$ (3) In figure 1 alongside the FFT of the signal is a contour plot generated by plotting $T(a,b)$ using the Morlet mother wavelet over 12 octaves. One of the key advantages of wavelets is seeing the periodic variation over time. The y-axis represents the period of the signal represented and the x-axis is the time of the traffic trace in seconds. A first feature is the continuous strong periodicity at 30 seconds as a result of the update packets. A second and more intriguing feature are the inverse triangular ‘bursts’ of high frequency traffic with an average period close to one hour. These are update packets generated by route flapping, which are damped for a maximum period of one hour according to the most common presets for route flapping damping. The packets with the most pernicious flapping routers announcing withdrawals were removed in the third figure where the hourly oscillation largely disappears. Figure 1: A FFT periodogram and two wavelet contour plots of the ACVF of BGP update packet traffic on node rrc00 on the RIPE Routing Information Service (RIS) BGP update traffic on February 1, 2009 [11]. In the FFT plot, the strong peaks are due to the 30s BGP KEEPALIVE update packet messages with subsequent harmonics. The contour plot is based on a continuous wavelet transform using the Morlet wavelet for a 20,000s (5.5 hour) trace starting at 0000 GMT. The strong periodicity at 30s is evident, as well as the periodic bursts of high frequency traffic below it due to route flapping and the one hour periodic maximum suppression by route flap damping. The peaks correspond to the minimum penalty for the flapping route while the troughs correspond to the maximum penalty. In the third figure, the contour plot is recreated with the signal omitting packets that announce a withdrawal of one of the top 5 (most likely flapping) withdrawn IP addresses. The high frequency flapping is still present but not the coordinated hourly damping as in the second figure. ## 3 Traffic oscillations/periodicities There are a plethora of traffic periodicities that represent oscillations in traffic over periods of many orders of magnitude from milliseconds to weeks. Broido, et. al. [10] believe there are thousands of periodic processes in the Internet. The sheer range of the periods of the periodicities means that many times, only certain periodicities appear in packet arrival time series due either to the sampling rate or sampling duration. This is one of the reasons why a comprehensive description of all Internet periodicities has rarely been done. Internet periodicities have origins which broadly correspond to two general causes: first, there are protocol or data transmission driven periodicities. These range on the time scale from microseconds to seconds, or in rare cases, hours. These periodicties can again be broken down into two smaller groups, periodicities driven by packet data transmission on the link layer and periodicities driven by protocol behavior on the transport layer. Second are application driven periodicities. Their periods range on the time scale of minutes to hours to weeks, and quite possibly longer. These are all generated from activities at the application layer, either by automated applications such as BGP or DNS or user driven applications via HTTP or other user application protocols. The major known periodicities are summarized in figure 2 and will be described in detail in the next two subsections. Figure 2: A rough breakdown of the major periodicities in Internet traffic showing the responsible protocols and their period in seconds. The periodicities span over 12 orders of magnitude and different protocol layers tend to operate on different time scales. ### 3.1 Key Periodicities: Link and Transport Layer A key link level periodicity due to the throughput of packet transmission [12, 5] of a link and can be deduced from the equation: $f=\frac{T}{s}$ (4) Where $T$ is the average throughput of the link and $s$ is the average packet size at the link level. The base frequency is the rate of packet emission across the link at the optimum throughput and packet size. The base frequency for data transmission is given by $f_{max}=\frac{B}{MTU}$ (5) where $B$ is the bandwidth of the link and the packet size is the MTU packet size. Therefore for 1 Gigabit, 100 Mbps, and 10 Mbps Ethernet links with MTU sizes of 1500 bytes, the theoretical optimal base frequencies are 83.3 kHz, 8.3 kHz, and 833 Hz respectively. Other technologies have their own specific periods such as SONET frames identified with periods of 125$\mu$s[3]. These are among the most difficult traffic to identify due to the need for high sampling rates of packet traffic. At a minimum, a microsecond sampling rate is usually necessary to make sure you can identify all link-layer periodicities. It is rare that both link layer and other periodicities are displayed together since the massive memory overhead of recording the timestamp of almost every packet is necessary. The link layer periodicities are receiving much of the attention in the research, however, due to their possible use in inferring bottlenecks and malicious traffic. The main practical applications being researched are inferring network path characteristics such as bandwidth, digital fingerprinting of link transmissions, and detecting malicious attack traffic by changes in the frequency domain of the transmission signal. [13, 14] use analysis of the distribution of packet interarrival times to infer congestion and bottlenecks on network paths upstream. In [5, 4, 15, 16, 17, 18] various measures of packet arrival distributions, particularly in the frequency domain, are being tested to recognize and analyze distributed denial of service or other malicious attacks against computer networks. Inspecting the frequency domain of a signal can also reveal the fingerprints of the various link level technologies used along the route of the signal as is done in [10, 19]. The transport layer also produces its own periodicities. In particular, both TCP and ICMP often times operate bidirectional flows with the interarrival of ACK packets corresponding to the RTT between the source and destination [10, 15, 20], often in the range of 10 ms to 1 s. Instead of just frequency peaks there usually are wide bands corresponding to the dominant RTT in the TCP or ICMP traffic measured. According to most equations of TCP throughput such as that by Semke et. al. [21] the throughput of TCP depends inversely on the RTT so that the TCP RTT periodicities often can give a relative estimate of throughput of the flows producing them and the distribution of RTT for flows in the traffic trace. Exact estimates are difficult though since packet loss and maximum segment size are usually unknown. ICMP, though a connectionless protocol also has echo replies which can also appear as periodicities if they are persistent through time. ### 3.2 Key Periodicities: Application Layer Once you rise to periods above one second, application layer periodicities dominate the spectrum. These come from a variety of sources including software settings and human activity. At the low end are the 30s and sometimes 60s periodicities in BGP traffic. The 30s oscillation, shown in figure 1, is the most common set time for routers to advertise their presence and continuing function to neighboring routers using KEEPALIVE BGP updates. These are the strongest periodicities present in BGP traffic. Large-scale topological perturbations such as BGP storms can also produce transient periodicities in traffic such as large-scale route flapping which is shown in figure 1. UDP traffic periodicities are rarely consistent and large-scale and are generally generated by DNS, the largest application using UDP. Claffy et. al. identified periodicities of DNS updates transmitted with periods of 75 minutes, 1 hour, and 24 hours due to default settings in Windows 2000 and XP DNS software[3]. They warn that such software settings could possibly cause problems in Internet traffic if they lead to harmful periods of traffic oscillations and congestion. Large numbers of usually source and software specific UDP periodicities were also identified by Brondman [22]. User traffic driven periodicities were the first known and most easily recognized. The first discovered and most well-known periodicity is the 24 hour diurnal cycle and its companion cycle of 12 hours. These cycles have been known for decades and reported as early as 1980 and again in 1991 as well as in many subsequent studies[23, 24, 25, 26, 27, 28, 29]. This obviously refers to the 24 hour work-day and its 12-hour second harmonic as well as activity from around the globe. The other major periodicity from human behavior is the week with a period of 7 days [25, 26, 30] and a second harmonic at 3.5 days and barely perceptible third harmonic at 2.3 days. There are reports as well of seasonal variations in traffic over months [12], but mostly these have not been firmly characterized. Long period oscillations have been linked to possible causes of congestion and other network behavior related to network monitoring [27, 28]. One note is that user traffic driven periodicities tend to appear in protocols that are directly used by most end users. The periodicities appear TCP/IP not UDP/IP and are mainly attributable to activity with the HTTP and SMTP protocols. They also often do not appear in networks with low traffic or research aims such as the now defunct 6Bone IPv6 test network. ## 4 Discussion These periodicities range in roughly 12 orders of magnitude. However, they share one particular characteristic. Namely, the longer the period of the periodicity, the less likely it is to betray variations in period or phase over time. For example, the diurnal and weekly periodicities have their roots in human activity and are based on the Earth’s rotation and the seven week social convention. These do not vary appreciably over long-time periods and since they help drive human behavior which drives traffic, these could be considered the most permanent of all periodicities and this is partially why these were the earliest known. The BGP KEEPALIVE updates and DNS updates are based on commonly agreed software settings. These also do not vary appreciably and only change by user preference. However, the transport and link layer periodicities are much more variable. The RTT of TCP or ICMP varies depending on the topological distance and congestion between two points. Hardly, stable variables. Assuming the bandwidth of the link layers is steady, the average packet size, which depends on both the maximum transmission unit (MTU) software settings can cause large variability to be seen in actual network traffic. Understanding the range of these periodicities is more important than memorizing a distance frequency value since it is always different depending on the time and place of measurement. Internet periodicities will likely play a large role in full characterization and simulation of Internet traffic. Hopefully further work will put them in their rightful place as fundamental phenomena of data traffic. ## References * [1] WE Leland, & DV Wilson, High time-resolution measurement and analysis of LAN traffic: Implications for LAN interconnection, Proceedings IEEE lNFOCOM ’91, (1991) 1360-1366. * [2] WE Leland, MS Taqqu, W Willinger, & DV Wilson, On the self-similar nature of Ethernet traffic (extended version), IEEE/ACM Transactions on Networking, 2 1, (1994) -151. * [3] A Broido, E Nemeth, & KC Claffy, Spectroscopy of DNS Update Traffic, ACM SIGMETRICS 2003, 31 (2003) 320-321. * [4] A Hussain, J Heidemann, & C Papadopoulos, A framework for classifying denial of service attacks in Proceedings of the ACM SIGCOMM’2003. Karlsruhe, Germany, August 2003, (2003) 99-110. * [5] X He, C Papadopoulos, J Heidemann, U Mitra, U Riaz, U & A Hussain, Remote detection of bottleneck links using spectral and statistical methods, Computer Networks, 53 (2009) 279-298. * [6] DB Percival & AT Walden, Wavelet Methods for Time Series Analysis, Cambridge University Press, New York, 2000. * [7] Y Nievergelt, Wavelets Made Easy Springer, Berlin, 1999\. * [8] G Kaiser, A Friendly Guide to Wavelets Springer, Berlin, 1994. * [9] P Addison, The Illustrated Wavelet Transform Handbook, CRC Press, Boca Raton, 2002. * [10] A Broido, R King, E Nemeth, KC Claffy, Radon Spectroscopy of Packet Delay, in Proceedings of the IEEE High-Speed Networking Workshop 2003. San Diego, CA (2003). * [11] RIPE Network Co-ordination Centre - Routing Information Service (RIS) http://www.ripe.net/ris/ * [12] X He, C Papadopoulos, J Heidemann, & A Hussain, Spectral Characteristics of Saturated Links, University of Southern California Technical Report, USC-CSD-TR-827 (2004). * [13] D Katabi & C Blake, Inferring Congestion Sharing and Path Characteristics from Packet Interarrival Times, MIT Technical Report, MIT-LCSTR-828 (2001). * [14] X He, C Papadopoulos, J Heidemann, U Mitra, U Riaz, U & A Hussain, Spectral Analysis of Bottleneck Traffic, University of Southern California Technical Report, USC/CS Technical Report 05-853 (2005). * [15] CM Cheng, HT Kung, & KS Tan, Use of spectral analysis in defense against DoS attacks, in Proceedings of IEEE GLOBECOM ’02, 3 (2002) 2143-2148. * [16] Y Chen & K Hwang, Collaborative detection and filtering of shrew DDoS attacks using spectral analysis, Journal of Parallel and Distributed Computing, 66 (2006) 1137-1151. * [17] A Hussain, J Heidemann, & C Papadopolous, Identification of Repeated Attacks Using Network Traffic Forensics, USC/ISI Technical Report ISI-TR-2003-577b (2004). * [18] L Li & G Lee, DDoS Attack Detection and Wavelets, Telecommunication Systems, 28 (2005) 435-451. * [19] M Coates, A Hero, R Nowak, & B Yu, Internet Tomography, IEEE Signal Processing Magazine, 19 no. 3 (2002) 47-65. * [20] A Broido, Invariance of Internet RTT spectrum, in Proceedings of ISMA Conference, October 2002 (2002). * [21] M Mathis, J Semke, & J Madhavi, The Macroscopic Behavior of the TCP Congestion Avoidance Algorithm, ACM SIGCOMM Computer Communication Review, 27 no. 3 (1997) 67-82. * [22] Grondman, I, Identifying short-term periodicities in Internet traffic, BSc. Thesis, University of Twente (2006). * [23] JF Shoch & JA Hupp, Measured performance of an Ethernet local network, Communications of the ACM, 23 (1980) 711-721. * [24] A Lakhina, K Papagiannaki, ME Crovella, C Diot, E Kolaczyk, & N Taft, Structural analysis of network traffic flows, ACM SIGMETRICS Performance Evaluation Review, 32 (2004) 61-72. * [25] K Papagiannaki, N Taft, Z Zhang, & C Diot, Long-term forecasting of Internet backbone traffic, IEEE Transactions on Neural Networks, 16 (2005) 1110-1124. * [26] M Roughan, A Greenberg, C Kalmanek, M Rumsewicz, J Yates, & Y Zhang, Experience in measuring backbone traffic variability: models, metrics, measurements and meaning, Proceedings of the 2nd ACM SIGCOMM Workshop on Internet Measurement, (2002) 91-92. * [27] A Mukherjee, On The Dynamics and Significance of Low Frequency Components of Internet Load, University of Pennsylvania Technical Reports, MS-CIS-92-83 (1992). * [28] P Owezarski & N Larrieu, Internet Traffic Characterization - An Analysis of Traffic Oscillations, in High Speed Networks and Multimedia Communications edited by MM Freire, P Lorenz, & M Lee, Springer, Berlin, 2004, 96 * [29] HJ Fowler & WE Leland, Local area network characteristics, with implications for broadbandnetwork congestion management, IEEE Journal on Selected Areas in Communications, 19 (1991) 1139-1149. * [30] M Burgess, H Haugerud, S Straumsnes, & T Reitan, Measuring system normality, ACM Transactions on Computer Systems, 20 2, (2002) 125-160.
arxiv-papers
2009-04-24T12:35:01
2024-09-04T02:49:02.117852
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Reginald D. Smith", "submitter": "Reginald Smith", "url": "https://arxiv.org/abs/0904.3797" }
0904.3855
# Exploring Progressions: A Collection of Problems Konstantine Zelator Department of Mathematics and Computer Science Rhode Island College 600 Mount Pleasant Avenue Providence, RI 02908 USA ## 1 Introduction In this work, we study the subject of arithmetic, geometric, mixed, and harmonic progressions. Some of the material found in Sections 2,3,4, and 5, can be found in standard precalculus texts. For example, refer to the books in [1] and [2]. A substantial portion of the material in those sections cannot be found in such books. In Section 6, we present 21 problems, with detailed solutions. These are interesting, unusual problems not commonly found in mathematics texts, and most of them are quite challenging. The material of this paper is aimed at mathematics educators as well as math specialists with a keen interest in progressions. ## 2 Progressions In this paper we will study arithmetic and geometric progressions, as well as mixed progressions. All three kinds of progressions are examples of sequences. Almost every student who has studied mathematics, at least through a first calculus course, has come across the concept of sequences. Such a student has usually seen some examples of sequences so the reader of this book has quite likely at least some informal understanding of what the term sequence means. We start with a formal definition of the term sequence. Definition 1: 1. (a) A finite sequence of $k$ elements, ($k$ a fixed positive integer) and whose terms are real numbers, is a mapping $f$ from the set $\\{1,2,\ldots,k\\}$ (the set containing the first $k$ positive integers) to the set of real numbers $\mathbb{R}$. Such a sequence is usually denoted by $a_{1},\ldots,a_{n},\ldots,a_{k}$. If $n$ is a positive integer between $1$ and $k$, the $n$th term ${\boldmath a}_{\boldmath n}$, is simply the value of the function $f$ at $n$; $a_{n}=f(n)$. 2. (b) An infinite sequence whose terms are real numbers, is a mapping $f$ from the set of positive integers or natural numbers to the set of real numbers $\mathbb{R}$, we write $F:\mathbb{N}\rightarrow\mathbb{R}$; $f(n)=a_{n}$. Such a sequence is usually denoted by $a_{1},a_{2},\ldots a_{n},\ldots$ . The term $a_{n}$ is called the $n$th term of the sequence and it is simply the value of the function at $n$. Remark 1: Unlike sets, for which the order in which their elements do not matter, in a sequence the order in which the elements are listed does matter and makes a particular sequence unique. For example, the sequences $1,\ 8,\ 10,$ and $8,\ 10,\ 1$ are regarded as different sequences. In the first case we have a function $f$ from $\\{1,2,3\\}$ to $\mathbb{R}$ defined as follows: $f:=\\{1,2,3\\}\rightarrow\mathbb{R};\ f(1)=1=a_{1},\ f(2)=8=a_{2}$, and $f(3)=10=a_{3}$. In the second case, we have a function $g:\\{1,2,3\\}\rightarrow\mathbb{R};\ g(1)=b_{1}=8,\ g(2)=b_{2}=10$, and $g(3)=b_{3}=1$. Only if two sequences are equal as functions, are they regarded one and the same sequence. ## 3 Arithmetic Progressions Definition 2: A sequence $a_{1},a_{2},\ldots,a_{n},\ldots$ with at least two terms, is called an arithmetic progression, if, and only if there exists a (fixed) real number $d$ such that $a_{n+1}=a_{n}+d$, for every natural number $n$, if the sequence is infinite. If the sequence if finite with $k$ terms, then $a_{n+1}=a_{n}+d$ for $n=1,\ldots,k-1$. The real number $d$ is called the difference of the arithmetic progression. Remark 2: What the above definition really says, is that starting with the second term $a_{2}$, each term of the sequence is equal to the sum of the previous term plus the fixed number $d$. Definition 3: An arithmetic progression is said to be increasing if the real number $d$ (in Definition 2) is positive, and decreasing if the real number $d$ is negative, and constant if $d=0$. Remark 3: Obviously, if $d>0$, each term will be greater than the previous term, while if $d<0$, each term will be smaller than the previous one. Theorem 1: Let $a_{1},a_{2},\ldots,a_{n},\ldots$ be an arithmetic progression with difference $d,m$ and $n$ any natural numbers with $m<n$. The following hold true: 1. (i) $a_{n}=a_{1}+(n-1)d$ 2. (ii) $a_{n}=a_{n-m}+md$ 3. (iii) $a_{m+1}+a_{n-m}=a_{1}+a_{n}$ Proof: 1. (i) We may proceed by mathematical induction. The statement obviously holds for $n=1$ since $a_{1}=a_{1}+(1-1)d$; $a_{1}=a_{1}+0$, which is true. Next we show that if the statement holds for some natural number $t$, then this assumption implies that the statement must also hold for $(t+1)$. Indeed, if the statement holds for $n=t$, then we have $a_{t}=a_{1}+(t-1)d$, but we also know that $a_{t+1}=a_{t}+d$, since $a_{t}$ and $a_{t+1}$ are successive terms of the given arithmetic progression. Thus, $a_{t}=a_{1}+(t-1)d\Rightarrow a_{t}+d=a_{1}(t-1)d+d\Rightarrow a_{t}+d=a_{1}+d\cdot t\Rightarrow a_{t+1}=a_{1}+d\cdot t$; $a_{t+1}=a_{1}+d\cdot[(t+1)-1]$, which proves that the statement also holds for $n=t+1$. The induction process is complete. 2. (ii) By part (i) we have established that $a_{n}=a_{1}+(n-1)d$, for every natural number $n$. So that $\begin{array}[]{rcl}a_{n}&=&a_{1}+(n-1)d-md+md;\\\ \\\ a_{n}&=&a_{1}+[(n-m)-1]d+md.\end{array}$ Again, by part (i) we know that $a_{n-m}=a_{1}+[(n-m)-1]d$. Combining this with the last equation we obtain, $a_{n}=a_{n-m}+md$, and the proof is complete. 3. (iii) By part (i) we know that $a_{m+1}=a_{1}+[(m+1)-1]d\Rightarrow a_{m+1}=a_{1}+md$; and by part (ii), we have already established that $a_{n}=a_{n-m}+md$. Hence, $a_{m+1}+a_{n-m}=a_{1}+md+a_{n-m}=a_{1}+a_{n}$, and the proof is complete. $\square$ Remark 4: Note that what Theorem 1(iii) really says is that in an arithmetic progression $a_{1},\ldots,a_{n}$ with $a_{1}$ being the first term and $a_{n}$ being the $n$th or last term; if we pick two in between terms $a_{m+1}$ and $a_{n-m}$ which are “equidistant” from the first and last term respectively ($a_{m+1}$ is $m$ places or spaces to the right of $a_{1}$ while $a_{n-m}$ is $m$ spaces or places to the left of $a_{n}$), the sum of $a_{m+1}$ and $a_{n-m}$ remains fixed: it is always equal to $(a_{1}+a_{n})$, no matter what the value of $m$ is ($m$ can take values from $1$ to $(n-1)$). For example, if $a_{1},a_{2},a_{3},a_{4},a_{5}$ is an arithmetic progression we must have $a_{1}+a_{5}=a_{2}+a_{4}=a_{3}+a_{3}=2a_{3}$. Note that $(a_{2}+a_{4})$ corresponds to $m=1$, while $(a_{3}+a_{3})$ corresponds to $m=2$, but also $a_{4}+a_{2}$ corresponds to $m=3$ and $a_{5}+a_{1}$ corresponds to $m=4$. Likewise, if $b_{1},b_{2},b_{3},b_{4},b_{5},b_{6}$ are the successive terms of an arithmetic progression we must have $b_{1}+b_{6}=b_{2}+b_{5}=b_{3}+b_{4}$. The following theorem establishes two equivalent formulas for the sum of the first $n$ terms of an arithmetic progression. Theorem 2: Let $a_{1},a_{2},\ldots,a_{n},\ldots,$ be an arithmetic progression with difference $d$. 1. (i) The sum of the first (successive) $n$ terms $a_{1},\ldots,a_{n}$, is equal to the real number $\left({\displaystyle\frac{a_{1}+a_{n}}{2}}\right)\cdot n$; we write $a_{1}+a_{2}+\cdots+a_{n}={\displaystyle\sum^{n}_{i=1}}a_{i}={\displaystyle\frac{n\cdot(a_{1}+a_{n})}{2}}$. 2. (ii) ${\displaystyle\sum^{n}_{i=1}}a_{i}=\left({\displaystyle\frac{a_{1}+[a_{1}+(n-1)d]}{2}}\right)\cdot n$. Proof: 1. (i) We proceed by mathematical induction. For $n=1$ the statement is obviously true since $a_{1}={\displaystyle\frac{1\cdot(a_{1}+a_{1})}{2}}={\displaystyle\frac{2a_{1}}{2}}$ . Assume the statement to hold true for some $n=k\geq 1$. We will show that whenever the statement holds true for some value $k$ of $n,\ k\geq 1$, it must also hold true for $n=k+1$. Indeed, assume $a_{1}+\cdots+a_{k}={\displaystyle\frac{k\cdot(a_{1}+a_{k})}{2}}$; add $a_{k+1}$ to both sides to obtain $\begin{array}[]{rcl}a_{1}+\cdots+a_{k}+a_{k+1}&=&{\displaystyle\frac{k\cdot a_{1}+a_{k}}{2}}+a_{k+1}\\\ &&\Rightarrow a_{1}+\cdots+a_{k}+a_{k+1}\\\ \\\ &=&{\displaystyle\frac{ka_{1}+ka_{k}+2a_{k+1}}{2}}\end{array}$ $None$ But since the given sequence is an arithmetic progression by Theorem 1(i), we must have $a_{k+1}=a_{1}+kd$ where $d$ is the difference. Substituting back in equation (1) for $a_{k+1}$ we obtain, $\begin{array}[]{rcl}a_{1}+\cdots+a_{k}+a_{k+1}&=&{\displaystyle\frac{ka_{1}+ka_{k}+(a_{1}+kd)+a_{k+1}}{2}}\\\ \\\ \Rightarrow a_{1}+\cdots+a_{k}+a_{k+1}&=&{\displaystyle\frac{(k+1)a_{1}+k(a_{k}+d)+a_{k+1}}{2}}\end{array}$ $None$ We also have $a_{k+1}=a_{k}+d$, since $a_{k}$ and $a_{k+1}$ are successive terms. Replacing $a_{k}+d$ by $a_{k+1}$ in equation (2) we now have $a_{1}+\cdots+a_{k}+a_{k+1}={\displaystyle\frac{(k+1)a_{1}+ka_{k+1}+a_{k+1}}{2}}={\displaystyle\frac{(k+1)a_{1}+(k+1)a_{k+1}}{2}}=(k+1)\cdot{\displaystyle\frac{(a_{1}+a_{k+1})}{2}}$, and the proof is complete. The statement also holds for $n=k+1$. $\square$ 2. (ii) This is an immediate consequence of part (i). Since ${\displaystyle\sum^{n}_{i=1}}a_{i}={\displaystyle\frac{n(a_{1}+a_{n})}{2}}$ and $a_{n}=a_{1}+(n-1)d$ (by Theorem 1(i)) we have, ${\displaystyle\sum^{n}_{i=1}}a_{i}=n\left({\displaystyle\frac{a_{1}+[a_{1}+(n-1)d]}{2}}\right),$ and we are done. $\square$ Example 1: 1. (i) The sequence of positive integers $1,2,3,\ldots,n,\ldots,$ is an infinite sequence which is an arithmetic progression with first term $a_{1}=1$, difference $d=1$, and the $n$th term $a_{n}=n$. According to Theorem 2(i) the sum of the first $n$ terms can be easily found: $1+2+\ldots+n={\displaystyle\frac{n\cdot(1+n)}{2}}$. 2. (ii) The sequence of the even positive integers $2,4,6,8,\ldots,2n,\ldots$ has first term $a_{1}=2$, difference $d=2$, and the $n$th term $a_{n}=2n$. According to Theorem 2(i), $2+4+\cdots+2n={\displaystyle\frac{n\cdot(2+2n)}{2}}={\displaystyle\frac{n\cdot 2\cdot(n+1)}{2}}=n\cdot(n+1)$. 3. (iii) The sequence of the odd natural numbers $1,3,5,\ldots,(2n-1),\ldots$, is an arithmetic progression with first term $a_{1}=1$, difference $d=2$, and $n$th term $a_{n}=2n-1$. According to Theorem 2(i) we have $1+3+\cdots+(2n-1)=n\cdot\left({\displaystyle\frac{1+(2n-1)}{2}}\right)={\displaystyle\frac{n\cdot(2n)}{2}}=n^{2}$. 4. (iv) The sequence of all natural numbers which are multiples of $3\ :\ 3,6,9,12,$ $\ldots,3n,\ldots$ is an arithmetic progression with first term $a_{1}=3$, difference $d=3$ and $n$th term $a_{n}=3n$. We have $3+6+\cdots+3n={\displaystyle\frac{n\cdot(3+3n)}{2}}={\displaystyle\frac{3n(n+1)}{2}}$. Observe that this sum can also be found from (i) by observing that $3+6+\cdots+3n=3\cdot(1+2+\cdots+n)={\displaystyle\frac{3\cdot n(n+1)}{2}}$. If we had to find the sum of all natural numbers which are multiples of $3$, starting with $3$ and ending with $33$; we know that $a_{1}=3$ and that $a_{n}=33$. We must find the value of $n$. Indeed, $a_{n}=a_{1}+(n-1)\cdot d$; and since $d=3$, we have $33=3+(n-1)\cdot 3\Rightarrow 33=3\cdot[1+(n-1)]$; $11=n$. Thus, $3+6+\cdots+30+33={\displaystyle\frac{11\cdot(3+33)}{2}}={\displaystyle\frac{11\cdot 36}{2}}=11\cdot 18=198$. Example 2: Given an arithmetic progression $a_{1},\ldots,a_{m},\ldots,a_{n},\ldots$, and natural numbers $m,n$ with $2\leq m<n$, one can always find the sum $a_{m}+a_{m+1}+\cdots+a_{n-1}+a_{n}$; that is, the sum of the $[(n-m)+1]$ terms starting with $a_{m}$ and ending with $a_{n}$. If we know the values of $a_{m}$ and $a_{n}$ then we do not need to know the value of the difference. Indeed, the finite sequence $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$ is a finite arithmetic progression with first term $a_{m}$, last term $a_{n}$, (and difference $d$); and it contains exactly $[(n-m)+1]$ terms. According to Theorem 2(i) we must have $a_{m}+a_{m+1}+\cdots+a_{n-1}+a_{n}=\frac{(n-m+1)\cdot[a_{m}+a_{n}]}{2}$. If, on the other hand, we only know the values of the first term $a_{1}$ and difference $d$ ( and the values of $m$ and $n$), we can apply Theorem 2(ii) by observing that $\begin{array}[]{rcl}a_{m}+a_{m+1}+\cdots+a_{n-1}+a_{n}&=&\underset{\underset{n\ {\rm terms}}{{\rm sum\ of\ the\ first}}}{\left(\underbrace{a_{1}+a_{2}+\ldots+a_{n}}\right)}\\\ &&-\underset{\underset{(m-1)\ {\rm terms}}{{\rm sum\ of\ the\ first}}}{\left(\underbrace{a_{1}+\ldots+a_{m-1}}\right)}\\\ \\\ {\rm by\ Th.\ 2(ii)}&=&\left(\frac{2a_{1}+(n-1)d}{2}\right)\cdot n\\\ &&-\left(\frac{2a_{1}+(m-2)d}{2}\right)\cdot(m-1)\\\ \\\ &=&\frac{2[n-(m-1)]a_{1}+[n\cdot(n-1)-\cdot(m-2)\cdot(m-1)]d}{2}\\\ \\\ &=&\frac{2(n-m+1)a_{1}+[n(n-1)-(m-2)(m-1)]d}{2}\end{array}$ Example 3: 1. (a) Find the sum of all multiples of $7$, starting with $49$ and ending with $133$. Both $49$ and $133$ are terms of the infinite arithmetic progression with first term $a_{1}=7$, and difference $d=7$. If $a_{m}=49$, then $49=a_{1}+(m-1)d;\ 49=7+(m-1)\cdot 7\Rightarrow\frac{49}{7}=m;\ m=7$. Likewise, if $a_{n}=$ then $133=a_{1}+(n-1)d;\ 133=7+(n-1)7\Rightarrow 19=n$. According to Example 2, the sum we are looking for is given by $a_{7}+a_{8}+\ldots+a_{18}+a_{19}=\frac{(19-7+1)(a_{7}+a_{19})}{2}=\frac{13\cdot(49+133)}{2}=\frac{13\cdot 182}{2}=(13)\cdot(91)=1183$. 2. (b) For the arithmetic progression with first term $a_{1}=11$ and difference $d=5$, find the sum of its terms starting with $a_{5}$ and ending with $a_{13}$. We are looking for the sum $a_{5}+a_{6}+\ldots+a_{12}+a_{13}$; in the usual notation $m=5$ and $n=13$. According to Example 2, since we know the first term $a_{1}=11$ and the difference $d=5$ we may use the formula we developed there: $\begin{array}[]{rcl}a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}&=&\frac{2(n-m+1)a_{1}+[n(n-1)-(m-2)(m-1)]d}{2};\\\ \\\ a_{5}+a_{6}+\ldots+a_{12}+a_{13}&=&\frac{2\cdot(13-5+1)\cdot 11+[13\cdot(13-1)-(5-2)(5-1)]5}{2}\\\ \\\ &=&\frac{2\cdot 9\cdot 11+[(13)(12)-(3)(4)]5}{2}=\frac{198+(156-12)\cdot 5}{2}\\\ \\\ &=&\frac{198+720}{2}=\frac{918}{2}=459\end{array}$ The following Theorem is simple in both its statement and proof but it serves as an effective tool to check whether three real numbers are successive terms of an arithmetic progression. Theorem 3: Let $a,b,c$ be real numbers with $a<b<c$. 1. (i) The three numbers $a,b$, and $c$ are successive of an arithmetic progression if, and only if, $2b=a+c$ or equivalently $b=\frac{a+c}{2}$. 2. (ii) Any arithmetic progression containing $a,b,c$ as successive terms must have the same difference $d$, namely $d=b-a=c-b$ Proof: 1. (i) Suppose that $a,b$, and $c$ are successive terms of an arithmetic progression; then by definition we have $b=a+d$ and $c=b+d$, where $d$ is the difference. So that $d=b-a=c-b$; from $b-a=c-b$ we obtain $2b=a+c$ or $b=\frac{a+c}{2}$. Conversely, if $2b=a+c$, then $b-a=c-b$; so by setting $d=b-a=c-b$, it immediately follows that $b=a+d$ and $c=b+d$ which proves that the real numbers $a,b,c$ are successive terms of an arithmetic progression with difference $d$. 2. (ii) This has already been shown in part (i), namely that $d=b-a=c-b$. Thus, any arithmetic progression containing the real numbers $a,b,c$ as successive terms must have difference $d=b-a=c-b$. Remark 5: According to Theorem 3, the middle term $b$ is the average of $a$ and $c$. This is generalized in Theorem 4 below. But, first we have the following definition. Definition 4: Let $a_{1},a_{2},\ldots,a_{n}$ be a list (or sequence) of $n$ real numbers($n$ a positive integer). The arithmetic mean or average of the given list, is the real number $\frac{a_{1}+a_{2}+\ldots+a_{n}}{n}$. Theorem 4: Let $m$ and $n$ be natural numbers with $m<n$. Suppose that the real numbers $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$ are the $(n-m+1)$ successive terms of an arithmetic progression (here, as in the usual notation, $a_{k}$ stands for the $k$th term of an arithmetic progression whose first term is $a_{1}$ and difference is $d$). 1. (i) If the natural number $(n-m+1)$ is odd, then the arithmetic mean or average of the reals $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$ is the term $a_{(\frac{m+n}{2})}$. In other words, $a_{(\frac{m+n}{2})}=\frac{a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}}{n-m+1}$. (Note that since $(n-m+1)$ is odd, it follows that $n-m$ must be even, and thus so must be $n+m$; and hence $\frac{m+n}{2}$ must be a natural number). 2. (ii) If the natural number is even, then the arithmetic mean of the reals $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$ must be the average of the two middle terms $a_{(\frac{n+m-1}{2})}$ and $a_{(\frac{n+m+1}{2})}$. In other words $\frac{a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}}{n-m+1}=\frac{a_{(\frac{n+m-1}{2})}+a_{(\frac{n+m+1}{2})}}{2}$. Remark 6: To clearly see the workings of Theorem 4, let’s look at two examples; first suppose $m=3$ and $n=7$. Then $n-m+1=7-3+1=5$; so if $a_{3},a_{4},a_{5},a_{6},a_{7}$ are successive terms of an arithmetic progression, clearly $a_{5}$ is the middle term. But since the five terms are equally spaced or equidistant from one another (because each term is equal to the sum of the previous terms plus a fixed number, the difference $d$), it makes sense that $a_{5}$ would also turn out to be the average of the five terms. If, on the other hand, the natural number $n-m+1$ is even; as in the case of $m=3$ and $n=8$. Then we have two middle numbers: $a_{5}$ and $a_{6}$. Proof (of Theorem 4): 1. (i) Since $n-m+1$ is odd, it follows $n-m$ is even; and thus $n+m$ is also even. Now, if we look at the integers $m,m+1,\ldots,n-1,n$ we will see that since $m+n$ odd, there is a middle number among them, namely the natural number $\frac{m+n}{2}$. Consequently among the terms $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$, the term $a_{(\frac{m+n}{2})}$ is the middle term. Next we perform two calculations. First we compute $a_{(\frac{m+n}{2})}$ in terms of $m,n$ the first term $a_{1}$ and the difference $d$. According to Theorem 1(i), we have, $a_{(\frac{m+n}{2})}=a_{1}+\left(\frac{m+n}{2}-1\right)d=a_{1}+\left(\frac{m+n-2}{2}\right)d.$ Now let us compute the sum $\frac{a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}}{n-m+1}$. First assume $m\geq 2$; so that $2\leq m<n$. Observe that $\begin{array}[]{rl}&a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}\\\ \\\ =&\underset{{\rm sum\ of\ the\ first}\ n\ {\rm terms}}{\left({\underbrace{a_{1}+a_{2}+\ldots+a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}}}\right)}\\\ \\\ &-\underset{\underset{{\rm note\ that}\ m-1\geq 1,\ {\rm since}\ m\geq 2}{{\rm sum\ of\ the\ first}\ (m-1)\ {\rm terms}}}{(\underbrace{a_{1}+\ldots+a_{m-1}})}\end{array}$ Apply Theorem 2(ii), we have, $a_{1}+a_{2}+\ldots+a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}=\frac{n[2a_{1}+(n-1)d]}{2}$ and $a_{1}+\ldots+a_{m-1}=\frac{(m-1)[2a_{1}+(m-2)d]}{2}.$ Putting everything together we have $\begin{array}[]{rl}&a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}\\\ \\\ =&(a_{1}+a_{2}+\ldots+a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n})\\\ \\\ &-(a_{1}+\ldots+a_{m-1})=\frac{n[2a_{1}+(n-1)d]}{2}\\\ \\\ &-\frac{(m-1)[2a_{1}+(m-2)d]}{2}\\\ \\\ =&\frac{2(n-m+1)a_{1}+[n(n-1)-(m-1)(m-2)]d}{2}.\end{array}$ Thus, $\begin{array}[]{rcl}&&\frac{a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}}{n-m+1}\\\ \\\ &=&\frac{2(n-m+1)a_{1}+[n(n-1)-(m-1)(m-2)]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{[n(n-1)-(m-1)(m-2)]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{[n^{2}-m^{2}-n+3m-2]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{[(n-m)(n+m)+(n+m)-2(n-m)-2]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{[(n-m)(n+m)+(n+m)-2(n-m+1)]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{[(n+m)(n-m+1)-2(n-m+1)]d}{2(n-m+1)}\\\ \\\ &=&a_{1}+\frac{(n-m+1)(n+m-2)d}{2(n-m+1)}=a_{1}+\frac{(n+m-2)d}{2},\end{array}$ which is equal to the term $a_{(\frac{m+n}{2})}$ as we have already shown. What about the case $m=1$? If $m=1$, then $n-m+1=n$ and $a_{m}=a_{1}$. In that case, we have the sum $\frac{a_{1}+a_{2}+\ldots+a_{n-1}+a_{n}}{n}=$ (by Theorem 2(ii)) $\frac{n\cdot[2a_{1}+(n-1)d]}{2n}$; but the middle term $a_{(\frac{m+n}{2})}$ is now $a_{(\frac{n+1}{2})}$ since $m=1$; but $a_{(\frac{n+1}{2})}=a_{1}+(\frac{1+n-2}{2})d\Rightarrow a_{(\frac{n+1}{2})}=a_{1}+(\frac{n-1}{2})d$; compare this answer with what we just found right above, namely $\frac{n\cdot[2a_{1}+(n-1)d]}{2n}=\frac{2a_{1}+(n-1)d}{2}=a_{1}+(\frac{n-1}{2})d,$ they are the same. The proof is complete. 2. (ii) This is left as an exercise to the student. (See Exercise 23). Definition 5: A sequence $a_{1},a_{2},\ldots,a_{n},\ldots$ (finite or infinite) is called a harmonic progression, if, and only if, the corresponding sequence of the reciprocal terms: $b_{1}=\frac{1}{a_{1}},\ \ b_{2}=\frac{1}{a_{2}},\ldots,b_{n}=\frac{1}{a_{n}},\ldots,$ is an arithmetic progression. Example 4: The reader can easily verify that the following three sequences are harmonic progressions: 1. (a) $\frac{1}{1},\frac{1}{2},\frac{1}{3},\ldots,\frac{1}{n},\ldots$ 2. (b) $\frac{1}{2},\frac{1}{4},\frac{1}{6},\ldots,\frac{1}{2n},\ldots$ 3. (c) $\frac{1}{9},\frac{1}{16},\frac{1}{23},\ldots,\frac{1}{7n+2},\ldots$ ## 4 Geometric Progressions Definition 6: A sequence $a_{1},a_{2},\ldots,a_{n},\ldots$ (finite or infinite) is called a geometric progression, if there exists a (fixed) real number $r$ such that $a_{n+1}=r\cdot a_{n}$, for every natural number $n$ (if the progression is finite with $k$ terms $a_{1},\ldots,a_{k}$; with $k\geq 2$, then $a_{n+1}=r\cdot a_{n}$, for all $n=1,2,\ldots,k-1$). The real number $r$ is called the ratio of the geometric progression. The first term of the arithmetic progression is usually denoted by $a$, we write $a_{1}=a$. Theorem 5: Let $a=a_{1},a_{2},\ldots,a_{n},\ldots$ be a geometric progression with first term $a$ and ratio $r$. 1. (i) $a_{n}=a\cdot r^{n-1}$, for every natural number $n$. 2. (ii) $a_{1}+\ldots+a_{n}={\displaystyle\sum^{n}_{i=1}}a_{i}=\frac{a_{n}\cdot r-a}{r-1}=\frac{a(r^{n}-1)}{r-1}$, for every natural number $n$, if $r\neq 1$; if on the other hand $r=1$, then the sum of the first $n$ terms of the geometric progression is equal to $n\cdot a$. Proof: 1. (i) By induction: the statement is true for $n=1$, since $a_{1}=a\cdot r^{\circ}=a$. Assume the statement to hold true for $n=k$; for some natural number $k$. We will show that this assumption implies the statement to be also true for $n=(k+1)$. Indeed, since the statement is true for $n=k$, we have $a_{k}=a\cdot r^{k-1}\Rightarrow r\cdot a_{k}=r\cdot a\cdot r^{k-1}=a\cdot r^{k}$; but $k=(k+1-1)$ and $r\cdot a_{k}=a_{k+1}$, by the definition of a geometric progression. Hence, $a_{k+1}=a\cdot r^{(k+1)-1}$, and so the statement also holds true for $n=k$. 2. (ii) Most students probably have seen in precalculus the identity $r^{n}-1=(r-1)(r^{n-1}+\ldots+1)$ to hold true for all natural numbers $n$ and all reals $r$. For example, when $n=2,\ r^{2}-1=(r-1)(r+1)$; when $n=3$, $r^{3}-1=(r-1)(r^{2}+r+1)$. We use induction to actually prove it. Note that the statement $n=1$ simply takes the form, $r-1=r-1$ so it holds true; while for $n=2$ the statement becomes $r^{2}-1=(r-1)(r+1)$, which is again true. Now assume the statement to hold for some $n=k,\ k\geq 2$ a natural number. So we are assuming that the statement $r^{k}-1=(r-1)(r^{k-1}+\ldots+r+1)$. Multiply both sides by $r$: $\begin{array}[]{rl}&r\cdot(r^{k}-1)=r\cdot(r-1)\cdot(r^{k-1}+\ldots+r+1)\\\ \\\ \Rightarrow&r^{k+1}-r=(r-1)\cdot(r^{k}+r^{k-1}+\ldots+r^{2}+r);\\\ \\\ &r^{k+1}-r=(r-1)\cdot(r^{k}+r^{k-1}+\ldots r^{2}+r+1-1)\\\ \\\ \Rightarrow&r^{k+1}-r=(r-1)\cdot(r^{k}+r^{k-1}+\ldots+r^{2}+r+1)\\\ &+(r-1)\cdot(-1)\\\ \\\ \Rightarrow&r^{k+1}-r=(r-1)\cdot(r^{k}+r^{k-1}+\ldots+r^{2}+r+1)-r+1\\\ \\\ \Rightarrow&r^{k+1}-1=(r-1)\cdot(r^{(k+1)-1}+r^{(k+1)-2}+\ldots+r^{2}+r+1),\end{array}$ which proves that the statement also holds true for $n=k+1$. The induction process is complete. We have shown that $r^{n}-1=(r-1)(r^{n-1}+r^{n-2}+\ldots+r+1)$ holds true for every real number $r$ and every natural $n$. If $r\neq 1$, then $r-1\neq 0$, and so $\frac{r^{n}-1}{r-1}=r^{n-1}+r^{n-2}+\ldots+r+1$. Multiply both sides by the first term $a$ we obtain $\begin{array}[]{rcl}{\displaystyle\frac{a\cdot(r^{n}-1)}{r-1}}&=&ar^{n-1}+ar^{n-2}+\ldots ar+a\\\ \\\ &=&a_{n}+a_{n-1}+\ldots+a_{2}+a_{1}.\end{array}$ Since by part (i) we know that $a_{i}=a\cdot r^{i-1}$, for $i=1,2,\ldots,n$; if on the other hand $r=1$, then the geometric progression is obviously the constant sequence, $a,a,\ldots,a,\ldots\ ;\ \ a_{n}=a$ for every natural number $n$. In that case $a_{1}+\ldots+a_{n}=\underset{n\ {\rm times}}{\underbrace{a+\ldots+a}}=na$. The proof is complete. $\square$ Remark 7: We make some observation about the different types of geometric progressions that might occur according to the different types of values of the ratio $r$. 1. (i) If $a=0$, then regardless of the value of the ratio $r$, one obtains the zero sequence $0,0,0,\ldots,0,\ldots$ . 2. (ii) If $r=1$, then for any choice of the first term $a$, the geometric progression is the constant sequence, $a,a,\ldots,a,\ldots$ . 3. (iii) If the first term $a$ is positive and $r>1$ one obtains a geometric progression of positive terms, and which is increasing and which eventually exceed any real number (as we will see in Theorem 8, given a positive real number $M$, there is a term $a_{n}$ that exceeds M; in the language of calculus, we say that it approaches positive infinity). For example: $a=\frac{1}{2}$, and $r=2$; we have the geometric progression $a_{1}=a=\frac{1}{2},\ a_{2}=\frac{1}{2}\cdot 2=1,a_{3}=\frac{1}{2}\cdot 2^{2}=2;$ The sequence is, $\frac{1}{2},1,2,2^{2},2^{3},2^{4},\ldots,\underset{a_{n}}{\underbrace{\frac{1}{2}\cdot 2^{n-1}}}$. 4. (iv) When $a>0$ and $0<r<1$, the geometric progression is decreasing and in the language of calculus, it approaches zero (it has limit value zero). For example: $a=4,\ r=\frac{1}{3}$. We have $a_{1}=a=4,\ a_{2}=4\cdot\frac{1}{3},\ a_{3}=a\cdot\left(\frac{1}{3}\right)^{2},\ a_{4}=4\cdot\left(\frac{1}{3}\right)^{3};$$4,\ \frac{4}{3},\ \frac{4}{9},\ldots,\frac{4}{3^{n-1}}\ n$th term, $\ldots$ . 5. (v) For $a>0$ and $-1<r<0$, the geometric sequence alternates (which means that if we pick any term, the succeeding term will have opposite sign). Still, in this case, such a sequence approaches zero (has limit value zero). For example: $a=9,\ r=-\frac{1}{2}$. $a_{1}=a=9,\ a_{2}=9\cdot\left(-\frac{1}{2}\right)=-\frac{9}{2},\ a_{3}=9\cdot\left(\cdot\frac{1}{2}\right)^{2}=\frac{9}{4},\ldots$ $9,\ -\frac{9}{2},\ \frac{9}{2^{2}},\ \frac{-9}{2^{3}},\ldots,\underset{n{\rm th\ term}}{\underbrace{9\cdot\left(-\frac{1}{2}\right)^{n-1}=\frac{9\cdot(-1)^{n-1}}{2^{n-1}}}}\\\ $ 6. (vi) For $a>0$ and $r=-1$, we have a geometric progression that oscillates: $a,-a,a,-a,\ldots,a_{n}=(-1)^{n-1},\ldots$ . 7. (vii) For $a>0$ and $r<-1$, the geometric progression has negative terms only, it is decreasing, and in the language of calculus we say that approaches negative infinity. For example: $a=3,r=-2$ $\begin{array}[]{rcl}a_{1}&=&a=3,\ a_{2}=3\cdot(-2)=-6,\\\ \\\ a_{3}&=&3\cdot(-2)^{2}=12,\ldots 3,\ -6,\ 12,\ldots,\\\ \\\ &&\displaystyle{\underbrace{3\cdot(-2)^{n-1}=3\cdot 2^{n-1}\cdot(-1)^{n-1}}_{n{\rm th\ term}}},\ldots\end{array}$ 8. (viii) What happens when the first term $a$ is negative? A similar analysis holds (see Exercise 24). Theorem 6: Let $a=a_{1},a_{2},\ldots,a_{n},\ldots$ be a geometric progression with ratio $r$. 1. (i) If $m$ and $n$ are any natural numbers such that $m<n,\ a_{n}=a_{n-m}\cdot r^{m}$. 2. (ii) If $m$ and $n$ are any natural numbers such that $m<n$, then $a_{m+1}\cdot a_{n-m}=a_{1}\cdot a_{n}$. 3. (iii) For any natural number $n$, $\left(\overset{n}{\underset{i=1}{\Pi}}a_{i}\right)^{2}=(a_{1}\cdot a_{2}\ldots a_{n})^{2}=(a_{1}\cdot a_{n})^{n}$, where $\overset{n}{\underset{i=1}{\Pi}}a_{i}$ denotes the product of the first $n$ terms $a_{1},a_{2},\ldots,a_{n}$. Proof: 1. (i) By Theorem 5(i) we have $a_{n}=a\cdot r^{n-1}$ and $a_{n-m}=a\cdot r^{n-m-1}$; thus $a_{n-m}\cdot r^{m}=a\cdot r^{n-m-1}\cdot r^{m}=a\cdot r^{n-1}=a_{n}$, and we are done. $\square$ 2. (ii) Again by Theorem 5(i) we have, $a_{m+1}=a\cdot r^{m},\ a_{n-m}=a\cdot r^{n-m-1},\ {\rm and}\ a_{n}=a\cdot r^{n-1}$ so that $a_{m+1}\cdot a_{n-m}=a\cdot r^{m}\cdot a\cdot r^{n-m-1}=a^{2}\cdot r^{n-1}$ and $a_{1}\cdot a_{n}=a\cdot(a\cdot r^{n-1})=a^{2}\cdot r^{n-1}$. Therefore, $a_{m+1}\cdot a_{n-m}=a_{1}\cdot a_{n}$. 3. (iii) We could prove this part by using mathematical induction. Instead, an alternative proof can be offered by making use of the fact that the sum of the first $n$ natural integers is equal to $\frac{n\cdot(n+1)}{2}$; $1+2+\ldots+n=\frac{n(n+1)}{2}$; we have already seen this in Example 1(i). (Go back and review this example if necessary; $1,2,\ldots,n$ are the consecutive first $n$ terms of the infinite arithmetic progression with first term $1$ and difference $1$). This fact can be applied neatly here: $\begin{array}[]{rcl}a_{1}\cdot a_{2}\ldots a_{i}\ldots a_{n}&=&\ {\rm(by\ Theorem\ 1(i))}\\\ \\\ &=&a\cdot(a\cdot r)\ldots(a\cdot r^{i-1})\ldots(a\cdot r^{n-1})\\\ \\\ &=&\underset{n\ {\rm times}}{(\underbrace{a\cdot a\ldots a})}\cdot r^{[1+2+\ldots+(i-1)+\ldots+(n-1)]}\end{array}$ The sum $[1+2+\ldots+(i-1)+\ldots+(n-1)]$ is simply the sum of the first $(n-1)$ natural numbers, if $n\geq 2$. According to Example 1(i) we have, $1+2+\ldots+(i-1)+\ldots+(n-1)=\frac{(n-1)\cdot[(n-1)+1]}{2}=\frac{(n-1)\cdot n}{2}.$ Hence, $a_{1}\cdot a_{2}\ldots a_{i}\ldots a_{n}=\underset{n\ {\rm times}}{(\underbrace{a\cdot a\ldots a})}\cdot r^{[1+2+\ldots+(i-1)+\ldots+(n-1)]}=a^{n}\cdot r^{\frac{(n-1)n}{2}}\Rightarrow(a_{1}\cdot a_{2}\ldots a_{i}\ldots a_{n})^{2}=a^{2n}\cdot r^{(n-1)\cdot n}$. On the other hand, $(a_{1}\cdot a_{n})^{n}=[a\cdot(a\cdot r^{n-1})]^{n}=[a^{2}\cdot r^{n-1}]^{n}=a^{2n}\cdot r^{n(n-1)}=(a_{1}\cdot a_{2}\ldots a_{i}\ldots a_{n})^{2}$; we are done. $\square$ Definition 7: Let $a_{1},a_{2},\ldots,a_{n}$ be positive real numbers. The positive real number $\sqrt[n]{a_{1}a_{2}\ldots a_{n}}$ is called the geometric mean of the numbers $a_{1},a_{2},\ldots a_{n}$. We saw in Theorem 3 that if three real numbers $a,b,c$ are consecutive terms of an arithmetic progression, the middle term $b$ must be equal to the arithmetic mean of $a$ and $c$. The same is true for the geometric mean if the positive reals $a,b,c$ are consecutive terms in a geometric progression. We have the following theorem. Theorem 7: If the positive real numbers $a,b,c$, are consecutive terms of a geometric progression, then the geometric mean of $a$ and $c$ must equal $b$. Also, any geometric progression containing $a,b,c$ as consecutive terms, must have the same ratio $r$, namely $r=\frac{b}{a}=\frac{c}{b}$. Moreover, the condition $b^{2}=ac$ is the necessary and sufficient condition for the three reals $a,b,c$ to be consecutive terms in a geometric progression. Proof: If $a,b,c$ are consecutive terms in a geometric progression, then $b=ar$ and $c=b\cdot r$; and since both $a$ and $b$ are positive and thus nonzero, we must have $r=\frac{b}{a}={c}{b}\Rightarrow b^{2}=ac\Rightarrow b=\sqrt{ac}$ which proves that $b$ is the geometric mean of $a$ and $c$. Conversely, if the condition $b^{2}=ac$ is satisfied (which is equivalent to $b=\sqrt{ac}$, since $b$ is positive), then since $a$ and $b$ are positive and thus nonzero, infer that $\frac{b}{a}=\frac{c}{b}$; thus if we set $r=\frac{b}{a}=\frac{c}{b}$, it is now clear that $a,b,c$ are consecutive terms of a geometric progression whose ratio is uniquely determined in terms of the given reals $a,b,c$ and any other geometric progression containing $a,b,c$ as consecutive terms must have the same ratio $r$. $\square$ For the theorem to follow we will need what is called Bernoulli’s Inequality: for every real number $a\geq-1$, and every natural number $n$, $(a+1)^{n}\geq 1+na.$ Let $a\geq-1$; Bernoulli’s Inequality can be easily proved by induction: clearly the statement holds true for $n=1$ since $1+a\geq 1+a$ (the equal sign holds). Assume the statement to hold true for some $n=k\geq 1:(a+1)^{k}\geq 1+ka$; since $a+1\geq 0$ we can multiply both sides of this inequality by $a+1$ without affecting its orientation: $\begin{array}[]{rcl}(a+1)^{k+1}&\geq&(a+1)(1+ka)\Rightarrow\\\ \\\ (a+1)^{k+1}&\geq&a+ka^{2}+1+ka;\\\ \\\ (a+1)^{k+1}&\geq&1+(k+1)a+ka^{2}\geq 1+(k+1)a,\end{array}$ since $ka^{2}\geq 0$ (because $a^{2}\geq 0$ and $k$ is a natural number). The induction process is complete. Theorem 8: 1. (i) If $r>1$ and $M$ is a real number, then there exists a natural number $N$ such that $r^{n}>M$, for every natural number $n$. For parts (ii), (iii), (iv) and (v), let $a_{1}=a,a_{2},\ldots,a_{n},\ldots,$ be an infinite geometric progression with first term $a$ and ratio $r$. 2. (ii) Suppose $r>1$ and $a>0$. If $M$ is a real number, then there is a natural number $N$ such that $a_{n}>M$, for every natural number $n\geq N$. 3. (iii) Suppose $r>1$ and $a<0$. If $M$ is a real number, then there is a natural number $N$ such that $a_{n}<M$, for every natural number $n\geq N$. 4. (iv) Suppose $|r|<1$, and $r\neq 0$. If $\epsilon>0$ is a positive real number, then there is a natural number $N$ such that $|a_{n}|<\epsilon$, for every natural number $n\geq N$. 5. (v) Suppose $|r|<1$ and let $S_{n}=a_{1}+a_{2}+\ldots+a_{n}$. If $\epsilon>0$ is a positive real number, then there exists a natural number $N$ such that $\left|S_{n}-\frac{a}{1-r}\right|<\epsilon$, for every natural number $n\geq N$. Proof: 1. (i) We can write $r=(r-1)+1$; let $a=r-1$, since $r>1$, $a$ must be a positive real. According to the Bernoulli Inequality we have, $r^{n}=(a+1)^{n}\geq 1+na$; thus, in order to ensure that $r^{n}>M$, it is sufficient to have $1+na>M\Leftrightarrow na>M-1\Leftrightarrow n>{\displaystyle\frac{M-1}{a}}$ (the last step is justified since $a>0$). Now, if $\left[\left[\,{\displaystyle\frac{|M-1|}{a}}\,\right]\right]$ stands for the integer part of the positive real number ${\displaystyle\frac{|M-1|}{a}}$ we have by definition, $\left[\left[{\displaystyle\frac{|M-1|}{a}}\ \right]\right]\ \leq\ {\displaystyle\frac{|M-1|}{a}}<\left[\left[\,{\displaystyle\frac{|M-1|}{a}}\,\right]\right]+1$. Thus, if we choose $N=\left[\left[{\displaystyle\frac{|M-1|}{a}}\right]\right]+1$, it is clear that $N>{\displaystyle\frac{|M-1|}{a}}\geq{\displaystyle\frac{M-1}{a}}$ so that for every natural number $n\geq N$, we will have $n>{\displaystyle\frac{M-1}{a}}$, and subsequently we will have (since $a>0$), $na>M-1\Rightarrow na+1>M$. But $(1+a)^{n}\geq 1+na$ (Bernoulli), so that $r^{n}=(1+a)^{n}\geq 1+na>M$; $r^{n}>M$, for every $n\geq N$. We are done. $\square$ 2. (ii) By part (i), there exists a natural number $N$ such that $r^{n}>\frac{M}{a}\cdot r$, for every natural number $n\geq N$ (apply part (i) with $\frac{M}{a}\cdot r$ replacing $M$). Since both $r$ and $a$ are positive, so is $\frac{a}{r}$; multiplying both sides of the above inequality by $\frac{a}{r}$ we obtain $\frac{a}{r}\cdot r^{n}>\frac{a}{r}\cdot\frac{M}{a}\cdot r\Rightarrow a\cdot r^{n-1}>M$. But $a\cdot r^{n-1}$ is the $n$th term $a_{n}$ of the geometric progression. Hence $a_{n}>M$, for every natural number $n\geq N$. $\square$ 3. (iii) Apply part (ii) to the opposite geometric progression: $-a_{1},-a_{2},\ldots$,$-a_{n},\ldots$ , where $a_{n}$ is the $n$th term of the original geometric progression (that has $a_{1}=a<0$ and $r>1$, it is also easy to see that the opposite sequence is itself a geometric progression with the same ratio $r>1$ and opposite first term $-a$). According to part (ii) there exists a natural number $N$ such that $-a_{n}>-M$, for every natural number $n\geq N$. Thus $-(-a_{n})<-(-M)\Rightarrow a_{n}<M$, for every $n\geq N$. $\square$ 4. (iv) Since $|r|<1$, assuming $r\neq 0$ it follows that $\frac{1}{|r|}>1$. Let $M=\frac{|a|}{\epsilon\cdot|r|}$. According to part (i), there exists a natural number $N$ such that $\left(\frac{1}{|r|}\right)^{n}>M=\frac{|a|}{\epsilon|r|}$ (just apply part (i) with $r$ replaced by $\frac{1}{|r|}$ and $M$ replaced by $\frac{|a|}{\epsilon\cdot|r|}$ for every natural number $n\geq N$. Thus $\frac{1}{|r|^{n}}>\frac{|a|}{\epsilon\cdot|r|}$; multiply both sides by $|r|^{n}\cdot\epsilon$ to obtain $\frac{|r|^{n}\cdot\epsilon}{|r|^{n}}>\frac{|a|\cdot|r|^{n}\cdot\epsilon}{\epsilon\cdot|r|}\Rightarrow|a|\cdot|r|^{n-1}<\epsilon$; but $|a|\cdot|r|^{n-1}=|ar^{-n}|=|a_{n}|$, the absolute value of the $n$th term of the geometric progression; $|a_{n}|<\epsilon$, for every natural number $n\geq N$. Finally if $r=0$, then $a_{n}=0$ for $n\geq 2$, and so $|a_{n}|=0<\epsilon$ for all $n\geq 2$. $\square$ 5. (v) By Theorem 5(ii) we know that, $S_{n}=a_{1}+a_{2}+\ldots+a_{n}=a+ar+\ldots+ar^{n-1}=\frac{a(r^{n}-1)}{r-1}$ We have $S_{n}-\frac{a}{1-r}=\frac{a(r^{n}-1)}{r-1}+\frac{a}{r-1}=\frac{ar^{n}-a+a}{r-1}=\frac{ar^{n}}{r-1}$. Consequently, $\left|S_{n}-\frac{a}{1-r}\right|=\left|\frac{ar^{n}}{r-1}\right|=|r|^{n}\cdot\left|\frac{a}{r-1}\right|$. Assume $r\neq 0$. Since $|r|<1$, we can apply the already proven part (iv), using the positive real number $\frac{\epsilon\cdot|r-1|}{|r|}$ in place of $\epsilon$: there exists a natural number $N$ such that $|a_{n}|<\frac{\epsilon\cdot|r-1|}{|r|}$, for every natural number $n\geq N$. But $a_{n}=a\cdot r^{n-1}$ so that, $|a|\cdot|r|^{n-1}<\frac{\epsilon\cdot|r-1|}{|r|}\Rightarrow$ $\Rightarrow$ (multiplying both sides by $|r|$) $|a||r|^{n}<\epsilon\cdot|r-1|\Rightarrow$ $\Rightarrow$ (dividing both sides by $|r-1|$) $\frac{|a|\ |r|^{n}}{|r-1|}<\epsilon$. And since $\left|S_{n}-\frac{a}{1-r}\right|=|r|^{n}\cdot\left|\frac{a}{r-1}\right|$ we conclude that, $\left|S_{n}-\frac{a}{1-r}\right|<\epsilon$. The proof will be complete by considering the case $r=0$: if $r=0$, then $a_{n}=0$, for all $n\geq 2$. And thus $S_{n}=\frac{a(r^{n}-1)}{r-1}=\frac{-a}{-1}=a$, for all natural numbers $n$. Hence, $\left|S_{n}-\frac{a}{1-r}\right|=\left|a-\frac{a}{1}\right|=|a-a|=0<\epsilon$, for all natural numbers $n$. $\square$ Remark 6: As the student familiar with, will recognize, part (iv) of Theorem 8 establishes the fact that the limit value of the sequence whose $n$th term is $a_{n}=a\cdot r^{n-1}$ and under the assumption $|r|<1$, is equal to zero. In the language of calculus, when $|r|<1$, the geometric progression approaches zero. Also, part (v), establishes the sequence of (partial) sums whose $n$th term is $S_{n}$, approaches the real number $\frac{a}{1-r}$, under the assumption $|r|<1$. In the language of calculus we say that the infinite series $a+ar+ar^{2}+\ldots+ar^{n-1}+\ldots$ converges to $\frac{a}{1-r}$. ## 5 Mixed Progressions The reader of this book who has also studied calculus, may have come across the sum, $1+2x+3x^{2}+\ldots+(n+1)x^{n}.$ There are $(n+1)$ terms in this sum; the $i$th term is equal to $i\cdot x^{i-1}$, where $i$ is a natural number between $1$ and $(n+1)$. Note that if $a_{i}=i\cdot x^{i-1},\ b_{i}=i$, and $c_{i}=x^{i-1}$, we have $a_{i}=b_{i}\cdot c_{i}$; what is more, $b_{i}$ is the $i$th term of an arithmetic progression (that has both first term and difference equal to $1$); and $c_{i}$ is the $i$th term of a geometric progression (with first term $c=1$ and ratio $r=x$). Thus the term $a_{i}$ is the product of the $i$th term of an arithmetic progression with the $i$th term of a geometric progression; then we say that $a_{i}$ is the $i$th term of a mixed progression. We have the following definition. Definition 8: Let $b_{1},b_{2},\ldots,b_{n},\ldots$ be an arithmetic progression; and $c_{1},c_{2},$ $\ldots,c_{n},\ldots$ be a geometric progression. The sequence $a_{1},a_{2},\ldots,a_{n},\ldots,$ where $a_{n}=b_{n}\cdot c_{n}$, for every natural number $n$, is called a mixed progression. (Of course, if both the arithmetic and geometric progressions are finite sequences with the same number of terms, so it will be with the mixed progression.) Back to our example. With a little bit of ingenuity, we can compute this sum; that is, find a closed form expression for it, in terms of $x$ and $n$. Indeed, we can write the given sum in the form, $\begin{array}[]{ll}\underset{(n+1)\ {\rm terms}}{\left(\underbrace{1+x+x^{2}+\ldots+x^{n-1}+x^{n}}\right)}+\underset{n\ {\rm terms}}{\left(\underbrace{x+x^{2}+\ldots+x^{n-1}+x^{n}}\right)}\\\ \\\ +\underset{(n-1)\ {\rm terms}}{\left(\underbrace{x^{2}+x^{3}+\ldots+x^{n-1}+x^{n}}\right)}+\ldots+\underset{2\ {\rm terms}}{\left(\underbrace{x^{n-1}+x^{n}}\right)}+\underset{{\rm one\ term}}{\underbrace{x^{n}}}\end{array}.$ In other words we have written the original sum $1+2x+3x^{2}+\ldots+(n+1)x^{n}$ as a sum of $(n+1)$ sums, each containing one term less than the previous one. Now according to Theorem 5(ii), $1+x+x^{2}+\ldots+x^{n-1}+x^{n}=\frac{x^{n+1}-1}{x-1}\ {\rm\left(\right.}{\rm assuming}\ x\neq 1\ {\rm\left.\right)},$ since this is the sum of the first $(n+1)$ terms of a geometric progression with first term $1$ and ratio $x$. Next, consider $\begin{array}[]{rcl}x+x^{2}+\ldots+x^{n-1}+x^{n}&=&(1+x+x^{2}+\ldots+n^{n-1}+x^{n})-1\\\ &=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x^{i}-1}{x-1}\right)\end{array}.$ Continuing this way we have, $\begin{array}[]{rcl}x^{2}+\ldots+x^{n-1}+x^{n}&=&(1+x+x^{2}+\ldots+x^{n}-1+x^{n})-(x+1)\\\ \\\ &=&{\displaystyle\frac{x^{n+1}-1}{x-1}}-\left({\displaystyle\frac{x^{2}-1}{x-1}}\right).\end{array}$ On the $i$th level, $\begin{array}[]{rcl}x^{i}+\ldots+x^{n-1}+x^{n}&=&(1+x+\ldots+x^{i-1}+x^{i}+\ldots+x^{n-1}+x^{n})-\\\ \\\ -(1+x+\ldots+x^{i-1})&=&{\displaystyle\frac{x^{n+1}-1}{x-1}}-\left({\displaystyle\frac{x^{i}-1}{x-1}}\right).\end{array}$ Let us list all of these sums: $\begin{array}[]{crcl}(1)&1+x+x^{2}+\ldots+x^{n-1}+x^{n}&=&\frac{x^{n+1}-1}{x-1}\\\ \\\ (2)&x+x^{2}+\ldots+x^{n-1}+x^{n}&=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x-1}{x-1}\right)\\\ \\\ (3)&x^{2}+\ldots+x^{n-1}+x^{n}&=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x^{2}-1}{x-1}\right)\\\ \vdots&&&\\\ (i)&x^{i}+\ldots+x^{n-1}+x^{n}&=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x^{i}-1}{x-1}\right)\\\ \vdots&&&\\\ (n)&x^{n-1}+x^{n}&=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x^{n-1}-1}{x-1}\right)\\\ \\\ (n+1)&x^{n}&=&\frac{x^{n+1}-1}{x-1}-\left(\frac{x^{n}-1}{x-1}\right),\end{array}$ with $x\neq 1$. If we add the $(n+1)$ equations or identities (they hold true for all reals except for $x=1$), the sum of the $(n+1)$ left-hand sides is simply the original sum $1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x$? Thus, if we add up the $(n+1)$ equations member-wise we obtain, $\begin{array}[]{rl}&1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&(n+1)\cdot\left(\frac{x^{n+1}-1}{x-1}\right)+\frac{n-(x+x^{2}+\ldots+x^{i}+\ldots+x^{n-1}+x^{n})}{x-1}\\\ =&(n+1)\cdot\left(\frac{x^{n+1}-1}{x-1}\right)+\frac{(n+1)-(1+x+x^{2}+\ldots+x^{n})}{x-1}\\\ \Rightarrow&1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&(n+1)\cdot\left(\frac{x^{n+1}-1}{x-1}\right)+\frac{(n+1)-\left(\frac{x^{n+1}-1}{x-1}\right)}{x-1};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&(n+1)\cdot\left(\frac{x^{n+1}-1}{x-1}\right)+\frac{(n+1)(x-1)-(x^{n+1}-1)}{(x-1)^{2}};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&\frac{(n+1)(x^{n+1}-1)(x-1)+(n+1)(x-1)-(x^{n+1}-1)}{(x-1)^{2}};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&\frac{(n+1)(x-1)\cdot[(x^{n+1}-1)+1]-(x^{n+1}-1)}{(x-1)^{2}};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&\frac{(n+1)(x-1)\cdot x^{n+1}-(x^{n+1}-1)}{(x-1)^{2}};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&\frac{(n+1)x^{n+2}-(n+1)x^{n+1}-x^{n+1}+1}{(x-1)^{2}};\\\ &1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}\\\ =&\framebox{$\frac{(n+1)x^{n+2}-(n+2)x^{n+1}+1}{(x-1)^{2}}$}\end{array}$ for every natural number $n$. For $x=1$, the above derived formula is not valid. However, for $x=1$; $1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}=1+2+3+\ldots+n+(n+1)=\frac{(n+1)(n+2)}{2}$ (the sum of the first $(n+1)$ terms of an arithmetic progression with first term $a_{1}=1$ and difference $d=1$. The following theorem gives a formula for the sum of the first $n$ terms of a mixed progression. Theorem 9: Let $b_{1},b_{2},\ldots,b_{n},\ldots$ , be an arithmetic progression with first term $b_{1}$ and difference $d$; and $c_{1},c_{2},\ldots,c_{n},\ldots$ , be a geometric progression with first term $c_{1}=c$ and ratio $r\neq 1$. Let $a_{1},a_{2},\ldots,a_{n},\ldots$ , the corresponding mixed progression, that is the sequence whose $n$th term $a_{n}$ is given by $a_{n}=b_{n}\cdot c_{n}$, for every natural number $n$. 1. (i) $a_{n}=\left[b_{1}+(n-1)\cdot d\right]\cdot c\cdot r^{n-1}$, for every natural number $n$. 2. (ii) For every natural number $n$, $a_{n+1}-r\cdot a_{n}=d\cdot c_{n+1}$. 3. (iii) If $S_{n}=a_{1}+a_{2}+\ldots+a_{n}$ (sum of the first $n$ terms of the mixed progression), then $\begin{array}[]{rcl}S_{n}&=&\frac{a_{n}\cdot r-a_{1}}{r-1}+\frac{d\cdot\tau\cdot c\cdot(1-r^{n-1})}{(r-1)^{2}};\\\ \\\ S_{n}&=&\frac{a_{n}\cdot r-a_{1}}{r-1}+\frac{d\cdot r\cdot(c-c_{n})}{(r-1)^{2}}\end{array}$ (recall $c_{n}=c\cdot r^{n-1}$). Proof: 1. (i) This is immediate, since by Theorem 1(i), $b_{n}=b_{1}+(n-1)\cdot d$ and by Theorem 5(i), $c_{n}=c\cdot r^{n-1}$, and so $a_{n}=b_{n}\cdot c_{n}=[b_{1}+(n-1)d]\cdot c\cdot r^{r-1}$. 2. (ii) We have $a_{n+1}=b_{n+1}\cdot c_{n+1},\ a_{n}=b_{n}c_{n},\ b_{n+1}=d+b_{n}$. Thus, $a_{n+1}-r\cdot a_{n}=c_{n+1}\cdot(d+b_{n})-r\cdot b_{n}\cdot c_{n}=d\cdot c_{n+1}+c_{n+1}b_{n}-rb_{n}c_{n}=d\cdot c_{n+1}+b_{n}\cdot\underset{0}{(\underbrace{c_{n+1}-rc_{n}})}=dc_{n+1}$, since $c_{n+1}=rc_{n}$ by virtue of the fact that $c_{n}$ and $c_{n+1}$ are consecutive terms of a geometric progression with ratio $r$. End of proof. $\square$ 3. (iii) We proceed by mathematical induction. The statement is true for $n=1$ because $S_{1}=a_{1}$ and $\frac{a_{1}r-a_{i}}{r-1}+\frac{d\cdot r\cdot(c-c_{1})}{(r-1)^{2}}=\frac{a_{1}(r-1)}{r-1}+0=a_{1}=S_{1}$. Assume the statement to hold for $n=k$: (for some natural number $k\geq 1;\ S_{k}=\frac{a_{k}\cdot r-a_{1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k})}{(r-1)^{2}}$. We have $S_{k+1}=S_{k}+a_{k+1}=\frac{a_{k}\cdot r-a_{1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k})}{(r-1)^{2}}+a_{k+1}=\frac{a_{k}\cdot r-a_{1}+a_{k+1}\cdot r-a_{k+1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k})}{(r-1)^{2}}(1)$. But by part (ii) we know that $a_{k+1}-ra_{k}=d\cdot c_{k+1}$. Thus, by (1) we now have, $\begin{array}[]{lrcl}&S_{k+1}&=&{\displaystyle\frac{a_{k+1}\cdot r-a_{1}}{r-1}-\frac{d\cdot c_{k+1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k})}{(r-1)^{2}}}\\\ \Rightarrow&S_{k+1}&=&{\displaystyle\frac{a_{k+1}\cdot r-a_{1}}{r-1}+\frac{-(r-1)\cdot d\cdot c_{k+1}+d\cdot r\cdot(c-c_{k})}{(r-1)^{2}}};\\\ &S_{k+1}&=&{\displaystyle\frac{a_{k+1}\cdot r-a_{1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k+1})+d\cdot\overset{0}{(\overbrace{c_{k+1}-r\cdot c_{k}})}}{(r-1)^{2}}}.\end{array}$ But $c_{k+1}-r\cdot c_{k}=0$ (since $c_{k+1}=r\cdot c_{k}$) because $c_{k}$ and $c_{k+1}$ consecutive terms of a geometric progression with ratio $r$. Hence, we obtain $S_{k+1}=\frac{a_{k+1}\cdot r-a_{1}}{r-1}+\frac{d\cdot r\cdot(c-c_{k+1})}{(r-1)^{2}}$; the induction is complete. The example with which we opened this section is one of a mixed progression. We dealt with the sum $1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}$. This is the sum of the first $(n+1)$ terms of a mixed progression whose $n$th term is $a_{n}=n\cdot x^{n-1}$; in the notation of Theorem 9, $b_{n}=n,\ d=1,\ c_{n}=x^{n-1}$, and $r=x$ (we assume $x\neq 1$). According to Theorem 9(iii) $\begin{array}[]{rcl}S_{n}&=&1+2x+3x^{2}+\ldots+nx^{n-1}=\frac{(nx^{n-1})\cdot x-1}{x-1}+\frac{x\cdot(1-x^{n-1})}{(x-1)^{2}}\\\ \\\ &=&\frac{nx^{n}-1}{x-1}+\frac{x-x^{n}}{(x-1)^{2}}=\frac{(nx^{n}-1)(x-1)}{(x-1)^{2}}+\frac{x-x^{n}}{(x-1)^{2}}\\\ \\\ &=&\frac{nx^{n+1}-nx^{n}-x+1+x-x^{n}}{(x-1)^{2}}=\frac{nx^{n+1}-(n+1)x^{n}+1}{(x-1)^{2}};\end{array}$ Thus, if we replace $n$ by $(n+1)$ we obtain, $S_{n+1}=1+2x+3x^{2}+\ldots+nx^{n-1}+(n+1)x^{n}=\frac{(n+1)x^{n+2}-(n+2)x^{n+1}+1}{(x-1)^{2}}$, and this is the formula we obtained earlier. Definition 9: Let $a_{1},\ldots,a_{n}$ be nonzero real numbers. The real number $\frac{n}{\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}}}$, is called the harmonic mean of the real numbers $a_{1},\ldots,a_{n}$. Remark 7: Note that since $\frac{n}{\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}}}=\frac{1}{(\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}})/n}$, the harmonic mean of the reals $a_{1},\ldots,a_{n}$, is really the reciprocal of the mean of the reciprocal real numbers $\frac{1}{a_{1}},\ldots,\frac{1}{a_{n}}$. We close this section by establishing an interesting, significant and deep inequality, that has many applications in mathematics and has been used to prove a number of other theorems. Given $n$ positive real numbers $a_{1},\ldots,a_{n}$ one can always designate three positive reals to the given set $\\{a_{1},\ldots,a_{n}\\}$: the arithmetic mean denoted by A.M., the geometric mean denoted by G.M., and the harmonic mean H.M. The arithmetic- geometric-harmonic mean inequality asserts that A.M. $\geq$ G.M. $\geq$ H.M. (To the reader: Do an experiment; pick a set of three positive reals; then a set of four positive reals; for each set compute the A.M., G.M., and H.M. values; you will see that the inequality holds; if you are in disbelief do it again with another sample of positive real numbers.) The proof we will offer for the arithmetic-geometric-harmonic inequality is indeed short. To do so, we need a preliminary result: we have already proved (in the proof of Theorem 5(i)) the identity $r^{n}-1=(r-1)(r^{n-1}+r^{n-2}+\ldots+r+1)$, which holds true for all real numbers $r$ and all natural numbers $n$. Moreover, if $r\neq 1$, we have $\frac{r^{n-1}}{r-1}=r^{n-1}+r^{n-2}+\ldots+r+1$ If we set $r=\frac{b}{a}$, with $b\neq a$, in the above equation and we multiply both sides by $a^{n}$ we obtain, $\frac{b^{n}-a^{n}}{b-a}=b^{n-1}+b^{n-2}\cdot a+b^{n-3}\cdot a^{2}+\ldots+b^{2}\cdot a^{n=-3}+b\cdot a^{n-2}+a^{n-1}$ Now, if $b>a>0$ and in the above equation we replace $b$ by $a$, the resulting right-hand side will be smaller. In other words, in view of $b>a>0$ we have, $\begin{array}[]{c}(1)\\\ (2)\\\ (3)\\\ \vdots\\\ (n-2)\\\ (n-1)\\\ (n)\end{array}\left\\{\begin{array}[]{l}b^{n-1}>a^{n-1}\\\ b^{n-2}\cdot a>a^{n-2}\cdot a^{1}=a^{n-1}\\\ b^{n-3}\cdot a^{2}>a^{n-3}\cdot a^{2}=a^{n-1}\\\ \vdots\\\ b^{2}\cdot a^{n-3}\cdot a^{2}>a^{2}\cdot a^{n-3}j=a^{n-1}\\\ b\cdot a^{n-2}>a\cdot a^{n-2}=a^{n-1}\\\ a^{n-1}=a^{n-1}\end{array}\right\\}\begin{array}[]{ll}\Rightarrow&{\rm add\ memberwise}\\\ \\\ &b^{n-1}+b^{n-2}\cdot a+b^{n-3}\cdot a^{2}+\ldots\\\ +&b^{2}a^{n-3}+b\cdot a^{n-2}+a^{n-1}\\\ >&n\cdot a^{n-1}\end{array}$ Hence, the identity above, for $b>a>0$, implies the inequality $\frac{b^{n}-a^{n}}{b-a}>na^{n-1}$; multiplying both sides by $b-a>0$ we arrive at $\begin{array}[]{rl}&b^{n}-a^{n}>(b-a)na^{n-1}\\\ \\\ \Rightarrow&b^{n}>nba^{n-1}-na^{n}+a^{n};\\\ \\\ &b^{n}>nba^{n-1}-(n-1)a^{n}.\end{array}$ Finally, by replacing $n$ by $(n+1)$ in the last inequality we obtain, $b^{n+1}>(n+1)ba^{n}-na^{n+1}$, for every natural number $n$ and any real numbers such that $b>a>0$ We are now ready to prove the last theorem of this chapter. Theorem 10: Let $n$ be a natural number and $a_{1},\ldots,a_{n}$ positive real numbers. Then, $\begin{array}[]{rcccl}\underset{{\rm A.M.}}{\underbrace{\frac{a_{1}\ldots+a_{n}}{n}}}&\geq&\underset{{\rm G.M.}}{\underbrace{\sqrt[n]{a_{1}\ldots a_{n}}}}&\geq&\underset{{\rm H.M.}}{\underbrace{\frac{n}{\frac{1}{a_{1}}+\frac{1}{a_{2}}+\ldots+\frac{1}{a_{n}}}}}\end{array}$ Proof: Before we proceed with the proof, we mention here that if one equal sign holds the other must also hold, and that can only happen when all $n$ numbers $a_{1},\ldots,a_{n}$ are equal. We will not prove this here, but the reader may want to verify this in the cases $n=2$ and $n=3$. We will proceed by using mathematical induction to first prove that, $\frac{a_{1}+\ldots+a_{n}}{n}\geq\sqrt[n]{a_{1}\ldots a_{n}}$, for every natural number $n$ and all positive reals $a_{1},\ldots,a_{n}$. Even though this trivially holds true for $n=1$, we will use as our starting or base value, $n=2$. So we first prove that $\frac{a_{1}+a_{2}}{2}\geq\sqrt{a_{1}a_{2}}$ holds true for any two positive reals. Since $a_{1}$ and $a_{2}$ are both positive, the square roots $\sqrt{a_{1}}$ and $\sqrt{a_{2}}$ are both positive real numbers and $a_{1}=(\sqrt{a_{1}})^{2},\ a_{2}=(\sqrt{a_{2}})^{2}$. Clearly, $\begin{array}[]{rl}&(\sqrt{a_{1}}-\sqrt{a_{2}})^{2}\geq 0\\\ \\\ \Rightarrow&(\sqrt{a_{1}})^{2}-2(\sqrt{a_{1}})(\sqrt{a_{2}})+(\sqrt{a_{2}})^{2}\geq 0\\\ \\\ \Rightarrow&a_{1}-2\sqrt{a_{1}a_{2}}+a_{2}\geq 0\\\ \\\ \Rightarrow&a_{1}+a_{2}\geq 2\cdot\sqrt{a_{1}a_{2}}\\\ \\\ \Rightarrow&\frac{a_{1}+a_{2}}{2}\geq\sqrt{a_{1}a_{2}},\end{array}$ so the statement holds true for $n=2$. The Inductive Step: Assume the statement to hold true for some natural number $n=k\geq 2$; and show that this assumption implies that the statement must also hold true for $n=k+1$. So assume, $\begin{array}[]{rlll}&\frac{a_{1}+\ldots+a_{k}}{k}&\geq&\sqrt[k]{a_{1}\ldots a_{k}}\\\ \\\ \Rightarrow&a_{1}+\ldots+a_{k}&\geq&k\cdot\sqrt[k]{a_{1}\ldots a_{k}}\end{array}$ Now we apply the inequality we proved earlier: $b^{k+1}>(k+1)\cdot b\cdot a^{k}-k\cdot a^{k+1};$ If we take $b=\sqrt[k+1]{a_{k+1}}$, where $a_{k+1}$ is a positive real and $a=\sqrt[k(k+1)]{a_{1}\ldots a_{k}}$ we now have, $\begin{array}[]{rcl}\left(\sqrt[k+1]{a_{k+1}}\right)^{k+1}&>&(k+1)\cdot\sqrt[k+1]{a_{k+1}}\cdot\left(\sqrt[k(k+1)]{a_{1}\ldots a_{k}}\right)^{k}-k\cdot\left(\sqrt[k(k+1)]{a_{1}\ldots a_{k}}\right)^{k+1}\\\ \\\ &\Rightarrow&a_{k+1}>(k+1)\cdot\sqrt[k+1]{a_{k+1}}\cdot\sqrt[k+1]{a_{1}\ldots a_{k}}-k\cdot\sqrt[k]{a_{1}\ldots a_{k}}\\\ \\\ &\Rightarrow&a_{k+1}+k\cdot\sqrt[k]{a_{1}\ldots a_{k}}>(k+1)\cdot\sqrt[k+1]{a_{1}\ldots a_{k}\cdot a_{k+1}}\end{array}$ But from the inductive step we know that $a_{1}+\ldots+a_{k}\geq k\cdot\sqrt[k]{a_{1}\ldots a_{k}}$; hence we have, $\begin{array}[]{rcl}a_{k+1}+(a_{1}+\ldots+a_{k})&\geq&a_{k+1}+k\cdot\sqrt[k]{a_{1}\ldots a_{k}}\geq(k+1)\cdot\sqrt[k+1]{a_{1}\ldots a_{k}\cdot a_{k+1}}\\\ \\\ &\Rightarrow&a_{1}+\ldots+a_{k}+a_{k+1}\geq(k+1)\sqrt[k+1]{a_{1}\ldots a_{k}\cdot a_{k+1}},\end{array}$ and the induction is complete. Now that we have established the arithmetic-geometric mean inequality, we prove the geometric-harmonic inequality. Indeed, if $n$ is a natural number and $a_{1},\ldots,a_{n}$ are positive reals, then so are the real numbers $\frac{1}{a_{1}},\ldots,\frac{1}{a_{n}}$. By applying the already proven arithmetic-geometric mean inequality we infer that, $\frac{\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}}}{n}\geq\sqrt[n]{\frac{1}{a_{1}}\ldots\frac{1}{a_{n}}}$ Multiplying both sides by the product $\left(\frac{n}{\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}}}\right)\cdot\sqrt[n]{a_{1}\ldots a_{n}}$, we arrive at the desired result: $\sqrt[n]{a_{1}\ldots a_{n}}\geq\frac{n}{\frac{1}{a_{1}}+\ldots+\frac{1}{a_{n}}}.$ This concludes the proof of the theorem. $\square$ ## 6 A collection of 21 problems 1. P1. Determine the difference of each arithmetic progression whose first term is $\frac{1}{5}$; and with subsequent terms (but not necessarily consecutive) the rational numbers $\frac{1}{4},\ \frac{1}{3},\ \frac{1}{2}$. Solution: Let $k,m,n$ be natural numbers with $k<m<n$ such that $a_{k}=\frac{1}{4},\ a_{m}=\frac{1}{3},$ and $a_{n}=\frac{1}{2}$. And, of course, $a_{1}=\frac{1}{5}$ is the first term; $a_{1}=\frac{1}{5},\ldots,a_{k}=\frac{1}{4},\ldots,a_{m}=\frac{1}{3},\ldots,a_{n}=\frac{1}{2},\ldots$ . By Theorem 1(i) we must have, $\left.\begin{array}[]{l}\frac{1}{4}=a_{k}=\frac{1}{5}+(k-1)d\\\ \\\ \frac{1}{3}=a_{m}=\frac{1}{5}+(m-1)d\\\ \\\ \frac{1}{2}=a_{n}+\frac{1}{5}+(n-1)d\end{array}\right\\}$; where $d$ is the difference of the arithmetic progression. Obviously, $d\neq 0$; the three equations yield, $\left.\begin{array}[]{l}(k-1)d=\frac{1}{4}-\frac{1}{5}=\frac{1}{20}\\\ \\\ (m-1)d=\frac{1}{3}-\frac{1}{5}=\frac{2}{15}\\\ \\\ (n-1)d=\frac{1}{2}-\frac{1}{5}=\frac{3}{10}\end{array}\right\\}$ (1) Also, it is clear that $1<k$; (2) so that $1<k<m<n$. (3) Dividing (1) with (2) member-wise gives $\frac{k-1}{m-1}=\frac{3}{8},\ \Rightarrow 8(k-1)=3(m-1)$ (4) Dividing (2) with (3) member-wise implies $\frac{m-1}{n-1}=\frac{4}{9}\Rightarrow 9(m-1)=4(n-1)$ (5) Dividing (1) with (3) member-wise produces $\frac{k-1}{n-1}=\frac{1}{6}\Rightarrow 6(k-1)=n-1$ (6) According to Equation (4), 3 must be a divisor of $k-1$ and $8$ must be a divisor of $m-1$; if we put $k-1=3t;\ k=3t+1$, where $t$ is a natural number (since $k>1$), then (4) implies $8t=m-1\Rightarrow m=8t+1$ Going to equation (5) and substituting for $m-1=8t$, we obtain, $18t=n-1\Rightarrow n=18t+1.$ Checking equation (6) we see that $6(3t)=18t$, which is true for all nonnegative integer values of $t$. In conclusion we have the following formulas for $k,\ m,$ and $n$: $k=3t+1,\ m=8t+1,\ n=18t+1;\ t\in{\mathbb{N}};\ t=1,2,\ldots$ We can now calculate $d$ in terms of $t$ from any of the equations (1), (2), or (3): From (1), $(k-1)d=\frac{1}{20}\Rightarrow 3t\cdot d=\frac{1}{20}\Rightarrow$ $d=\frac{1}{60t}$. We see that this problem has infinitely many solutions: there are infinitely many (infinite) arithmetic progressions that satisfy the conditions of the problem. For each positive integer of value of $t$, a new such arithmetic progression is determined. For example, for $t=1$ we have $d=\frac{1}{60},\ k=4,\ m=9,\ n=19$. We have the progression, $a_{1}=\frac{1}{5},\ldots,a_{4}=\frac{1}{4},\ldots\ldots,a_{9}=\frac{1}{3},\ldots\ldots,a_{19}=\frac{1}{2},\ldots$ 2. P2. Determine the arithmetic progressions (by finding the first term $a_{1}$ and difference $d$) whose first term is $a_{1}=5$, whose difference $d$ is an integer, and which contains the numbers $57$ and $113$ among their terms. Solution: We have $a_{1}=5,\ a_{m}=57,\ a_{n}=113$ for some natural numbers $m$ and $n$ with $1<m<n$. We have $57=5+(m-1)d$ and $113=5+(n-1)d$; $(m-1)d=52$ and $(n-1)d=108$; the last two conditions say that $d$ is a common divisor of $52$ and $108$; thus $d=1,2,\ {\rm or}\ 4$ are the only possible values. A quick computation shows that for $d=1$, we have $m=53$, and $n=109$; for $d=2$, we have $m=27$ and $n=55$; and for $d=4,\ m=14$ and $n=28$. In conclusion there are exactly three arithmetic progressions satisfying the conditions of this exercise; they have first term $a_{1}=5$ and their differences $d$ are $d=1,2,$ and $4$ respectively. 3. P3. Find the sum of all three-digit natural numbers $k$ which are such that the remainder of the divisions of $k$ with $18$ and of $k$ with $30$, is equal to $7$. Solution: Any natural number divisible by both $18$ and $30$, must be divisible by their least common multiple which is $90$. Thus if $k$ is any natural number satisfying the condition of the exercise, then the number $k-7$ must be divisible by both $18$ and $90$ and therefore $k-7$ must be divisible by $90$; so that $k-7=90t$, for some nonnegative integer $t$; thus the three- digit numbers of the form $k=90t+7$ are precisely the numbers we seek to find. These numbers are terms in an infinite arithmetic progression whose first term is $a_{1}=7$ and whose difference is $d=70:\ a_{1}=7,\ a_{2}=7+90,\ a_{3}=7+2\cdot(90),\ldots,a_{t+1}=7+90t,\ldots$ . A quick check shows that the first such three-digit number in the above arithmetic progression is $a_{3}=7+90(2)=187$ (obtained by setting $t=2$) and the last such three-digit number in the above progression is $a_{12}=7+90(11)=997$ (obtained by putting $t=11$ in the formula $a_{t+1}=7+90t$). Thus, we seek to find the sum, $a_{3}+a_{4}+\ldots+a_{11}+a_{12}$. We can use either of the two formulas developed in Example 2 (after example 1 which in turn is located below the proof of Theorem 2). Since we know the first and last terms of the sum at hand, namely $a_{3}$, it is easier to use the first formula in Example 2: $\begin{array}[]{rcl}a_{m}+a_{m+1}+\ldots+a_{n-1}+a_{n}&=&\frac{(n-m+1)(a_{m}+a_{n})}{2}\end{array}$ In our case $m=3,\ n=12,\ a_{m}=a_{3}=187$, and $a_{n}=a_{12}=997$. Thus $\begin{array}[]{rcl}a_{3}+a_{4}+\ldots+a_{11}+a_{12}&=&\frac{(12-3+1)\cdot(187+997)}{2}\\\ \\\ &=&\frac{10}{2}\cdot(1184)=5\cdot(1184)=5920.\end{array}$ 4. P4. Let $a_{1},a_{2},\ldots,a_{n},\ldots$, be an arithmetic progression with first term $a_{1}$ and positive difference $d$; and $M$ a natural number, such that $a_{1}\leq M$. Show that the number of terms of the arithmetic progression that do not exceed $M$, is equal to $\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$, where $\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]$ stands for the integer part of the real number $\frac{M-a_{1}}{d}$. Solution: If, among the terms of the arithmetic progression, $a_{n}$ is the largest term which does not exceed $M$, then $a_{n}\leq M$ and $a_{\ell}>M$, for all natural number $\ell$ greater than $n$; $\ell=n+1,n+2,\ldots$ . But $a_{n}=a_{1}+(n-1)d$; so that $a_{1}+(n-1)d\leq M\Rightarrow(n-1)d\leq M-a_{1}\Rightarrow n-1\leq\frac{M-a_{1}}{d}$ since $d>0$. Since, by definition, $\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]$ is the greatest integer not exceeding $\frac{M-a_{1}}{d}$ and since $n-1$ does not exceed $\frac{M-a_{1}}{d}$, we conclude that $n-1\leq\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]\Rightarrow n\leq\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$. But $n$ is a natural number, that is, a positive integer, and so must be the integer $N=\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$ Since $a_{n}$ was assumed to be the largest term such that $a_{n}\leq M$, it follows that $n$ must equal $N$; because the term $a_{N}$ is actually the largest term not exceeding $M$ (note that if $n<N$, then $a_{n}<a_{N}$, since the progression is increasing in view of the fact that $d>0$). Indeed, if $N=\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$, then by the definition of the integer part of a real number we must have $N-1\leq\frac{M-a_{1}}{d}<N$. Multiplying by $d>0$ yields $d(N-1)\leq M-a_{1}\Rightarrow a_{1}+d(N-1)\leq M\Rightarrow a_{N}\leq M$. In conclusion we see that the terms $a_{1},\ldots,a_{N}$ are precisely the terms not exceeding $\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$; therefore there are exactly $\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1$ terms not exceeding $M$. 5. P5. Apply the previous problem P4 to find the value of the sum of all natural numbers $k$ not exceeding $1,000$, and which are such that the remainder of the division of $k^{2}$ with $17$ is equal to $9$. Solution: First, we divide those numbers $k$ into two disjoint classes or groups. If $q$ is the quotient of the division of $k^{2}$ with $17$, and with remainder $9$, we must have, $k^{2}=17q+9\Leftrightarrow(k-3)(k+3)=17q,$ but $17$ is a prime number and as such it must divide at least one of the two factors $k-3$ and $k+3$; but it cannot divide both. Why? Because for any value of the natural number $k$, it is easy to see that the greatest common divisor of $k-3$ and $k+3$ is either equal to $1,2$, or $6$. Thus, we must have either $k-3=17n$ or $k+3=17m$; either $k=17n+3$ or $\begin{array}[]{rcl}k=17m-3&=&17(m-1)+14\\\ &=&17\cdot\ell+14\end{array}$ (here we have set $m-1=\ell$). The number $n$ is a nonnegative integer and the number $\ell$ is also a nonnegative integer. So the two disjoint classes of the natural numbers $k$ are, $\begin{array}[]{rrcl}&k&=&3,20,37,54,\ldots\\\ \\\ {\rm and}&k&=&14,31,48,65,\ldots\end{array}$ Next, we find how many numbers $k$ in each class do not exceed $M=10,000$. Here, we are dealing with two arithmetic progressions: the first being $3,20,37,54,\ldots,$ having first term $a_{1}=3$ and difference $d=17$. The second arithmetic progression has first term $b_{1}=14$ and the same difference $d=17$. According to the previous practice problem, P4, there are exactly $N_{1}=\left[\\!\left[\frac{M-a_{1}}{d}\right]\\!\right]+1=\left[\\!\left[\frac{1000-3}{17}\right]\\!\right]+1=\left[\\!\left[\frac{997}{17}\right]\\!\right]+1=58+1=59$ terms of the first arithmetic progression not exceeding $1000$ (also, recall from Chapter 6 that $\left[\\!\left[\frac{997}{17}\right]\\!\right]$ is really none other than the quotient of the division of $997$ with $17$). Again, applying problem P4 to the second arithmetic progression, we see that there are $N_{2}=\left[\\!\left[\frac{M-b_{1}}{d}\right]\\!\right]+1=\left[\\!\left[\frac{1000-14}{17}\right]\\!\right]+1=\left[\\!\left[\frac{986}{17}\right]\\!\right]+1=58+1=59$. Finally, we must find the two sums: $\begin{array}[]{rcl}S_{N_{1}}&=&a_{1}+\ldots+a_{N_{1}}=\frac{N_{1}\cdot(a_{1}+a_{N_{1}})}{2}=\frac{N_{1}\cdot\left[2a_{1}+(N_{1}-1)d\right]}{2}\\\ \\\ &=&\frac{59\cdot\left[2(3)+(59-1)\cdot 17\right]}{2}=\frac{59\cdot\left[6+(58)(17)\right]}{2}\end{array}$ and $\begin{array}[]{rcl}S_{N_{2}}&=&b_{1}\ldots+b_{N_{2}}=\frac{N_{2}\cdot\left[2b_{1}+(N_{2}-1)d\right]}{2}\\\ \\\ &=&\frac{59\cdot\left[2(14)+(59-1)17\right]}{2}=\frac{59\cdot\left[28+(58)(17)\right]}{2}\end{array}$ Hence, $\begin{array}[]{rcl}S_{N_{1}}+S_{N_{2}}&=&\frac{59\cdot\left[6+28+2(58)(17)\right]}{2}\\\ \\\ &=&\frac{59\left[34+1972\right]}{2}=\frac{59\cdot(2006)}{2}=59\cdot(1003)=59,177.\end{array}$ 6. P6. If $S_{n},\ S_{2n},\ S_{3n}$, are the sums of the first $n,\ 2n,\ 3n$ terms of an arithmetic progression, find the relation or equation between the three sums. Solution: We have $S_{n}=\frac{n\cdot\left[a_{1}+(n-1)d\right]}{2}$, $S_{2n}=\frac{2n\cdot\left[a_{1}+(2n-1)d\right]}{2}$, and $S_{3n}=\frac{3n\cdot\left[a_{1}+(3n-1)d\right]}{2}$. We can write $\begin{array}[]{rcl}S_{2n}&=&\frac{2n\cdot\left[2a_{1}+2(n-1)d+(d-a_{1})\right]}{2}\ {\rm and}\\\ \\\ S_{3n}&=&\frac{3n\cdot\left[3a_{1}+3(n-1)d+(2d-2a_{1})\right]}{2}.\end{array}$ So that, $S_{2n}=\frac{2n\cdot 2\cdot\left[a_{1}+(n-1)d\right]}{2}+\frac{2n\cdot(d-a_{1})}{2}$ (1) and $S_{3n}=\frac{3n\cdot 3\cdot\left[a_{1}+(n-1)d\right]}{2}+\frac{3n\cdot 2\cdot(d-a_{1})}{2}$ (2) To eliminate the product $n\cdot(d-a_{1})$ in equations (1) and (2) just consider $3S_{2n}-S_{3n}$: equations (1) and (2) imply, $\begin{array}[]{rcl}3S_{2n}-S_{3n}&=&\frac{3\cdot 2n\cdot 2\cdot\left[a_{1}+(n-1)d\right]}{2}-\frac{3n\cdot 3\cdot\left[a_{1}+(n-1)d\right]}{2}\\\ \\\ &&+\underset{0}{\underbrace{\frac{3\cdot 2n\cdot(d-a_{1})}{2}-\frac{3n\cdot 2\cdot(d-a_{1})}{2}}}\\\ \\\ \Rightarrow 3S_{2n}-S_{3n}&=&\frac{3n\cdot\left[a_{1}+(n-1)d\right]}{2}\end{array}$ but $S_{n}=\frac{n\cdot\left[a_{1}+(n-1)d\right]}{2}$; hence the last equation yields $\begin{array}[]{rl}&3S_{2n}-S_{3n}=3\cdot S_{n}\\\ \\\ \Rightarrow&\framebox{$3S_{2n}=3S_{n}+S_{3n}$};\\\ \\\ {\rm or}&3(S_{2n}-S_{n})=S_{3n}\end{array}$ 7. P7. If the first term of an arithmetic progression is equal to some real number $a$, and the sum of the first $m$ terms is equal to zero, show that the sum of the next $n$ terms must equal to $\frac{a\cdot m(m+n)}{1-m}$; here, we assume that $m$ and $n$ are natural numbers with $m>1$ Solution: We have $a_{1}+\ldots+a_{m}=0=\frac{m\cdot\left[2a_{1}+d(m-1)\right]}{2}\Rightarrow$ (since $m>1$) $2a_{1}+d(m-1)=0\Rightarrow d=\frac{-2a_{1}}{m-1}=\frac{2a_{1}}{1-m}=\frac{2a}{1-m}$. Consider the sum of the next $n$ terms $\begin{array}[]{rcl}a_{m+1}+\ldots+a_{m+n}&=&\frac{n\cdot(a_{m+1}+a_{m+n})}{2};\\\ \\\ a_{m+1}+\ldots+a_{m+n}&=&\frac{n\cdot\left[(a_{1}+md)+(a_{1}+(m+n-1)d)\right]}{2};\\\ \\\ a_{m+1}+\ldots+a_{m+n}&=&\frac{n\cdot\left[2a_{1}+(2m+n-1)d\right]}{2}\end{array}$ Now substitute for $d=\frac{2a}{1-m}$: (and of course, $a=a_{1}$) $\begin{array}[]{rcl}a_{m+1}+\ldots+a_{m+n}&=&\frac{n[2a+(2m+n-1)\cdot\frac{2a}{1-m}]}{2};\\\ \\\ a_{m+1}+\ldots+a_{m+n}&=&\frac{n\cdot 2a[(1-m)+(2m+n-1)]}{2(1-m)};\\\ \\\ a_{m+1}+\ldots+a_{m+n}&=&\frac{2an[1-m+2m+n-1]}{2(1-m)}=\frac{a\cdot n\cdot(m+n)}{1-m}\end{array}$ 8. P8. Suppose that the sum of the $m$ first terms of an arithmetic progression is $n$; and thesum of the first $n$ terms is equal to $m$. Furthermore, suppose that the first term is $\alpha$ and the difference is $\beta$, where $\alpha$ and $\beta$ are given real numbers. Also, assume $m\neq n$ and $\beta\neq 0$. 1. (a) Find the sum of the first $(m+n)$ in terms of the constants $\alpha$ and $\beta$ only. 2. (b) Express the integer $mn$ and the difference $(m-n)$ in terms of $\alpha$ and $\beta$. 3. (c) Drop the assumption that $m\neq n$, and suppose that both $\alpha$ and $\beta$ are integers. Describe all such arithmetic progressions. Solution: 1. (a) We have $a_{1}+\ldots+a_{m}=n$ and $a_{1}+\ldots+a_{n}=m$; $\frac{m\cdot[2\alpha+(m-1)\beta]}{2}=n\ \ {\rm and}\ \ \frac{n\cdot[2\alpha+(n-1)\beta]}{2}=m,$ since $a_{1}=\alpha$ and $d=\beta$. Subtracting the second equation from the first one to obtain, $\begin{array}[]{rcl}2\alpha\cdot(m-n)&+&\beta\cdot[m(m-1)-n(n-1)]=2n-2m;\\\ 2\alpha\cdot(m-n)&+&\beta\cdot[(m^{2}-n^{2})-(m-n)]+2(m-n)=0;\\\ 2\alpha\cdot(m-n)&+&\beta\cdot[(m-n)(m+n)-(m-n)]+2(m-n)=0;\\\ 2\alpha\cdot(m-n)&+&\beta\cdot(m-n)\cdot[m+n-1]+2(m-n)=0;\end{array}$ $(m-n)\cdot[2\alpha+\beta(m+n-1)+2]=0$; but $m-n\neq 0$, since $m\neq n$ by the hypothesis of the problem. Thus, $\begin{array}[]{ll}&2\alpha+\beta\cdot(m+n-1)+2=0\Rightarrow\beta(m+n-1)=-2(1+a)\\\ \\\ \Rightarrow&m+n-1=\frac{-2(1+a)}{\beta}\Rightarrow m+n=1-\frac{2(1+\alpha)}{\beta}=\frac{\beta-2\alpha-2}{\beta}.\end{array}$ Now, we compute the sum $a_{1}+\ldots+a_{m+n}=\frac{(m+n)\cdot[2\alpha+(m+n-1)\beta]}{2}$ $\begin{array}[]{rl}\Rightarrow&a_{1}+\ldots+a_{m+n}=\frac{\left(\frac{\beta-2\alpha-2}{\beta}\right)\cdot\left[2\alpha\left(\frac{\beta-2\alpha-2}{\beta}\right)\cdot\beta\right]}{2};\\\ \\\ &a_{1}+\ldots+a_{m+n}=\framebox{$\frac{\left(\beta-2\alpha-2\right)\cdot\left(\beta-2\right)}{2\beta}$}\end{array}$ 2. (b) If we multiply the equations $\frac{m\cdot[2\alpha+(m-1)\beta]}{2}=n$ and $\frac{n\cdot[2\alpha+(n-1)\beta]}{2}=m$ member-wise we obtain, $\frac{m\cdot n\cdot[2\alpha+(n-1)\beta][2\alpha+(m-1)\beta]}{4}=mn$ and since $mn\neq 0$, we arrive at $\begin{array}[]{rl}&[2\alpha+(n-1)\beta]\cdot[2\alpha+(m-1)\beta]=4\\\ \\\ \Rightarrow&4\alpha^{2}+2\alpha\beta\cdot(m-1+n-1)+(n-1)(m-1)\beta^{2}=4\\\ \\\ \Rightarrow&4\alpha^{2}+2\alpha\beta\cdot(m+n)-4\alpha\beta+nm\beta^{2}-(n+m)\beta^{2}+\beta^{2}=4;\\\ \\\ &(2\alpha-\beta)^{2}+(m+n)\cdot(2\alpha\beta-\beta^{2})+nm\beta^{2}=4.\end{array}$ Now let us substitute for $m+n=\frac{\beta-2\alpha-2}{\beta}$ (from part (a)) in the last equation above; we have, $\begin{array}[]{rl}&(2\alpha-\beta)^{2}+\left(\frac{\beta-2\alpha-2}{\beta}\right)\cdot\beta\cdot(2\alpha-\beta)+nm\beta^{2}=4\\\ \\\ \Rightarrow&(2\alpha-\beta)^{2}+(\beta-2\alpha-2)(2\alpha-\beta)+nm\beta^{2}=4\\\ \\\ \Rightarrow&4\alpha^{2}-4\alpha\beta+\beta^{2}+2\alpha\beta-\beta^{2}-4\alpha^{2}+4\alpha\beta-4\alpha+2\beta+nm\beta^{2}=4\\\ \\\ \Rightarrow&nm\beta^{2}+2\alpha\beta-4\alpha+2\beta=4\Rightarrow nm\beta^{2}=4-2\alpha\beta+4\alpha-2\beta\\\ \\\ \Rightarrow&\framebox{$nm=\frac{2\cdot(2-\alpha\beta+2\alpha-\beta)}{\beta^{2}}$}\end{array}$ Finally, from the identity $(m-n)^{2}=(m+n)^{2}-4nm$, it follows that $\begin{array}[]{rl}&(m-n)^{2}=\left(\frac{\beta-2\alpha-2}{\beta}\right)^{2}-\frac{8(2-\alpha\beta+2\alpha-\beta)}{\beta^{2}}\\\ \\\ \Rightarrow&(m-n)^{2}=\frac{\beta^{2}+4\alpha^{2}+4-4\alpha\beta-4\beta+8\alpha-16+8\alpha\beta-16\alpha+8\beta}{\beta^{2}}\\\ \\\ &(m-n)^{2}=\frac{\beta^{2}+4\alpha^{2}-12+4\alpha\beta+4\beta-8\alpha}{\beta^{2}};\\\ \\\ &|m-n|=\frac{\sqrt{\beta^{2}+4\alpha^{2}-12+4\alpha\beta+4\beta-8\alpha}}{|\beta|}\\\ &=\frac{\sqrt{(2\alpha+\beta)^{2}-12+4\beta-8\alpha}}{|\beta|};\\\ \\\ &\framebox{$m-n=\pm\frac{\sqrt{(2\alpha+\beta)^{2}-12+4\beta-8\alpha}}{|\beta|}$}\end{array}$ the choice of the sign depending on whether $m>n$ or $m<n$ respectively. Also note, that a necessary condition that must hold here is $(2\alpha+\beta)^{2}-12+4\beta-8\alpha>0.$ 3. (c) Now consider $\dfrac{m[2\alpha+(m-1)\beta]}{2}=n$ and $\dfrac{n[2\alpha+(n-1)\beta]}{2}=m$, with $\alpha$ and $\beta$ being integers. There are four cases. Case 1: Suppose that $m$ and $n$ are odd. Then we see that $m\mid n$ and $n\mid m$, which implies $m=n$ (since $m,n$ are positive integers; if they are divisors of each other, they must be equal). We obtain, $2\alpha+(n-1)\beta=2\Leftrightarrow n=\dfrac{\beta+2-2\alpha}{\beta}=1+\dfrac{2(1-\alpha)}{\beta};\ \beta\mid 2(1-\alpha).$ If $\beta$ is odd, it must be a divisor of $1-\alpha$. Put $1-\alpha=\beta\rho$ and so $n=1+2\rho$, with $\rho$ being a positive integer. So, the solution is $m=n=1+2\rho,\ \ \alpha=1-\beta\rho,\ \ \rho\in\mathbb{Z}^{+},\ \ \beta\in\mathbb{Z}$ If $\beta$ is even, set $\beta=2B$. We obtain $1-\alpha-B\rho$, for some odd integer $\rho\geq 1$. The solution is $m=n=1+\rho,\ \ \alpha=1-B\rho,\ \ \beta=2B,\ \ \rho\ {\rm an\ odd\ positive\ integer}$. Case 2: Suppose that $m$ is even, $n$ is odd; put $m=2k$. We obtain $k\left[2\alpha+(2k-1)\beta\right]=n\ {\rm and}\ n\left[2\alpha+(n-1)\beta\right]=4k.$ Since $n$ is odd, $n$ must be a divisor of $k$ and since $k$ is also a divisor of $n$, we conclude that since $n$ and $k$ are positive, we must have $n=k$. So, $2\alpha+(2n-1)\beta=1$ and $2\alpha+(n-1)\beta=4$. From which we obtain $n\beta=-3\Leftrightarrow(n=1\ {\rm and}\ \beta=-3)$ or $(n=3\ {\rm and}\ \beta=01$). The solution is $\begin{array}[]{rl}&n=1,\ \beta=-3,\ m=2,\ \alpha=2\\\ {\rm or}&n=3,\ \beta=-1,\ m=6,\ \alpha=3\end{array}$ Case 3: $m$ odd and $n$ even. This is exactly analogous to the previous case. One obtains the solutions (just switch $m$ and $n$) $\begin{array}[]{l}m=1,\ \beta=-3,\ n=2,\ \alpha=2\\\ m=3,\ \beta=-1,\ n=6,\ \alpha=3\end{array}$ Case 4: Assume $m$ and $n$ to be both even. Set $m=2^{e}_{m_{1}},n=2^{f}_{n_{1}}$, where $e,f$ are positive integers and $m_{1},n_{1}$ are odd positive integers. Since $n-1$ and $m-1$ are odd, by inspection we see that $\beta$ must be even. We have, $\left\\{\begin{array}[]{rl}&2^{e}\cdot m_{1}\cdot\left[2\alpha+\left(2^{3}_{m_{1}}-1\right)\cdot\beta\right]=2^{f+1}\cdot n_{1}\\\ \\\ {\rm and}&2^{f}\cdot n_{1}\cdot\left[2\alpha+\left[2\alpha+\left(2^{f}_{n_{1}}-1\right)\cdot\beta\right]\right]=2^{e+1}\cdot m_{1}.\end{array}\right.$ We see that the left-hand side of the first equation is divisible by a power of 2 which is at least $2^{e+1}$; and the left-hand side of the equation is divisible by at least $2^{f+1}$. This then implies that $e+1\leq f+1$ and $f+1\leq e+1$. Hence $e=f$. Consequently, $\begin{array}[]{rcll}m_{1}\left[2\alpha+\left(2^{e}_{m_{1}}-1\right)\beta\right]&=&2_{n_{1}}&{\rm and}\\\ \ n_{1}\left[2\alpha+\left(2^{e}_{n_{1}}-1\right)\beta\right]&=&2m_{1}&\end{array}$ Let $\beta=2k$. By cancelling the factor 2 from both sides of the two equations, we infer that $m_{1}$ is a divisor of $n_{1}$ and $n_{1}$ a divisor of $m_{1}$. Thus $m_{1}=n_{1}$. The solution is $\begin{array}[]{l}\alpha=1-\left(2^{e}\cdot n_{1}-1\right)k\\\ \\\ \beta=2k\\\ \\\ m=2^{e}_{n_{1}}=n\end{array}$ , where $k$ is an arbitrary integer, $e$ is a positive integer, and $n_{1}$ can be any odd positive integer. 9. P9. Prove that if the real numbers $\alpha,\beta,\gamma,\delta$ are successive terms of a harmonic progression, then $3(\beta-\alpha)(\delta-\gamma)=(\gamma-\beta)(\delta-\alpha).$ Solution: Since $\alpha,\beta,\gamma,\delta$ are members of a harmonic progression they must all be nonzero; $\alpha\beta\gamma\delta\neq 0$. Thus $3(\beta-\alpha)(\delta-\gamma)=(\gamma-\beta)(\delta-\alpha)$ is equivalent to $\frac{3(\beta-\alpha)(\delta-\gamma)}{\alpha\beta\gamma\delta}=\frac{(\gamma-\beta)(\delta-\alpha)}{\alpha\beta\gamma\delta}$ $\begin{array}[]{rl}\Leftrightarrow&3\cdot\left(\frac{\beta-\alpha}{\beta\alpha}\right)\cdot\left(\frac{\delta-\gamma}{\delta\gamma}\right)=\left(\frac{\gamma-\beta}{\gamma\beta}\right)\cdot\left(\frac{\delta-\alpha}{\alpha\delta}\right)\\\ \\\ \Leftrightarrow&3\cdot\left(\frac{1}{\alpha}-\frac{1}{\beta}\right)\cdot\left(\frac{1}{\gamma}-\frac{1}{\delta}\right)=\left(\frac{1}{\beta}-\frac{1}{\gamma}\right)\cdot\left(\frac{1}{\alpha}-\frac{1}{\delta}\right)\end{array}$ By definition, since $\alpha,\beta,\gamma,\delta$ are consecutive terms of a harmonic progression; the numbers $\frac{1}{\alpha},\frac{1}{\beta},\frac{1}{\gamma},\frac{1}{\delta}$ must be successive terms of an arithmetic progression with difference $d$; and $\frac{1}{\alpha}-\frac{1}{\beta}=-d,\ \frac{1}{\gamma}-\frac{1}{\delta}=-d$, $\frac{1}{\beta}-\frac{1}{\gamma}=-d$, and $\frac{1}{\alpha}-\frac{1}{\delta}=-3d$ (since $\frac{1}{\delta}=\frac{1}{\gamma}+d=\frac{1}{\beta}+2d=\frac{1}{\alpha}+3d$). Thus the above statement we want to prove is equivalent to $3\cdot(-3)\cdot(-d)=(-d)\cdot(-3d)\Leftrightarrow 3d^{2}=3d^{2}$ which is true. 10. P10. Suppose that $m$ and $n$ are fixed natural numbers such that the $m$th term $a_{m}$ in a harmonic progression is equal to $n$; and the $n$th term $a_{n}$ is equal to $m$. We assume $m\neq n$. 1. (a) Find the $(m+n)$th term $a_{m+n}$ in terms of $m$ and $n$ . 2. (b) Determine the general $k$th term $a_{k}$ in terms of $k,m$, and $n$. Solution: 1. (a) Both $\frac{1}{a_{m}}$ and are the $m$th and $n$th terms respectively of an arithmetic progression with first term $\frac{1}{a_{1}}$ and difference $d$; so that $\frac{1}{a_{m}}=\frac{1}{a_{1}}+(m-1)d$ and $\frac{1}{a_{n}}=\frac{1}{a_{1}}+(n-1)d$. Subtracting the second equation from the first and using the fact that $a_{m}=n$ and $a_{n}=m$ we obtain, $\frac{1}{n}-\frac{1}{m}=(m-n)d\Rightarrow\frac{m-n}{nm}=(m-n)d$; but $m-n\neq 0$; cancelling the factor $(m-n)$ from both sides, gives $\frac{1}{mn}=d$. Thus from the first equation , $\frac{1}{n}=\frac{1}{a_{1}}+(m-1)\cdot\frac{1}{mn}\Rightarrow\frac{1}{n}-\frac{(m-1)}{mn}=\frac{1}{a_{1}}\Rightarrow\frac{m-(m-1)}{mn}=\frac{1}{a_{1}};\ \frac{1}{mn}=\frac{1}{a_{1}}\Rightarrow\framebox{$a_{1}=mn$}$. Therefore, $\frac{1}{a_{m+n}}=\frac{1}{a_{1}}+(m+n-1)d\Rightarrow\frac{1}{a_{m+n}}=\frac{1}{mn}+\frac{m+n-1}{mn}\Rightarrow\framebox{${a}_{m+n}=\frac{mn}{m+n}$}$. 2. (b) We have $\frac{1}{a_{k}}=\frac{1}{a_{1}}+(k-1)d\Rightarrow\frac{1}{a_{k}}=\frac{1}{mn}+\frac{(k-1)}{mn}=\frac{k}{mn}\Rightarrow\framebox{$a_{k}=\frac{mn}{k}$}$ . 11. P11. Use mathematical induction to prove that if $a_{1},a_{2},\ldots,a_{n}$, with $n\geq 3$, are the first $n$ terms of a harmonic progression, then $(n-1)a_{1}a_{n}=a_{1}a_{2}+a_{2}a_{3}+\ldots+a_{n-1}a_{n}$. Solution: For $n=3$ the statement is $2a_{1}a_{3}=a_{1}a_{2}+a_{2}a_{3}\Leftrightarrow a_{2}\cdot(a_{1}+a_{3})=2a_{1}a_{3}$; but $a_{1},a_{2},a_{3}$ are all nonzero since they are the first three terms of a harmonic progression. Thus, the last equation is equivalent to $\frac{2}{a_{2}}=\frac{a_{1}+a_{d}}{a_{1}a_{3}}\Leftrightarrow\frac{2}{a_{2}}=\frac{1}{a_{3}}+\frac{1}{a_{1}}$ which is true, because $\frac{1}{a_{1}},\frac{1}{a_{2}},\frac{1}{a_{3}}$ are the first three terms of a harmonic expression. The inductive step: prove that whenever the statement holds true for some natural number $n=k\geq 3$, then it must also hold true for $n=k+1$. So we assume $(k-1)a_{1}a_{k}=a_{1}a_{2}+a_{2}a_{3}+\ldots+a_{k-1}a_{k}$. Add $a_{k}a_{k+1}$ to both sides to obtain, $(k-1)a_{1}a_{k}+a_{k}a_{k+1}=a_{1}a_{2}+a_{2}a_{3}+\ldots+a_{k-1}a_{k}+a_{k}a_{k+1}$ (1) If we can show that the left-hand side of (1) is equal to $ka_{1}a_{k+1}$, the induction process will be complete. So we need to show that $(k-1)a_{1}a_{k}+a_{k}a_{k+1}=k\cdot a_{1}\cdot a_{k+1}$ (2) (dividing both sides of the equation by $a_{1}\cdot a_{k}\cdot a_{k+1}\neq 0$) $\Leftrightarrow\frac{(k-1)}{a_{k+1}}+\frac{1}{a_{1}}=\frac{k}{a_{k}}.$ (3) To prove (3), we can use the fact that $\frac{1}{a_{k+1}}$ and $\frac{1}{a_{k}}$ are the $(k+1)$th and $k$th terms of an arithmetic progression with first term $\frac{1}{a_{1}}$ and ratio $d$: $\frac{1}{a_{k+1}}=\frac{1}{a_{1}}+k\cdot d$ and $\frac{1}{a_{k}}=\frac{1}{a_{1}}+(k-1)d$; so that, $\frac{k-1}{a_{k+1}}=\frac{k-1}{a_{1}}+(k-1)kd$ and $\frac{k}{a_{k}}=\frac{k}{a_{1}}+k(k-1)d$. Subtracting the second equation from the first yields, $\frac{k-1}{a_{k+1}}-\frac{k}{a_{k}}=\frac{(k-1)-k}{a_{1}}\Rightarrow\frac{k-1}{a_{k+1}}+\frac{1}{a_{1}}=\frac{k}{a_{k}}$ which establishes (3) and thus equation (2). The induction is complete since we have show (by combining (1) and (3)). $k\cdot a_{1}a_{k+1}=a_{1}a_{2}+a_{2}a_{3}+\ldots+a_{k-1}a_{k}+a_{k}a_{k+1},$ the statement also holds for $n=k+1$. 12. P12. Find the necessary and sufficient condition that three natural numbers $m,n$, and $k$ must satisfy, in order that the positive real numbers $\sqrt{m},\sqrt{n},\sqrt{k}$ be consecutive terms of a geometric progression. Solution: According to Theorem 7, the three positive reals will be consecutive terms of an arithmetic progression if, and only if, $(\sqrt{n})^{2}=\sqrt{m}\sqrt{k}\Leftrightarrow n=\sqrt{mk}\Leftrightarrow$ (since both $n$ and $mk$ are positive) $n^{2}=mk$. Thus, the necessary and sufficient condition is that the product of $m$ and $k$ be equal to the square of $n$. 13. P13. Show that if $\alpha,\beta,\gamma$ are successive terms of an arithmetic progression, $\beta,\gamma,\delta$ are consecutive terms of a geometric progression, and $\gamma,\delta,\epsilon$ are the successive terms of a harmonic progression, then either the numbers $\alpha,\gamma,\epsilon$ or the numbers $\epsilon,\gamma,\alpha$ must be the consecutive terms of a geometric progression. Solution: Since $\frac{1}{\gamma},\frac{1}{\delta},\frac{1}{\epsilon}$ are by definition successive terms of an arithmetic progression and the same holds true for $\alpha,\beta,\gamma$, Theorem 3 tells us that we must have $2\beta=\alpha+\gamma$ (1) and $\frac{2}{\delta}=\frac{1}{\gamma}+\frac{1}{\epsilon}$ (2). And by Theorem 7, we must also have $\gamma^{2}=\beta\delta$ (3). (Note that $\gamma,\delta$, and $\epsilon$ must be nonzero and thus so must be $\beta$.) Equation (2) implies $\delta=\frac{2\gamma\epsilon}{\gamma+\epsilon}$ and equation (1) implies $\beta=\frac{\alpha+\gamma}{2}$. Substituting for $\beta$ and $\delta$ in equation (3) we now have $\begin{array}[]{rl}&\gamma^{2}=\left(\frac{\alpha+\gamma}{2}\right)\cdot\left(\frac{2\gamma\epsilon}{\gamma+\epsilon}\right)\\\ \\\ \Rightarrow&\gamma^{2}\cdot(\gamma+\epsilon)=(\alpha+\gamma)\cdot\gamma\epsilon\Rightarrow\gamma^{3}+\gamma^{2}\epsilon=\alpha\gamma\epsilon+\gamma^{2}\epsilon\\\ \\\ \Rightarrow&\gamma^{3}-\alpha\gamma\epsilon=0\Rightarrow\gamma(\gamma^{2}-\alpha\epsilon)=0\end{array}$ and since $\gamma\neq 0$ we conclude $\gamma^{2}-\alpha\epsilon=0\Rightarrow\gamma^{2}=\alpha\epsilon$, which, in accordance with Theorem 7, proves that either $\alpha,\gamma,\epsilon$; or $\epsilon,\gamma,\alpha$ are consecutive terms in a geometric progression. 14. P14. Prove that if $\alpha$ is the arithmetic mean of the numbers $\beta$ and $\gamma$; and $\beta$, nonzero, the geometric mean of $\alpha$ and $\gamma$, then $\gamma$ must be the harmonic mean of $\alpha$ and $\beta$. (Note: the assumption $\beta\neq 0$, together with the fact that $\beta$ is the geometric mean of $\alpha$ and $\gamma$, does imply that both $\alpha$ and $\gamma$ must be nonzero as well.) Solution: From the problems assumptions we must have $2\alpha=\beta+\gamma$ and $\beta^{2}=\alpha\gamma$; $\beta^{2}=\alpha\gamma\Rightarrow 2\beta^{2}=2\alpha\gamma$; substituting for $2\alpha=\beta+\gamma$ in the last equation produces $\begin{array}[]{rl}&2\beta^{2}=(\beta+\gamma)\gamma\Rightarrow 2\beta^{2}=\beta\gamma+\gamma^{2}\\\ \\\ \Rightarrow&2\beta^{2}-\gamma^{2}-\beta\gamma=0\Rightarrow(\beta^{2}-\gamma^{2})+(\beta^{2}-\beta\gamma)=0\\\ \\\ \Rightarrow&(\beta-\gamma)(\beta+\gamma)+\beta\cdot(\beta-\gamma)=0\Rightarrow(\beta-\gamma)\cdot(2\beta+\gamma)=0.\end{array}$ If $\beta-\gamma\neq 0$, then the last equation implies $2\beta+\gamma=0\Rightarrow\gamma=-2\beta$; and thus from $2a=\beta+\gamma$ we obtain $2\alpha=\beta-2\beta$; $2\alpha=-\beta$; $\alpha=-\beta/2$. Now compute, $\frac{2}{\gamma}=\frac{2}{-2\beta}=-\frac{1}{\beta}$, since $\beta\neq 0$; and $\frac{1}{\alpha}+\frac{1}{\beta}=\frac{1}{-\frac{\beta}{2}}+\frac{1}{\beta}=-\frac{2}{\beta}+\frac{1}{\beta}=-\frac{1}{\beta}$. Therefore $\frac{2}{\gamma}=\frac{1}{\alpha}+\frac{1}{\beta}$, which proves that $\gamma$ is the harmonic mean of $\alpha$ and $\beta$. Finally, by going back to the equation $(\beta-\gamma)(2\beta+\gamma)=0$ we consider the other possibility, namely $\beta-\gamma=0$; $\beta=\gamma$ (note that $\beta-\gamma$ and $2\beta+\gamma$ cannot both be zero for this would imply $\beta=0$, violating the problem’s assumption that $\beta\neq 0$). Since $\beta=\gamma$ and $2\alpha=\beta+\gamma$, we conclude $\alpha=\beta=\gamma$. And then trivially, $\frac{2}{\gamma}=\frac{1}{\alpha}+\frac{1}{\beta}$, so we are done. 15. P15. We partition the set of natural numbers in disjoint classes or groups as follows: $\\{1\\},\\{2,3\\},\\{4,5,6\\},\\{7,8,9,10\\},\ldots$; the $n$th class contains $n$ consecutive positive integers starting with $\frac{n\cdot(n-1)}{2}+1$. Find the sum of the members of the $n$th class. Solution: First let us make clear why the first member of $n$th class is the number $\frac{n(n-1)}{2}+1$; observe that the $n$th class is preceded by $(n-1)$ classes; so since the $k$th class, $1\leq k\leq n-1$, contains exactly $k$ consecutive integers, then there precisely $(1+2+\ldots+k+\ldots+(n-1))$ consecutive natural numbers preceding the $n$th class; but the sum $1+2+\ldots+(n-2)+(n-1)$ is the sum of the first $(n-1)$ terms of the infinite arithmetic progression that has first term $a_{1}=1$ difference $d=1$, hence $\begin{array}[]{rcl}1+2+\ldots+(n-1)&=&a_{1}+a_{2}+\ldots+a_{n-1}=\frac{(n-1)\cdot(a_{1}+a_{n-1})}{2}\\\ \\\ &=&\frac{(n-1)(1+(n-1))}{2}=\frac{(n-1)\cdot n}{2}.\end{array}$ This explains why the $n$th class starts with the natural number $\frac{n(n-1)}{2}+1$; the members of the $n$th class are the numbers $\frac{n(n-1)}{2}+1,\ \frac{n(n-1)}{2}+2,\ldots,\frac{n(n-1)}{2}+n$. These $n$ numbers form a finite arithmetic progression with first term $\underset{a}{\underbrace{\frac{n(n-1)}{2}+1}}$ and difference $d=1$. Hence their sum is equal to $\begin{array}[]{rcl}\frac{n\cdot[2a+(n-1)d]}{2}&=&\frac{n\cdot\left[2\left(\frac{n(n-1)}{2}+1\right)+(n-1)\right]}{2}\\\ \\\ &=&\frac{n\cdot[n(n-1)+2+n-1]}{2}=\frac{n\cdot[n^{2}-n+2+n-1]}{2}=\framebox{$\frac{n\cdot(n^{2}+1)}{2}$}\end{array}$ 16. P16. We divide 8,000 objects into $(n+1)$ groups of which the first $n$ of them contain $5,8,11,14,\ldots,[5+3\cdot(n-1)]$ objects respectively; and the $(n+1)$th group contains fewer than $(5+3n)$ objects; find the value of the natural number $n$ and the number of objects that the $(n+1)$th group contains. Solution: The total number of objects that first $n$ groups contain is equal to, $S_{n}=5+8+11+14+\ldots+[5+3(n-1)]$; this sum, $S_{n}$, is the sum of the first $n$ terms of the infinite arithmetic progression with first term $a_{1}=5$ and difference $d=3$; so that its $n$th term is $a_{n}=5+3(n-1)$. According to Theorem 2, $S_{n}=\frac{n\cdot[a_{1}+a_{n}]}{2}=\frac{n\cdot[5+5+3(n-1)]}{2}=\frac{n\cdot[5+5+3n-3]}{2}=\frac{n\cdot(7+3n)}{2}$. Thus, the $(n+1)$th group must contain, $8,000-\frac{n(7+3n)}{2}$ objects. By assumption, the $(n+1)$th group contains fewer than $(5+3n)$ objects. Also $8,000-\frac{n(7+3n)}{2}$ must be a nonnegative integer, since it represents the number of objects in a set (the $(n+1)$th class; theoretically this number may be zero). So we have two simultaneous inequalities to deal with: $0\leq 8,000-\frac{n(7+3n)}{2}\Leftrightarrow\frac{n(7+3n)}{2}\leq 8,000;\ \ n(7+3n)\leq 16,000.$ And (the other inequality) $\begin{array}[]{rcl}8,000-\frac{n(7+3n)}{2}&<&5+3n\Leftrightarrow 16,000-n(7+3n)<10+6n\Leftrightarrow 16,000\\\ &<&3n^{2}+13n+10\Leftrightarrow 16,000<(3n+10)(n+1).\end{array}$ So we have the following system of two simultaneous inequalities $\left.\begin{array}[]{rc}&n(7+3n)\leq 16,000\\\ \\\ {\rm and}&16,000<(3n+10)(n+1)\end{array}\right\\}\begin{array}[]{c}(1)\\\ \\\ (2)\end{array}$ Consider (1): At least one of the factors $n$ and $7+3n$ must be less than or equal to $\sqrt{16,000}$; for if both were greater than $\sqrt{16,000}$ then their product would exceed $\sqrt{16,000}\cdot\sqrt{16,000}=16,000$, contradicting inequality (1); and since $n<7+3n$, it is now clear that the natural number $n$ cannot exceed $\sqrt{16,000}:n\leq\sqrt{16,000}\Leftrightarrow n\leq\sqrt{16\cdot 10^{3}};\ n\leq 4\cdot\sqrt{10^{2}\cdot 10};\ n\leq 4\cdot 10\cdot\sqrt{10}=40\sqrt{10}$ so $40\sqrt{10}$ is a necessary upper bound for $n$. The closest positive integer to $40\sqrt{10}$, but less than $40\sqrt{10}$ is the number $126$; but actually, an upper bound for $n$ must be much less than $126$ in view of the factor $7+3n$. If we consider (1), we have $3n^{2}+7n-16,000\leq 0$ (3) The two roots of the quadratic equation $3x^{2}+7x-16,000=0$ are the real numbers $r_{1}=\frac{-7+\sqrt{(7)^{2}-4(3)(-16,000)}}{6}=\frac{-7+\sqrt{192,049}}{6}=\approx$${\rm approximately}\ 71.872326$; and $r_{2}=\frac{-7-\sqrt{192,049}}{6}\approx-74.20566$. Now, it is well known from precalculus that if $r_{1}$ and $r_{2}$ are the two roots of the quadratic polynomial $ax^{2}+bx+c$, then $ax^{2}+bx+c=a\cdot(x-r_{1})(x-r_{2})$, for all real numbers $x$. In our case $3x^{2}+7x-16,000=3\cdot(x-r_{1})(x-r_{2})$, where $r_{1}$ and $r_{2}$ are the above calculated real numbers. Thus, in order for the natural number $n$ to satisfy the inequality (3), $3n^{2}+7n-16,000\leq 0$; it must satisfy $3(n-r_{1})(n-r_{2})\leq 0$; but this will only be true if, and only if, $r_{1}\leq n\leq r_{2}$; $-74.20566\leq n\leq 71.872326$; but $n$ is a natural number; thus $1\leq n\leq 71$; this upper bound for $n$ is much lower than the upper bound of the upper bound $126$ that we estimated more crudely earlier. Now consider inequality (2): it must hold true simultaneously with (1); which means we have, $\left.\begin{array}[]{rl}&16,000<(3n+10)\cdot(n+1)\\\ \\\ {\rm and}&1\leq n\leq 71\end{array}\right\\}$ If we take the highest value possible for $n$; namely $n=71$, we see that $(3n+10)(n+1)=(3\cdot(71)+10)\cdot(72)=(223)(72)=16,052$ which exceeds the number $16,000$, as desired. But, if we take the next smaller value, $n=70$, we have $(3n+10)(n+1)=(220)(71)=15,620$ which falls below $16,000$. Thus, this problem has a unique solution, $n=71$. The total number of objects in the first $n$ groups (or 71 groups) is then equal to, $\frac{n\cdot(7+3n)}{2}=\frac{(7)\cdot(7+3(7))}{2}=\frac{(71)\cdot(220)}{2}=(71)\cdot(110)-7,810.$ Thus, the $(n+1)$th or $72$nd group contains, $8,000-7,810=\framebox{190}$ objects; note that $190$ is indeed less that $5n+3=5(71)+3=358$. 17. P17. 1. (a) Show that the real numbers $\frac{\sqrt{2}+1}{\sqrt{2}-1},\ \frac{1}{2-\sqrt{2}},\ \frac{1}{2}$, can be three consecutive terms of a geometric progression. Find the ratio $r$ of any geometric progression that contains these three numbers as consecutive terms. 2. (b) Find the value of the infinite sum of the terms of the (infinite) geometric progression whose first three terms are the numbers $\frac{\sqrt{2}+1}{\sqrt{2}-1},\ \frac{1}{2-\sqrt{2}},\ \frac{1}{2};\ \left(\frac{\sqrt{2}+1}{\sqrt{2}-1}\right)+\left(\frac{1}{2-\sqrt{2}}\right)+\frac{1}{2}+\ldots$ . Solution: 1. (a) Apply Theorem 7: the three numbers will be consecutive terms of a geometric progression if, and only if, $\left({\displaystyle\frac{1}{2-\sqrt{2}}}\right)^{2}={\displaystyle\frac{(\sqrt{2}+1)}{(\sqrt{2}-1)}}\cdot\frac{1}{2}$ (1) Compute the left-hand side: $\begin{array}[]{rcl}{\displaystyle\frac{1}{(2-\sqrt{2})^{2}}}&=&{\displaystyle\frac{1}{4-4\sqrt{2}+2}}={\displaystyle\frac{1}{6-4\sqrt{2}}}\\\ \\\ &=&{\displaystyle\frac{1}{2(3-2\sqrt{2})}}={\displaystyle\frac{3+2\sqrt{2}}{2\cdot(3-2\sqrt{2})(3+2\sqrt{2})}}\\\ \\\ &=&{\displaystyle\frac{3+2\sqrt{2}}{2\cdot[9-8]}}={\displaystyle\frac{3+2\sqrt{2}}{3}}.\end{array}$ Now we simplify the right-hand side: $\begin{array}[]{rcl}\left({\displaystyle\frac{\sqrt{2}+1}{\sqrt{2}-1}}\right)\cdot{\displaystyle\frac{1}{2}}&=&{\displaystyle\frac{1}{2}\cdot\frac{(\sqrt{2}+1)^{2}}{(\sqrt{2}-1)(\sqrt{2}+1)}}\\\ \\\ &=&{\displaystyle\frac{1}{2}\cdot\frac{(2+2\sqrt{2}+1)}{(2-1)}=\frac{3+\sqrt{2}}{2}}\end{array}$ so the two sides of (1) are indeed equal; (1) is a true statement. Thus, the three numbers can be three consecutive terms in a geometric progression. To find $r$, consider $\left(\frac{\sqrt{2}+1}{\sqrt{2}-1}\right)\cdot r=\frac{1}{2-\sqrt{2}}$; and also $\left(\frac{1}{2-\sqrt{2}}\right)\cdot r=\frac{1}{2}$; from either of these two equations we can get the value of $r$; if we use the second equation we have, $r=\frac{2-\sqrt{2}}{2}$. 2. (b) Since $|r|=\left|\frac{2-\sqrt{2}}{2}\right|=\frac{2-\sqrt{2}}{2}<1$, according to Remark 6, the sum $a+ar+ar^{2}+\ldots+ar^{n-1}+\ldots$ converges to $\frac{a}{1-r}$; in our case $a=\frac{\sqrt{2}+1}{\sqrt{2}-1}$ and $r=\frac{2-\sqrt{2}}{2}$. Thus the value of the infinite sum is equal to $\begin{array}[]{rcl}{\displaystyle\frac{a}{1-r}}&=&{\displaystyle\frac{\frac{\sqrt{2}+1}{\sqrt{2}-1}}{1-\left(\frac{2-\sqrt{2}}{2}\right)}}={\displaystyle\frac{\frac{\sqrt{2}+1}{\sqrt{2}-1}}{\frac{2-\left(2-\sqrt{2}\right)}{2}}}\\\ \\\ &=&{\displaystyle\frac{2(\sqrt{2}+1)}{\sqrt{2}(\sqrt{2}-1)}=\frac{2(\sqrt{2}+1)\cdot(\sqrt{2}+1)\cdot\sqrt{2}}{\sqrt{2}\cdot\sqrt{2}\cdot(\sqrt{2}-1)(\sqrt{2}+1)}}\\\ \\\ &=&{\displaystyle\frac{2\sqrt{2}\cdot(\sqrt{2}+1)^{2}}{2\cdot(2-1)}=\sqrt{2}\cdot(2+2\sqrt{2}+1)=\sqrt{2}\cdot(3+2\sqrt{2})}\\\ \\\ &=&3\sqrt{2}+2\cdot\sqrt{2}\cdot\sqrt{2}=3\sqrt{2}+4=\framebox{$4+3\sqrt{2}$}\end{array}$ 3. P18. (For student who had Calculus.) If $|\rho|<1$ and $|\beta\rho|<1$, calculate the infinite sum, $S=\underset{1{\rm st}}{\underbrace{\alpha\rho}}+\underset{2{\rm nd}}{(\underbrace{\alpha+\alpha\beta})}\rho^{2}+\ldots+\underset{n{\rm th\ term}}{(\underbrace{\alpha+\alpha\beta+\ldots+\alpha\beta^{n-1}})}\rho^{n}+\ldots\ .$ Solution: First we calculate the $n$th term which itself is a sum of $n$ terms: $(\alpha+\alpha\beta+\ldots+\alpha\beta^{n-1})\cdot\rho^{n}=\alpha\cdot\rho^{n}\cdot(1+\beta+\ldots+\beta^{n-1})=\alpha\cdot\rho^{n}\cdot\left(\frac{\beta^{n}-1}{\beta-1}\right)$ by Theorem 5(ii). Now we have, $\begin{array}[]{rcl}S&=&\alpha\rho+(\alpha+\alpha\beta)\rho^{2}+\ldots+\alpha\cdot\rho^{n}\cdot\left(\frac{\beta^{n}-1}{\beta-1}\right)+\ldots\\\ \\\ S&=&\alpha\rho\left(\frac{\beta-1}{\beta-1}\right)+\alpha\rho^{2}\cdot\left(\frac{\beta^{2}-1}{\beta-1}\right)\\\ \\\ &&+\ldots+\alpha\cdot\rho^{n}\cdot\left(\frac{\beta^{n}-1}{\beta-1}\right)+\ldots\end{array}$ Note that $S={\displaystyle\lim_{n\rightarrow\infty}}S_{n}$, where $\begin{array}[]{rcl}S_{n}&=&\alpha\rho\cdot\left(\frac{\beta-1}{\beta-1}\right)+\alpha\rho^{n}\cdot\left(\frac{\beta^{2}-1}{\beta-1}\right)+\ldots+\alpha\cdot\rho^{n}\cdot\left(\frac{\beta^{n}-1}{\beta-1}\right);\\\ \\\ S_{n}&=&\left(\frac{\alpha\rho}{\beta-1}\right)\left[(\beta-1)+\rho(\beta^{2}-1)+\ldots+\rho^{n-1}\cdot(\beta^{n}-1)\right]\\\ \\\ S_{n}&=&\left(\frac{\alpha\rho}{\beta-1}\right)\left[\beta\cdot[1+(\rho\beta)+\ldots+(\rho\beta)^{n-1}]-(1+\rho+\ldots+\rho^{n-1})\right]\\\ \\\ S_{n}&=&\left(\frac{\alpha\rho}{\beta-1}\right)\cdot\left[\beta\cdot\frac{[(\rho\beta)^{n}-1]}{\rho\beta-1}-\left(\frac{\rho^{n}-1}{\rho-1}\right)\right]\end{array}$ Now, as $n\rightarrow\infty$, in virtue of $|\rho\beta|<1$ and $|\rho|<1$ we have, ${\displaystyle\lim_{n\rightarrow\infty}}\frac{[(\rho\beta)^{n}-1]}{\rho\beta-1}=\frac{-1}{\rho\beta-1}=\frac{1}{1-\rho\beta}$ and ${\displaystyle\lim_{n\rightarrow\infty}}\frac{\rho^{n}-1}{\rho-1}=\frac{1}{1-\rho}$. Hence, $\begin{array}[]{rcl}S&=&{\displaystyle\lim_{n\rightarrow\infty}}S_{n}=\left(\frac{\alpha\rho}{\beta-1}\right)\cdot\left[\beta\cdot\left(\frac{1}{1-\rho\beta}\right)-\left(\frac{1}{1-\rho}\right)\right];\\\ \\\ S&=&\left(\frac{\alpha\rho}{\beta-1}\right)\cdot\left[\frac{\beta(1-\rho)-(1-\rho\beta)}{(1-\rho\beta)\cdot(1-\rho)}\right]=\frac{\alpha\rho\cdot(\beta-1)}{(\beta-1)\cdot(1-\rho\beta)(1-\rho)};\end{array}$ $\begin{array}[]{c}S=\frac{\alpha\rho}{(1-\rho\beta)\cdot(1-\rho)}\end{array}$ 18. P19. Let $m,n$ and $\ell$ be distinct natural numbers; and $a_{1},\ldots,a_{k},\ldots$, an infinite arithmetic progression with first nonzero term $a_{1}$ and difference $d$. 1. (a) Find the necessary conditions that $n,\ell$, and $m$ must satisfy in order that, $\underset{\underset{{\rm first}\ m\ {\rm terms}}{\rm sum\ of\ the}}{\underbrace{a_{1}+a_{2}+\ldots+a_{m}}}=\underset{\underset{{\rm next}\ n\ {\rm terms}}{\rm sum\ of\ the}}{\underbrace{a_{m+1}+\ldots+a_{m+n}}}=\underset{\underset{{\rm next}\ \ell\ {\rm terms}}{\rm sum\ of\ the}}{\underbrace{a_{m+1}+\ldots+a_{m+\ell}}}$ 2. (b) If the three sums in part (a) are equal, what must be the relationship between $a_{1}$ and $d$? 3. (c) Give numerical examples. Solution: 1. (a) We have two simultaneous equations, $\left.\begin{array}[]{rl}&a_{1}+a_{2}+\ldots+a_{m}=a_{m+1}+\ldots+a_{m+n}\\\ {\rm and}\\\ &a_{m+1}+\ldots+a_{m+n}=a_{m+1}+\ldots+a_{m+\ell}\end{array}\right\\}$ (1) According to Theorem 2 we have, $\begin{array}[]{rrcl}&a_{1}+a_{2}+\ldots+a_{m}&=&\frac{m\cdot[2a_{1}+(m-1)d]}{2};\\\ \\\ &a_{m+1}+\ldots+a_{m+n}&=&\frac{n\cdot[a_{m+1}+a_{m+n}]}{2}\\\ \\\ &&=&\frac{n\cdot[(a_{1}+md)+(a_{1}+(m+n-1)d)]}{2}\\\ \\\ &&=&\frac{n\cdot[2a_{1}+(2m+n-1)d]}{2};\\\ {\rm and}&&&\\\ &a_{m+1}+\ldots+a_{m+\ell}&=&\frac{\ell\cdot[2a_{1}+(2m+\ell-1)d]}{2}\end{array}$ Now let us use the first equation in (1): $\begin{array}[]{rcl}\frac{m\cdot[2a_{1}+(m-1)d]}{2}&=&\frac{n\cdot[2a_{1}+(2m+n-1)d]}{2};\\\ \\\ 2ma_{1}+m(m-1)d&=&2na_{1}+n\cdot(2m+n-1)d;\\\ \\\ 2a_{1}\cdot(m-n)&=&[n\cdot(2m+n-1)-m(m-1)]d;\\\ \\\ 2a_{1}\cdot(m-n)&=&[2nm+n^{2}-m^{2}+m-n]d;\end{array}$ According to hypothesis $a_{1}\neq 0$ and $m-n\neq 0$; so the right-hand side must also be nonzero and, $d=\frac{2a_{1}\cdot(m-n)}{2nm+n^{2}-m^{2}+m-n}$ (2) Now use the second equation in (1): $\begin{array}[]{rrcl}&\frac{n\cdot[2a_{1}+(2m+n-1)d]}{2}&=&\frac{\ell\cdot[2a_{1}+(2m+\ell-1)d]}{2}\\\ \\\ \Leftrightarrow&2na_{1}+n(2m+n-1)d&=&2\ell a_{1}+\ell(2m+\ell-1)d\\\ \\\ \Leftrightarrow&2a_{1}\cdot(n-\ell)&=&[\ell(2m+\ell-1)-n(2m+n-1)]d\\\ \\\ \Leftrightarrow&2a_{1}\cdot(n-\ell)&=&[2m\cdot(\ell-n)+(\ell^{2}-n^{2})-(\ell-n)]d\\\ \\\ \Leftrightarrow&2a_{1}\cdot(n-\ell)&=&[2m\cdot(\ell-n)+(\ell-n)(\ell+n)-(\ell-n)]d\\\ \\\ \Leftrightarrow&2a_{1}\cdot(n-\ell)&=&(\ell-n)\cdot[2m+\ell+n-1]d;\end{array}$ and since $n-\ell\neq$, we obtain $-2a_{1}=(2m+\ell_{n}-1)d$; $d=\frac{-2a_{1}}{2m+\ell+n-1}$ (3) (Again, in virtue of $a_{1}\neq 0$, the product $(2m+\ell+n-1)d$ must also be nonzero, so $2m+\ell+n-1\neq 0$, which is true anyway since, obviously, $2m+\ell+n$ is a natural number greater than 1). Combining Equations (2) and (3) and cancelling out the factor $2a_{1}\neq 0$ from both sides we obtain, $\frac{m-n}{2nm+n^{2}-m^{2}+m-n}=\frac{-1}{2m+\ell+n-1}$ Cross multiplying we now have, $\begin{array}[]{cl}&(m-n)\cdot(2m+\ell+n-1)\\\ \\\ =&(-1)\cdot(2nm+n^{2}-m^{2}+m-n);\\\ \\\ &2m^{2}+m\ell+mn-m-2mn-n\ell-n^{2}+n\\\ \\\ =&-2mn-n^{2}+m^{2}-m+n;\\\ \\\ &m^{2}+m\ell-n\ell+mn=0.\end{array}$ We can solve for $n$ in terms of $m$ and $\ell$ (or for $\ell$ in terms of $m$ and $n$) we have, $n\cdot(\ell-m)=m\cdot(m+\ell)\Rightarrow\framebox{$n=\frac{m\cdot(m+\ell)}{\ell-m}$},\ {\rm since}\ \ell-m\neq 0.$ Also, we must have $\ell>m$, in view of the fact that $n$ is a natural number and hence positive (also note that these two conditions easily imply $n>m$ as well). But, there is more: The natural number $\ell-m$ must be a divisor of the product $m\cdot(m+\ell)$. Thus, the conditions are: 1. (A) $\ell>m$ 2. (B) $(\ell-m)$ is a divisor of $m\cdot(m+\ell)$ and 3. (C) $n=\frac{m\cdot(m+\ell)}{\ell-m}$ 2. (b) As we have already seen $d$ and $a_{1}$ must satisfy both conditions (2) and (3). However, under conditions (A), (B), and (C), the two conditions (2) and (3) are, in fact, equivalent, as we have already seen; so $d=\frac{-2a_{1}}{2m+\ell+n-1}$ (condition (3)) will suffice. 3. (c) Note that in condition (C), if we choose $m$ and $\ell$ such $\ell-m$ is positive and $(\ell-m)$ is a divisor of $m$, then clearly the number $n=\frac{m\cdot(m+\ell)}{\ell-m}$, will be a natural number. If we set $\ell-m=t$, then $m+\ell=t+2m$, so that $n=\frac{m\cdot(t+2m)}{t}=m+\frac{2m^{2}}{t}.$ So if we take $t$ to be a divisor of $m$, this will be sufficient for $\frac{2m^{2}}{t}$ to be a positive integer. Indeed, set $m=M\cdot t$, then $n=M\cdot t+\frac{2M^{2}t^{2}}{t}=M\cdot t+2M^{2}\cdot t=t\cdot M\cdot(1+2M)$. Also, in condition (3) , if we set $a_{1}=a$, then (since $\ell=m+t=Mt+t$) $\begin{array}[]{rcl}d&=&\frac{-2a}{2M\cdot t+(Mt+t)+Mt+2M^{2}t-1};\\\ \\\ d&=&\frac{-2a}{4Mt+t+2M^{2}t-1}.\end{array}$ (4) Thus, the formulas $\ell=Mt+t,\ n=Mt+2M^{2}\cdot t$ and (4) will generate, for each pair of values of the natural numbers $M$ and $t$, an arithmetic progression that satisfies the conditions of the problem; for any nonzero value of the first term $a$. Numerical Example: If we take $t=3$ and $M=4$, we then have $m=M\cdot t=3\cdot 4=12;\ n=t\cdot M\cdot(1+2M)=12\cdot(1+8)=108$, and $\ell=m+t=12+3=15$. And, $d=\frac{-2a}{2m+\ell+n-1}=\frac{-2a}{24+15+108-1}=\frac{-2a}{146}=\frac{-a}{73}.$ Now let us compute $\begin{array}[]{rcl}a_{1}+\ldots+a_{m}&=&{\displaystyle\frac{m\cdot[2a+(m-1)d]}{2}=\frac{12\cdot\left[2a+11\cdot\left(\frac{-a}{73}\right)\right]}{2}}\\\ \\\ &=&{\displaystyle\frac{12\cdot[146a-11a]}{2\cdot 73}=\frac{6\cdot(135a)}{73}}={\displaystyle\frac{810a}{73}}.\end{array}$ Next, $\begin{array}[]{rl}&a_{m+1}+\ldots+a_{m+n^{\prime}}\\\ \\\ =&\frac{n\cdot[2a+(m+n-1)d]}{2}\\\ \\\ =&\frac{108\cdot\left[2a+(24+108-1)\cdot\left(\frac{-a}{73}\right)\right]}{2}\\\ \\\ =&\frac{108}{2}\cdot\frac{[146a-131a]}{73}\\\ \\\ =&\frac{(54)(15a)}{73}=\frac{810a}{73}\end{array}$ and $\begin{array}[]{cl}&a_{m+1}+\ldots+a_{m+\ell}\\\ \\\ =&{\displaystyle\frac{\ell\cdot[2a+(2m+\ell-1)d]}{2}}\\\ \\\ =&{\displaystyle\frac{15\cdot\left[2a+(24+15-1)\cdot\left(\frac{-a}{73}\right)\right]}{2}}\\\ \\\ =&{\displaystyle\frac{15}{2}\cdot\frac{[146a-38a]}{73}}\\\ \\\ =&{\displaystyle\frac{15}{2}\cdot\frac{(108)a}{73}=\frac{(15)(54a)}{73}}\\\ \\\ =&{\displaystyle\frac{810a}{73}}.\end{array}$ Thus, all three sums are equal to $\frac{810a}{73}$. 19. P20. If the real numbers $a,b,c$ are consecutive terms of an arithmetic progression and $a^{2},b^{2},c^{2}$ are consecutive terms of a harmonic progression, what conditions must the numbers $a,b,c$ satisfy? Describe all such numbers $a,b,c$. Solution: By hypothesis, we have $2b=a+c\ {\rm and}\ \frac{2}{b^{2}}=\frac{1}{a^{2}}+\frac{1}{c^{2}}$ so $a,b,c$ must all be nonzero real numbers. The second equation is equivalent to $b^{2}=\frac{2a^{2}c^{2}}{a^{2}+c^{2}}$ and $abc\neq 0$; so that, $b^{2}(a^{2}+c^{2})=2a^{2}c^{2}\Leftrightarrow b^{2}\cdot[(a+c)^{2}-2ac]=2a^{2}c^{2}$. Now substitute for $a+c=2b$: $\begin{array}[]{rl}&b^{2}\cdot[(2b)^{2}-2ac]=2a^{2}c^{2}\\\ \\\ \Leftrightarrow&4b^{4}-2acb^{2}-2a^{2}c^{2}=0;\\\ \\\ &2b^{4}-acb^{2}-a^{2}c^{2}=0\end{array}$ At this stage we could apply the quadratic formula since $b^{2}$ is a root to the equation $2x^{2}-acx-a^{2}c^{2}=0$; but the above equation can actually be factored. Indeed, $\begin{array}[]{rcl}b^{4}-acb^{2}+b^{4}-a^{2}c^{2}&=&0;\\\ \\\ b^{2}(b^{2}-ac)+(b^{2})^{2}-(ac)^{2}&=&0;\end{array}$ $\begin{array}[]{rcl}b^{2}\cdot(b^{2}-ac)+(b^{2}-ac)(b^{2}+ac)&=&0;\\\ (b^{2}-ac)\cdot(2b^{2}+ac)&=&0\end{array}$ (1) According to Equation (1), we must have $b^{2}-ac=0$; or alternatively $2b^{2}+ac=0$. Consider the first possibility, $b^{2}-ac=0$. Then, by going back to equation $\frac{2}{b^{2}}=\frac{1}{a^{2}}+\frac{1}{c^{2}}$ we obtain $\frac{2}{ac}=\frac{1}{a^{2}}+\frac{1}{c^{2}}\Leftrightarrow\frac{2a^{2}c^{2}}{ac}=a^{2}+c^{2}\Leftrightarrow 2ac=a^{2}+c^{2}$; $a^{2}+c^{2}-2ac=0\Leftrightarrow(a-c)^{2}=0$; $a=c$ and thus $2b=a+c$ implies $b=a=c$. Next, consider the second possibility in Equation (1): $2b^{2}+ac=0\Leftrightarrow 2b^{2}=-ac$; which clearly imply that one of $a$ and $c$ must be positive, the other negative. Once more going back to $\begin{array}[]{rl}&\frac{2}{b^{2}}=\frac{1}{a^{2}}+\frac{1}{c^{2}};\ \frac{4}{2b^{2}}=\frac{1}{a^{2}}+\frac{1}{c^{2}}\\\ \\\ \Leftrightarrow&\frac{4}{-ac}=\frac{c^{2}+a^{2}}{a^{2}c^{2}}\\\ \\\ \Leftrightarrow&-4ac=c^{2}+a^{2}$; $a^{2}+4ac+c^{2}=0\end{array}$ (2) Let $t=\frac{a}{c};\ a=c\cdot t$ then Equation (2) yields (since $ac\neq 0$), $t^{2}+4t+1=0$ (3) Applying the quadratic formula to Equation (3), we now have $\begin{array}[]{l}t={\displaystyle\frac{-4\pm\sqrt{16-4}}{2}=\frac{-4\pm 2\sqrt{3}}{2}};\\\ \\\ t=-2\pm\sqrt{3};\end{array}$ note that both numbers $-2+\sqrt{3}$ and $-2-\sqrt{3}$ are negative and hence both acceptable as solutions, since we know that $a$ and $c$ have opposite sign, which means that $t=\frac{a}{c}$ must be negative. So we must have either $a=(-2+\sqrt{3})c$; or alternatively $a=-(2+\sqrt{3})\cdot c$. Now, we find $b$ in terms of $c$. From $2b^{2}=-ac$; $b^{2}=-\frac{ac}{2}$; note that the last equation says that either the numbers $-\frac{a}{2},b,c$ are the successive terms of a geometric progression; or the numbers $-a,b,\frac{c}{2}$ (or any of the other two possible permutations: $a,b,-\frac{c}{2}$, $\frac{a}{2},b,-c$; and four more that are obtained by switching $a$ with $c$). So, if $a=(-2+\sqrt{3})c$, then from $2b=a+c;\ b=\frac{a+c}{2}=\frac{(-2+\sqrt{3})c+c}{2}=\frac{(\sqrt{3}-1)c}{2}$. And if $a=-(2+\sqrt{3})c,\ b=\frac{a+c}{2}=\frac{-(2+\sqrt{3})c+c}{2}=\frac{-(1+\sqrt{3})c}{2}$. So, in conclusion we summarize as follows: Any three real numbers $a,b,c$ such that $a,b,c$ are consecutive terms of an arithmetic progression and $a^{2},b^{2},c^{2}$ the successive terms of a harmonic progression must fall in exactly one of three classes: 1. (1) $a=b=c;\ c$ can be any nonzero real number 2. (2) $a=(-2+\sqrt{3})\cdot c,\ b=\frac{(\sqrt{3}-1)c}{2};\ c$ can be any positive real; 3. (3) $a=(2+\sqrt{3})c,\ b=\frac{-(1+\sqrt{3})}{2}c;\ c$ can be any positive real. 20. P21. Prove that if the positive real numbers $\alpha,\beta,\gamma$ are consecutive members of a geometric progression, then $\alpha^{k}+\gamma^{k}\geq 2\beta^{k}$, for every natural number $k$. Solution: Given any natural number $k$, we can apply the arithmetic-geometric mean inequality of Theorem 10, with $n=2$, and $a_{1}=\alpha^{k},\ a_{2}=\gamma^{k}$, in the notation of that theorem: $\frac{\alpha^{k}+\gamma^{k}}{2}\geq\sqrt{\alpha^{k}\cdot\gamma^{k}}=\sqrt{(\alpha\gamma)^{k}}.$ But since $\alpha,\beta,\gamma$ are consecutive terms of a geometric progression, we must also have $\beta^{2}=\alpha\gamma$. Thus the above inequality implies, $\begin{array}[]{rccl}&\frac{\alpha^{k}+\gamma^{k}}{2}&\geq&\sqrt{(\beta^{2})^{k}};\\\ &\frac{\alpha^{k}+\gamma^{k}}{2}&\geq&\sqrt{(\beta^{k})^{2}}\\\ \Rightarrow&\frac{\alpha^{k}+\gamma^{k}}{2}&\geq&\beta^{k}\\\ \Rightarrow&\alpha^{k}+\gamma^{k}&\geq&2\beta^{k},\end{array}$ and the proof is complete. ## 7 Unsolved problems 1. 1. Show that if the sequence $a_{1},a_{2},\ldots,a_{n},\ldots$ , is an arithmetic progression, so is the sequence $c\cdot a_{1},c\cdot a_{2},\ldots,c\cdot a_{n},\ldots$ , where $c$ is a constant. 2. 2. Determine the difference of each arithmetic progression which has first term $a_{1}=6$ and contains the numbers $62$ and $104$ as its terms. 3. 3. Show that the irrational numbers $\sqrt{2},\ \sqrt{3},\ \sqrt{5}$ cannot be terms of an arithmetic progression. 4. 4. If $a_{1},a_{2},\ldots,a_{n},\ldots$ is an arithmetic progression and $a_{k}=\alpha,\ a_{m}=\beta,\ a_{\ell}=\gamma$, show that the natural numbers $k,m,\ell$ and the real numbers $\alpha,\beta,\gamma$, must satisfy the condition $\alpha\cdot(m-\ell)+\beta\cdot(\ell-k)+\gamma\cdot(k-m)=0.$ Hint: Use the usual formula $a_{n}=a_{1}+(n-1)d$, for $n=k,m,\ell$, to obtain three equations; subtract the first two and then the last two (or the first and the third) to eliminate $a_{1}$; then eliminate the difference $d$ (or solve for $d$ in each of the resulting equations). 5. 5. If the numbers $\alpha,\beta,\gamma$ are successive terms of an arithmetic progression, then the same holds true for the numbers $\alpha^{2}\cdot(\beta+\gamma),\ \beta^{2}\cdot(\gamma+\alpha),\ \gamma^{2}\cdot(\alpha+\beta)$. 6. 6. If $S_{k}$ denotes the sum of the first $k$ terms of the arithmetic progression with first term $k$ and difference $d=2k-1$, find the sum $S_{1}+S_{2}+\ldots+S_{k}$. 7. 7. We divide the odd natural numbers into groups or classes as follows: $\\{1\\},\\{3,5\\},\\{7,9,11\\},\ldots$ ; the $n$th group contains $n$ odd numbers starting with $(n\cdot(n-1)+1)$ (verify this). Find the sum of the members of the $n$th group. 8. 8. We divide the even natural numbers into groups as follows: $\\{2\\},\\{4,6\\},$ $\\{8,10,12\\},\ldots$ ; the $n$th group contains $n$ even numbers starting with $(n(n-1)+2)$. Find the ’sum of the members of the $n$th group. 9. 9. Let $n_{1},n_{2},\ldots,n_{k}$ be $k$ natural numbers such that $n_{1}<n_{2}<\ldots<n_{k}$; if the real numbers, $a_{n_{1}},a_{n_{2}},\ldots,a_{n_{k}}$, are members of an arithmetic progression (so that the number $a_{n_{i}}$ is precisely the $n_{i}$th term in the progression; $i=1,2,\ldots,k)$, show that the real numbers: $\frac{a_{n_{k}}-a_{n_{1}}}{a_{n_{2}}-a_{n_{1}}},\ \frac{a_{n_{k}}-a_{n_{2}}}{a_{n_{2}}-a_{n_{1}}}\ ,\ldots,\frac{a_{n_{k}}-a_{n_{k-1}}}{a_{n_{2}}-a_{n_{1}}},$ are all rational numbers. 10. 10. Let $m$ and $n$ be natural numbers. If in an arithmetic progression $a_{1},a_{2},\ldots,a_{k},\ldots$; the term $a_{m}$ is equal to $\frac{1}{n}$; $a_{m}=\frac{1}{n}$, and the term $a_{n}$ is equal to $\frac{1}{m};\ a_{n}=\frac{1}{m}$, prove the following three statements. 1. (a) The first term $a_{1}$ is equal to the difference $d$. 2. (b) If $t$ is any natural number, then $a_{t\cdot(mn)}=t$; in other words, the terms $a_{mn},a_{2mn},a_{3mn},\ldots$ , are respectively equal to the natural numbers $1,2,3,\ldots$ . 3. (c) If $S_{t\cdot(mn)}$ ($t$ a natural number) denote the sum of the first $(t\cdot m\cdot n)$ terms of the arithmetic progression, then $S_{t\cdot(mn)}=\frac{1}{2}\cdot(mn+1)\cdot t$. In other words, $S_{mn}=\frac{1}{2}(mn+1)$, $S_{2mn}=\frac{1}{2}\cdot(mn+1)\cdot 2,\ S_{3mn}=\frac{1}{2}\cdot(mn+1)\cdot 3,\ldots$ . 11. 11. If the distinct real numbers $a,b,c$ are consecutive terms of a harmonic progression show that 1. (a) $\frac{2}{b}=\frac{1}{b-a}+\frac{1}{b-c}$ and 2. (b) $\frac{b+a}{b-a}+\frac{b+c}{b-c}=2$ 12. 12. If the distinct reals $\alpha,\beta,\gamma$ are consecutive terms of a harmonic progressionthen the same is true for the numbers $\alpha,\alpha-\gamma,\alpha-\beta$. 13. 13. Let $a=a_{1},a_{2},a_{3},\ldots,a_{n},\ldots$ , be a geometric progression and $k,\ell,m$natural numbers. If $a_{k}=\beta,\ a_{\ell}=\gamma,\ a_{m}=\delta$, show that $\beta^{\ell-m}\cdot\gamma^{m-k}\cdot\delta^{k-\ell}=1$. 14. 14. Suppose that $n$ and $k$ are natural numbers such that $n>k+1$; and $a_{1}=a,a_{2},\ldots,a_{t},\ldots$ a geometric progression, with positive ratio $r\neq 1$, and positivefirst term $a$. If $A$ is the value of the sum of the first $k$ terms of the progression and $B$ is the value of the last $k$ terms among the $n$ first terms, express the ratio $r$ in terms of $A$ and $B$ only; and also the first term $a$ in terms of $A$ and $B$. 15. 15. Find the sum $\left(a-\frac{1}{a}\right)^{2}+\left(a^{2}-\frac{1}{a^{2}}\right)^{2}+\ldots\left(a^{n}-\frac{a}{a^{n}}\right)^{2}$. 16. 16. Find the infinite sum $\left(\frac{1}{3}+\frac{1}{3^{2}}+\frac{1}{3^{3}}+\ldots\right)+\left(\frac{1}{5}+\frac{1}{5^{2}}+\frac{1}{5^{3}}+\ldots\right)$$+\left(\frac{1}{9}+\frac{1}{9^{2}}+\frac{1}{9^{3}}+\ldots\right)+\ldots+\underset{k{\rm th\ sum}}{\left(\underbrace{\frac{1}{(2k+1)}+\frac{1}{(2k+1)^{2}}+\frac{1}{(2k+1)^{3}}+\ldots}\right)}+\ldots$ . 17. 17. Find the infinite sum $\frac{2}{7}+\frac{4}{7^{2}}+\frac{2}{7^{3}}+\frac{4}{7^{4}}+\frac{2}{7^{5}}+\frac{4}{7^{6}}+\ldots$ . 18. 18. If the numbers $\alpha,\beta,\gamma$ are consecutive terms of an arithmetic progression and the nonzero numbers $\beta,\gamma,\delta$ are consecutive terms of a harmonic progression, show that $\frac{\alpha}{\beta}=\frac{\gamma}{\delta}$. 19. 19. Suppose that the positive reals $\alpha,\beta,\gamma$ are successive terms of an arithmetic progression and let $x$ be the geometric mean of $\alpha$ and $\beta$; and let $y$ be the geometric mean of $\beta$ and $\gamma$. Prove that $x^{2},\beta^{2},y^{2}$ are successive terms of an arithmetic progression. Give two numerical examples. 20. 20. Show that if the nonzero real numbers $a,b,c$ are consecutive terms of a harmonic progression, then the numbers $a-\frac{b}{2},\ \frac{b}{2},\ c-\frac{b}{2}$, must be consecutive terms of a geometric progression. Give two numerical examples. 21. 21. Compute the following sums: 1. (i) $\frac{1}{2}+\frac{2}{2^{2}}+\ldots+\frac{n}{2^{n}}$ 2. (ii) $1+\frac{3}{2}+\frac{5}{4}+\ldots+\frac{2n-1}{2^{n-1}}$ 22. 22. Suppose that the sequence $a_{1},a_{2},\ldots,a_{n},\ldots$ satisfies $a_{n+1}=(a_{n}+\lambda)\cdot\omega$, where $\lambda$ and $\omega$ are fixed real numbers with $\omega\neq 1$. 1. (i) Use mathematical induction to prove that for every natural number, $a_{n}=a_{1}\cdot\omega^{n-1}+\lambda\cdot\left(\frac{\omega^{n}-\omega}{\omega-1}\right)$. 2. (ii) Use your answer in part (i) to show that, $\begin{array}[]{rcl}S_{n}&=&a_{1}+a_{2}+\ldots+a_{n}\\\ &=&a_{1}\cdot{\left(\displaystyle\frac{\omega^{n}-1}{\omega-1}\right)+\lambda\cdot\left(\frac{\omega^{n+1}-n\cdot\omega^{2}+(n-1)\omega}{(\omega-1)^{2}}\right)}.\end{array}$ ($*$) Such a sequence is called a semi-mixed progression. 23. 23. Prove part (ii) of Theorem 4. 24. 24. Work out part (viii) of Remark 5. 25. 25. Prove the analogue of Theorem 4 for geometric progressions: if the $(n-m+1)$ positive real numbers $a_{m},a_{m+1},\ldots,a_{n-1},a_{n}$ are successive terms of a geometric progression, then 1. (i) If the natural number $(n-m+1)$ is odd, then the geometric mean of the $(n-m+1)$ terms is simply the middle number $a_{(\frac{m+n}{2})}$. 2. (ii) If the natural number $(n-m+1)$ is even, then the geometric mean of the $(n-m+1)$ terms must be the geometric mean of the two middle terms $a_{(\frac{n+m-1}{2})}$ and $a_{(\frac{n+m+1}{2})}$. ## References * [1] Robert Blitzer, Precalculus, Third Edition, Pearson Prentiss Hall, 2007, 1053 pp. See pages 936-958. * [2] Michael Sullivan, Precalculus, Eighth Edition, Pearson Prentiss Hall, 2008, 894 pp. See pages 791-801.
arxiv-papers
2009-04-24T12:10:36
2024-09-04T02:49:02.126031
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Konstantine Zelator", "submitter": "Konstantine Zelator", "url": "https://arxiv.org/abs/0904.3855" }
0904.3857
# Microscopic origin of magnetism and magnetic interactions in ferropnictides M.D. Johannes, I.I. Mazin Code 6393, Naval Research Laboratory, Washington, D.C. 20375 (Printed on ) ###### Abstract One year after their initial discovery, two schools of thought have crystallized regarding the electronic structure and magnetic properties of ferropnictide systems. One postulates that these are itinerant weakly correlated metallic systems that become magnetic by virtue of spin-Peierls type transition due to near-nesting between the hole and the electron Fermi surface pockets. The other argues these materials are strongly or at least moderately correlated, the electrons are considerably localized and close to a Mott-Hubbard transition, with the local magnetic moments interacting via short-range superexchange. In this paper we argue that neither picture is fully correct. The systems are moderately correlated, but with correlations driven by Hund’s rule coupling rather than by the on-site Hubbard repulsion. The iron moments are largely local, driven by Hund’s intra-atomic exchange. Superexchange is not operative and the interactions between the Fe moments are considerably long-range and driven mostly by one-electron energies of all occupied states. ###### pacs: Pacs Numbers: Ferropnictides are still attracting widespread attention from researchers both inside and outside the field of superconductivity. There is now a nearly universal agreement that magnetism and, specifically, proximity to an antiferromagnetic “stripe-order” transition plays a major role in the physics of these compounds. There is also growing evidence that the magnetic properties and correlation effects in this system are not controlled by the Hubbard $U$ as in cuprates (spectroscopy tells us that Hubbard correlations are weak and the effective $U$ is on the order of 1 eVPES , smaller than the bandwidth; first principles calculations of $U$ support thisU ). On the other hand, the multiband character of Fe bands and the large intra-atomic (Hund’s) exchange coupling in Fe suggest that the Hund’s $J$ may play the main role in the magnetism.. As opposed to the Hubbard $U,$ the Hund’s $J$ is generally well accounted for in density-functional calculations (where it is called the Stoner $I$).) Indeed, the local density approximation (LDA) correctly predicts the particular antiferromagnetic and structural ground state of undoped ferropnictides, in striking contrast to the cuprates. In view of this, it is instrumental to trace down the origin of magnetism $within$ LDA, and to disentangle the nature of magnetic interactions captured by this approach. It is highly likely that the physics uncovered by density functional theory will reflect the actual physics of these systems. Given the heated (but largely devoid of solid facts) discussion of whether antiferromagnetism in pnictides is due to Fermi surface nesting or to second neighbor superexchange (See Ref. MS for a review), a clear understanding of, at least, the message that LDA calculations send seems highly necessary. In this paper, we analyze the magnetic interactions and demonstrate that neither of the above two views (often presented as an axiomatic dilemma) is correct. The magnetism appears due to $local$ Hund’s rule coupling, while the particular ground state is selected by itinerant, essentially one-electron interactions, of which only a small part is played by the Fermi surface nesting. We will also explain why conventional “Anderson-Kanamori” superexchange is not operative here, and will show some striking examples where calculations and experiment contradict both local superexchange and spin-Peierls pictures, yet are perfectly understandable on the basis of one- electron energy balance. We start with a qualitative analysis. The Hund’s rule coupling energy in density functional theory is expressed as $E_{H}=-Im^{2}/4,$ where $m$ is the magnetization of an Fe ion, and $I\approx 0.8$ eV is the Stoner factor for Fe (0.9 eV in GGA). Depending on the material, the self-consistent magnetic moment on Fe appears to be between 1.5-2 $\mu_{B}$ in LDA and 1.8-2.5 in GGA. The corresponding energy gain even in LDA is 0.5 eV, which is remarkably large. In other words, every individual Fe wants to be strongly magnetic and the advantage of spin polarization should lead to a magnetic ground state at the mean field level, unless an unusually large kinetic energy penalty exists. However, this is exactly the case for the formation of a ferromagnetic configuration. To create a magnetization $m$ on Fe, one needs to move approximately 1.15 (to account for the relative share of Fe-d orbitals at the Fermi level) spin-minority electrons into unoccupied spin-majority states, incurring an energy loss of $\approx(1.15m)^{2}/N_{\uparrow}(E_{F}).$ The density of states (DOS) per Fe, $N_{\uparrow}(E_{F}),$ varies between 1 and 1.5 eV${}^{-1},$ depending on the system, creating an energy loss for $m=1.5$ $\mu_{B}$ of 0.5-0.8 eV. This cost is about as large as the Hund’s rule energy gain estimated above. This shows that the system is on the verge of a ferromagnetic instability, but nothing more. In low-DOS metals, magnetization without a large cost in kinetic energy is possible if some type of antiferromagnetic arrangement is formed (cf. metal Cr and Mn). For a broad band metal, this narrows the conductivity band, but as long as the exchange splitting is smaller than the bandwidth, the cost is small. Because in ferropnictides the calculated bandwidth is 5-6 eV and the exchange splitting $mI$ is at most 2 eV, this mechanism should be very favorable. It is interesting to consider how the system determines which particular AFM arrangement is most profitable from the point of view of the one-electron energy (note that LDA calculations can be forced to converge to nearly any AFM pattern, but not to a ferromagnetic state). If the resulting magnetization is small, the answer is obvious: the second derivative of the total energy with respect to magnetization is defined by the noninteracting susceptibility at the AF wave vector Q, $\partial^{2}E/\partial m^{2}=-\chi_{0}^{-1}(\mathbf{Q)}$ (with the small caveat that an actual spin density wave is not a single harmonic, but includes all wave vectors Q+G, where G is a reciprocal lattice vector). The imaginary part of $\chi_{0}$ is directly related to Fermi surface nesting, being defined, in the constant matrix elements approximation, as $\sum_{ij}\int\delta(\varepsilon_{\mathbf{k}i})\delta(\varepsilon_{\mathbf{k+Q,}i})d\mathbf{k,}$ while the (actually relevant) real part collects information from all states and may or may not have any relation to the nesting conditions (for a detailed discussion see Ref. CDW ). Geometrical nesting, as a property of the Fermi surface, becomes even more disconnected from a real instability in the strongly nonlinear regime, $m\gtrsim 1$ $\mu_{B}$, which is the case for ferropnictides. Monitoring the evolution of the electronic bands with increasing spin polarizationFSM , one observes that at $m\sim 1$ $\mu_{B}$ the resulting bands can in no way be described as anticrossing downfolded nonmagnetic bands with partial gapping of the Fermi surface. Rather, the entire Fe d band is fully restructured. Although the lowest-energy AFM state wave vector indeed coincides with the quasi-nesting wave vector in some cases, it is not always true, as exemplified by the case of FeTe that we discuss later. It should be noted that while quasi-nesting is not particularly relevant for the long-range ordering in the undoped crystals, it does define the low-energy excitations in non-magnetic phases and these can perfectly well mediate superconductivity. Figure 1: (color online) Top-down view of the a) checkerboard b) stripe and c) doublestripe magnetic patterns for a single FeAs or FeTe layer. The light colored sites have majority up spin and the darker sites have majority down spin. Having established a general framework, we now address specific examples. First, we investigate checkerboard, stripe, and double-stripe magnetic structures (See Fig. 1) and show that the stripe order is lower in energy than either the checkerboard or the double-stripe structure for the 122 systems, but not for FeTe. We use BaFe2As2 as an example, but the results for LaFeAsO are very similar. Our calculations were performed using an all-electron, full- potential LAPW package WIEN2k, in the Generalized Gradient Approximation, similar to Ref. PRB . All structures were fully relaxed (except where stated otherwise) using the Vienna Ab-Initio Simulation Program (VASP) vasp , with the PAW formulation PAW and also using GGA. In Table 1 we show the magnetic stabilization energies of the three different antiferromagnetic structures. Table 1: Stabilization energies for various magnetic configurations in the 122 and FeTe systems. All energies are per Fe atom. | checkerboard | stripe | double stripe ---|---|---|--- BaFe2As2 | 16 meV | 94 meV | 0.6 meV FeTe | – | 207 meV | 230 meV In Fig. 2a,b,c, we show the DOSs for BaFe2As2 in each of the three magnetic configurations along with the nonmagnetic DOS. Compared to the nonmagnetic DOS, we see that the checkerboard pattern has a very similar spectrum at and near the Fermi energy and gains one-electron energy by shifting spectral weight from the region between -0.5 and -1.0 downward to the region between -1.0 and -2.0. The doublestripe pattern actually incurs an energy penalty at and just below EF, but gains energy by shifting weight downward from between -0.2 and -0.7 to between -1.0 and -2.0. The ground state configuration, in contrast to the other two, gains energy all the way from EF to -0.9 by shifting weight downward. This is accomplished through the opening of a large pseudogap (this terminology has no connection with the pseudogap in cuprates and simply signifies a depression in one-electron DOS around the Fermi level). Though all three magnetic configurations are stable with respect to a nonmagnetic state, it is visibly the case that the stripe ordering has the greatest one electron energy advantage. This is reflected in the much larger gain in total energy (See Table 1). Figure 2: (color online) The densities of states for BaFe2As2 in the non- magnetic configuration in comparison to a) checkerboard magnetic pattern b) stripe (ground state) magnetic pattern and c) double stripe magnetic pattern Let us now compare the results with the same calculations for FeTe. As indicated in a number of papers, FeTe is always formed with an excess Fe, so the fact that experiment gives the double stripe structure as the low- temperature ground state Li should be taken $cum$ $grano$ $salis.$ However, as Table 1 shows, it is definitely the stoichiometric ground state in density functional calculations, and this is the only thing that matters for our analysis note1 . We note here that we do not fully relax the FeTe structure, but only relax the internal positions. As before these relaxations are done separately for magnetic and nonmagnetic cases. Figure 3: (color online) The densities of states for FeTe in the non-magnetic configuration in comparison to a) stripe magnetic pattern and b) double stripe magnetic pattern. Table 1 indicates that for FeTe, as opposed to BaFe2As${}_{2},$ the energies of the single and double stripe phases are relatively close. This suggests that the crude method of determining the ground state by looking at the DOS may not work here, as the DOSs for the two AFM phases will probably be similar. Indeed, this is what we see in Fig. 3a,b where a large downward shift of spectral weight is visible for both patterns. Interestingly, the nonmagnetic Fermi surfaces in FeTe are extremely similar to those in the 122 and 1111 materials, whereas nonmagnetic DOS and the magnetic electronic structure are quite different. This reinforces that FS nesting, which would be nearly identical for BaFe2As2 and FeTe, is not driving the magnetic order. Our calculations also provide a strong argument against superexchange. Looking at the patterns in Fig. 1, it is easy to see that for both the stripe and double stripe patterns, the first neighbor exchange, $J_{1}$, does not contribute, due to equal numbers of aligned and anti-aligned spins. The second neighbor exchange, $J_{2}$, would have to be stronger than $J_{1}/2$ in order for the stripe pattern to be energetically favorable over the checkerboard pattern in a superexchange picture. It has often been argued that this situation is not unreasonable since the Fe-As-Fe paths available for $J_{1}$ and $J_{2}$ are similar. For double stripe order in the FeTe system, however, both $J_{1}$ and $J_{2}$ cancel, leaving only $J_{3}$ to establish the ordering. Considering the remarkably strong stability (compared to non- magnetic) calculated for double stripe order (See Table 1), this is hard to rationalize. Furthermore, the energy term for stripe is $J_{2}$ \- $J_{3}$ (compared to $J_{3}$ alone for double stripe). For double stripe to stabilize, $J_{3}$ could be no smaller than $J_{2}/2$, but the ”similar hopping paths” justification used for $J_{1}$ and $J_{2}$ and is not available: the third neighbor exchange path is more than twice as long as the second neighbor one and involves As-As hopping across a distance of a full lattice constant. Thus, the existence and stability of the double stripe order severely strains the credibility of the superexchange picture. This is, in fact, to be expected since superexchange is not efficient when the bandwidth is much larger than the energy cost of flipping an electron’s spin, which is precisely the case here. This does not, however, mean that one cannot map the dependence of the total energy onto a suitable short-range exchange model. In fact, it is hard to imagine a case in which this would not be possible. Yet, in carrying out this procedure for ferropnictide systems, one should be aware of the following caveats: (1) There is no microscopic justification (as for instance in the Hubbard model) for introducing any $J-t$ (or $J_{1}-J_{2}-t)$ Hamiltonian. (2) There is no guarantee that this kind of mapping can be stopped at first or second neighbors. In fact, accurate calculations show that at least some of the exchange parameters in these mappings decay as $1/R^{3},$ just as in metal ironY-A . (3) The resulting exchange parameters strongly and qualitatively depend on the long-range order established in the system. In particular, the parameters that can be used to describe the ordered state cannot be used to describe the spin fluctuations, and vice versa. (See Ref. Y-A and references therein.) (4) In the absence of superexchange, there is no reason to believe that the total energy can be mapped onto a Heisenberg model, $\sum_{ij}J_{ij}\mathbf{S}_{i}\cdot\mathbf{S}_{j}.$ In fact, direct calculations show that at least one biquadratic term needs to be added to map the total energy onto the mean-field Hamiltonian, $\sum K(\mathbf{S}_{i}\cdot\mathbf{S}_{i+\mathbf{1}})^{2},$ where $K\sim J$. Ole Figure 4: The Fermi surfaces of stripe-ordered BaFe2As2. Top panel shows the ’reverse distortion’ in which the Fe-Fe distance is lengthened along the like spin direction and shortened along the unlike spin direction. The bottom panels shows the fully relaxed calculation which reproduces the experimentally observed distortion (to within a few percent). We now switch our attention to the structural transition observed simultaneoulsy with the magnetic one in the 122 systems. Density functional calculations very accurately reproduce the experimentally observed distortion in which Fe ions along the stripe direction are closer to one another than Fe atoms belong to adjacent stripes yildirim ; jesche . We investigated whether the structural distortion, like the magnetic ordering, can be understood in terms of one electron energies by calculating the DOS for a variety of small changes in the $a$ and $b$ lattice constants. In contrast to changing the magnetic pattern, changing the structural distortion has very little effect on the DOS away from the Fermi energy. There were no large shifts of spectral weight to lower energies, though small shifts of the order of 0.05 eV did occur and these were within 0.5 eV of the Fermi energy (for comparison see the heavy restructuring of the DOS in Figs. 2 and 3). The distortion can therefore be treated as a linear perturbation with a one-electron energy lowering observable at (or very near) the Fermi energy. Specifically, we find that the lowest energy structure corresponds to the smallest Fermi surface area. As an example, in Fig. 4 we show the Fermi surface in the magnetic Brillouin zone of the fully relaxed (lowest energy) structure and a ’reverse distortion’ in which the distances between like and unlike spins are reversed from the correct configuration. The change in the size of the Fermi surface is clearly visible. We were unable to engineer a further minimization of the Fermi surface with any choice of in-plane distortions other than the optimal energy one. In conclusion, we have shown that the relevant physics with respect to the magnetic ordering and structural distortion in the ferropnictides lies in the one-electron energies. Our results resolve the superficially binary choice between superexchange and Fermi surface nesting in favor of a third mechanism that is neither fully localized nor fully itinerant. One-electron energy is gained throughout an energy range of at least 1 eV below EF and the ground state is determined by which magnetic pattern most effectively exploits a downshift in spectral weight, not by fermiology. On the other hand, the Fermi surface itself is the operative feature for determination of the structural distortion. The energy minimum for an in-plane distortion corresponds to a simultaneous minimization of the Fermi surface area. We thank H. Eschrig, K. Koepernik and T. Yildirim for useful and engaging discussions related to this work. We acknowledge funding from the Office of Naval Research. ## References * (1) T. Kroll, S. Bonhommeau, T. Kachel, H.A. Duerr, J. Werner, G. Behr, A.Koitzsch, R. Huebel, S. Leger, R. Schoenfelder, A. Ariffin, R. Manzke, F.M.F. de Groot, J. Fink, H. Eschrig, B. Buechner, M. Knupfer, Phys. Rev. B 78, 220502 (2008); F. Bondino, E. Magnano, M. Malvestuto, F. Parmigiani, M. A. McGuire, A. S. Sefat, B. C. Sales, R. Jin, D. Mandrus, E. W. Plummer, D. J. Singh, N. Mannella; Phys. Rev. Lett. 101, 267001 (2008); E. Z. Kurmaev, R. G. Wilks, A. Moewes, N. A. Skorikov, Yu. A. Izyumov, L. D. Finkelstein, R. H. Li, X. H. Chen, Phys. Rev. B 78, 220503(R) (2008); V. I. Anisimov, E. Z. Kurmaev, A. Moewes, I. A. Izyumov, Physica C (Special Issue), to be published; T.D. Devereaux et al, to be published. * (2) V. I. Anisimov, Dm. M. Korotin, M. A. Korotin, A. V. Kozhevnikov, J. Kuneš, A. O. Shorikov, S. L. Skornyakov, S. V. Streltsov, J. Phys.: Condens. Matter 21, 075602 (2009); T. Miyake, L. Pourovskii, V. Vildosola, S. Biermann, A. Georges, J. Phys. Soc. Jpn. 77, Supplement C, 99 (2008). * (3) I.I. Mazin and J. Schmalian, Physica C (Special Issue), to be published. * (4) M.D. Johannes and I.I. Mazin, Phys. Rev. B77, 16535 (2008). * (5) M.A. Korotin, S.V. Streltsov, A.O. Shorikov, and V.I. Anisimov, JETP 107, 649 (2008). * (6) K.D. Belashchenko, V.P. Antropov, Phys. Rev. B78, 212505 (2008); T. Yildirim, Physica C (Special Issue), to be published. * (7) A. N. Yaresko, G.-Q. Liu, V. N. Antonov, O.K. Andersen, arXiv:0810.4469. * (8) I. I. Mazin, M. D. Johannes, L. Boeri, K. Koepernik, D. J. Singh, Phys. Rev. B78, 085104 (2008). * (9) G. Kresse, J. Furthmuller, Phys. Rev. B 54, 169 (1996). * (10) P. E. Blochl, Phys. Rev. B 50, 953 (1994). * (11) S. Li, C. de la Cruz, Q. Huang, Y. Chen, J.W. Lynn, J. Hu, Y-L. Huang, F-C. Hsu, K-W. Yeh, M-K. Wu, P. Dai, Phys. Rev. B 79, 054503 (2009). * (12) We are interested in how the double stripe structure manifests in stoichiometric FeTe within LDA. We cannot make meaningful comparisons with experiment and we therefore do not fully relax the FeTe structure, but only relax the internal positions. As before, relaxations are done separately for magnetic and nonmagnetic cases. We also neglect the checkerboard case as being of only secondary interest for this system. * (13) T. Yildirim, arXiv:0805.2888 (2008). * (14) A. Jesche, N. Caroca-Canales, H. Rosner, H. Borrmann, A. Ormeci, D. Kasinathan, K. Kaneko, H. H. Klauss, H. Luetkens, R. Khasanov, A. Amato, A. Hoser, C. Krellner, C. Geibel, Phys. Rev. B 78, 180504R (2008)
arxiv-papers
2009-04-24T12:21:52
2024-09-04T02:49:02.141573
{ "license": "Public Domain", "authors": "M. D. Johannes, Igor Mazin", "submitter": "Michelle Johannes", "url": "https://arxiv.org/abs/0904.3857" }
0904.3899
# Modified Gravitational Equations on Braneworld with Lorentz Invariant Violation Arianto(1,2,3) arianto@upi.edu Freddy P. Zen(1,2) fpzen@fi.itb.ac.id Bobby E. Gunara(1,2) bobby@fi.itb.ac.id (1)Theoretical Physics Lab., THEPI Devision, and (2)Indonesia Center for Theoretical and Mathematical Physics (ICTMP) Faculty of Mathematics and Natural Sciences, Institut Teknologi Bandung, Jl. Ganesha 10 Bandung 40132, INDONESIA. (3)Department of Physics, Udayana University Jl. Kampus Bukit Jimbaran Kuta-Bali 80361, INDONESIA. ###### Abstract The modified gravitational equations to describe a four-dimensional braneworld in the case with the Lorentz invariant violation in a bulk spacetime is presented. It contains a trace part of the brane energy-momentum tensor and the coefficients of all terms describe the Lorentz violation effects from the bulk spacetime. As an application, we apply this formalism to study cosmology. In respect to standard effective Friedmann equations on the brane, Lorentz invariance violation in the bulk causes a modification of this equations that can lead to significant physical consequences. In particular, the effective Friedmann equation on the brane explicitly depends on the equation of state of the brane matter and the Lorentz violating parameters. We show that the components of five-dimensional Weyl curvature are related to the matter on brane even at low energies. We also find that the constraints on the theory parameters are depend on the equation of state of the energy components of the brane matter. Finally, the stability of the model depend on the specific choices of initial conditions and the parameters $\beta_{i}$. ###### pacs: 98.80.Cq, 98.80.Hw ## I Introduction There has been a growing appreciation of the importance of the violations of Lorentz invariance recently. The intriguing possibility of the Lorentz violation is that an unknown physics at high-energy scales could lead to a spontaneous breaking of Lorentz invariance by giving an expectation value to certain non Standard Model fields that carry Lorentz indices, such as vectors, tensors, and gradients of scalar fields Kostelecky:1988zi . A relativistic theory of gravity where gravity is mediated by a tensor, a vector, and a scalar field, thus called TeVeS gravitational theory Bekenstein:2004ne , provides modified Newtonian dynamics (MOND) and Newtonian limits in the weak field nonrelativistic limit. TeVeS could also explain the large-scale structure formation of the Universe without recurring to cold dark matter Skordis:2005xk , which is composed of very massive slowly moving and weakly interacting particles. On the other hand, the Einstein–Aether theory Jacobson:2000xp is a vector-tensor theory, and TeVeS can be written as a vector-tensor theory which is the extension of the Einstein–Aether theory Zlosnik:2006sb . In the case of generalized Einstein–Aether theory Zlosnik:2006zu , the effect of a general class of such theories on the solar system has been considered in Ref. Bonvin:2007ap . On small scales the Einstein-Aether vector field will in general lead to a renormalization of the local Newton Constant Carroll:2004ai . Moreover, as has been shown by authors in Ref. Li:2007vz , the Einstein–Aether theory may lead to significant modifications of the power spectrum of tensor perturbation. The existence of vector fields in a scalar-vector-tensor theory of gravity also leads to its applications in modern cosmology and it might explain inflationary scenarios Lim:2004js ; Kanno:2006ty ; Watanabe:2009ct ; Avelino:2009wj and accelerated expansion of the universe Zlosnik:2006zu ; Tartaglia:2007mh . Based on a dynamical vector field coupled to the gravitation and scalar fields, we have studied to some extent the cosmological implications of a scalar-vector-tensor theory of gravity :2007xt . The models also allow crossing of phantom divide line Nozari:2008ff . Motivated by string theory and its extension M-theory, the standard model particles may be confined on a hypersurface, called brane, embedded in a higher dimensional space, called bulk. Only gravity and other exotic matter such as the dilaton can propagate in the bulk Horava:1995qa . The braneworld models have been shown to be extremely rich in phenomena leading to modifications of General Relativity (GR) at both low and high energies Maartens:2003tw . In the context of gravity and cosmology, models proposed by Randall and Sundrum (RS) Randall:1999ee ; Randall:1999vf have attracted much attention, where four-dimensional gravity can be recovered at low energy despite the infinite size of the extra dimension. In RS II model Randall:1999vf , a positive tension brane is embedded in five-dimensional anti-de Sitter (AdS) spacetime. To study gravity on the brane, it is useful to derive the effective four-dimensional Einstein equation on the brane firstly developed by Shiromizu, Maeda, and Sasaki (SMS) Shiromizu:1999wj . There are two very important results that arise from the effective four-dimensional Einstein equations on the brane. The first one is quadratic energy-momentum tensor, $\pi_{\mu\nu}$, which is relevant in high energy and the second one is the projected Weyl tensor, $E_{\mu\nu}$, on the brane which is responsible for carrying on the brane the contribution of the bulk gravitational field. In the RS II models, this term supplies an additional matter-like effect to the brane. Thus, its contribution to the four-dimensional effective theory is of crucial importance as it is non-negligible already even in low energy limit. Then, the Friedmann equations on the brane, governing the cosmological evolution of the brane, are non conventional in that the Hubble parameter depends quadratically on the energy density instead of linearly as in standard cosmology, and one radiation like term, usually referred to as a dark radiation term in the homogeneous and isotropic background spacetime. This dark radiation modifies the expansion of the background universe in the same way as an usual radiation Ida:1999ui ; Kraus:1999it ; Mukohyama:1999qx ; Ichiki:2002eh . Recently, a braneworld scenario with bulk broken Lorentz invariance has been developed, where a family of static self-tuning braneworld solutions was found Koroteev:2009xd . In a different approach braneworld model, a bulk vector field with a non-vanishing vacuum expectation value, allowing for the spontaneous breaking of the Lorentz symmetry. The breaking of Lorentz invariance the loss of this symmetry is transmitted to the gravitational sector of the model. By assuming that the vacuum expectation value of the component of the vector field normal to the brane vanishes, it found that Lorentz invariance on the brane can be made exact via the dynamics of the graviton, vector field, and the geometry of the extrinsic curvature of the surface of the brane. As a consequence of the exact reproduction of Lorentz symmetry on the brane, a condition for the matching of the observed cosmological constant in four dimensions is found Bertolami:2006bf . The notion of Lorentz violation in four dimensions is extended to a five- dimensional braneworld scenario resulting the time variation in the gravitational coupling and cosmological constant. There exist also a relation between the maximal velocity in the bulk and the speed of light on the brane Ahmadi:2006cr . Various Lorentz violating effects within the context of the braneworld scenario have also been studied in Refs. Csaki:2000dm ; Stoica:2001qe ; Libanov:2005yf ; Nozari:2008rg ; Farakos:2009ui . In this paper we address the issue of cosmological evolution on a brane in a theory of gravity whose action includes, in addition to the familiar Einstein term, a Lorentz violating vector field contribution. We generalize the gravitational effects of the vector fields in four dimensions Jacobson:2000xp ; Kostelecky:2003fs to include five dimensional braneworld gravity. In particular, we put a vector $n^{a}$ in the direction of the extra dimension such that the existence of the brane defines a preferred direction in the bulk. This paper is organized as follows. In Section II, we derive the four- dimensional effective Einstein equations on the brane in the case with the Lorentz invariant violation in a bulk spacetime. With non-ignoring of the Lorentz violation effects, this equation is modified by the trace of the brane energy–momentum tensor. Thus the relation between the projected Weyl tensor and the brane matter may be understood. In Section III, we study the cosmological implications of the modified four-dimensional effective Einstein equations on the brane. In general, the effective four-dimensional Einstein equations on the brane cannot be solved without knowing $E_{\mu\nu}$, because it could have a non-trivial component of an anisotropic stress Maartens:2000fg . However, it is possible to know some features of this tensor by using constraint equations on the brane obtained by the four-dimensional Bianchi identity. In the background spacetime, the four-dimensional equations are sufficient to show that $E_{\mu\nu}$ induces the radiation fluid on the brane. We will take this strategy to determine the Friedmann equation on the brane. Interestingly, the Friedmann equation is found to depend on the equation of state of the matter explicitly, and the Lorentz violation parameters. In Section IV, we discuss a low energy limit of the theory. Remarkable, the parameters of the theory can be determined by equation of state of the brane matter. Section V is devoted to the conclusions. ## II Modified SMS Effective Equation on the brane In this section, we derive the $4$-dimensional effective gravitational equations in a $Z_{2}$-symmetric braneworld using the geometrical projection approach. For this purpose, we first write the $5$-dimensional field equations in the form of the evolution equations along the extra dimension and the constraint equations. The action we consider consists of the vector field $n^{a}$ minimally coupled to gravity: $\displaystyle S$ $\displaystyle=$ $\displaystyle\frac{1}{2\kappa^{2}}\int d^{5}x\sqrt{-\tilde{g}}\left({\cal R}-2\Lambda\right)+\int d^{5}x\sqrt{-\tilde{g}}{\cal L}_{n}+\int d^{4}x\sqrt{-g}(-\sigma+{\cal L}_{m})\ .$ (1) Here, $\mathcal{R}$, $\kappa$, $\Lambda$, and $\tilde{g}$ are the scalar curvature, the gravitational constant in $5$-dimensions, the bulk cosmological constant, and the determinant of $5$-dimensional metric, respectively. ${\cal L}_{m}$ and ${\cal L}_{n}$ are the Lagrangian density for the matter fields on the brane and the vector field Lagrangian, respectively. A metric $g$ is the induced metric on the brane while $\sigma$ denotes the brane tension. Note that we have assumed no coupling between the matter fields and the vector field in the action (1). Therefore, the brane observer does not feel the present of the preferred frame. We write the coordinate system for the bulk spacetime in the form $ds^{2}=g_{ab}dx^{a}dx^{b}=dy^{2}+g_{\mu\nu}(y,x)dx^{\mu}dx^{\nu}\ ,$ (2) and we may assume that the position of the brane is $y=0$ in this coordinate system so that the induced metric on the brane is $g_{\mu\nu}(x)=\tilde{g}_{\mu\nu}(y=0,x)$. We also assume a $Z_{2}$-symmetry across the brane and the extrinsic curvature is defined as $K_{\mu\nu}=-g_{\mu\nu,y}/2$. The vector field Lagrangian, ${\cal L}_{n}$, is given by $\displaystyle{\cal L}_{n}$ $\displaystyle=$ $\displaystyle-\beta_{1}\nabla^{a}n^{b}\nabla_{a}n_{b}-\beta_{2}\left(\nabla_{a}n^{a}\right)^{2}-\beta_{3}\nabla^{a}n^{b}\nabla_{b}n_{a}+\lambda(n^{a}n_{a}-1)\ ,$ (3) where $\beta_{i}$ are constant parameters and $\lambda$ is a Lagrangian multiplier. In this setup, we assume that $n^{a}$ is a vector field along the extra dimension and the preferred frame is selected by the constrained vector field $n^{a}$ which violates Lorentz symmetry. We take $n^{a}$ as the dimensionless vector. Hence, each $\beta_{i}$ has dimension of $(mass)^{3}$. In other words, $\beta_{i}^{1/3}$ gives the mass scale of symmetry breakdown in the bulk. Following the usual braneworld scenarios our spacetime is orthogonal to the extra dimension. Then one can introduce the normal unit vector $n^{a}$ which is orthogonal to the hypersurfaces at $y=const$. as $n^{a}=\delta_{y}^{a}$. In particular, there is a background solution that 5-vector takes on a vacuum expectation value with components $(0,0,0,0,1)$, thus allowing for the spontaneous breaking of the Lorentz symmetry. Varying the action (1) with respect to the metric, $\lambda$, and $n^{a}$, respectively, we have the field equations $\displaystyle{}^{(5)}G_{ab}$ $\displaystyle=$ $\displaystyle-\Lambda g_{ab}+\kappa^{2}(T_{ab}+{\cal T}_{ab})+\kappa^{2}\delta_{a}^{\mu}\delta_{b}^{\nu}S_{\mu\nu}\delta(y)\ ,$ (4) $\displaystyle g_{ab}n^{a}n^{b}$ $\displaystyle=$ $\displaystyle 1\ ,$ (5) $\displaystyle\nabla_{a}J^{ab}$ $\displaystyle=$ $\displaystyle\lambda n^{b}\ ,$ (6) where current tensor $J^{a}{}_{c}$ is given by $J^{a}{}_{b}=-\beta_{1}\nabla^{a}n_{b}-\beta_{2}\delta^{a}_{b}\nabla_{c}n^{c}-\beta_{3}\nabla_{b}n^{a}\ ,$ (7) and $S_{\mu\nu}=-\sigma g_{\mu\nu}+\tau_{\mu\nu}$ is the energy momentum tensor on the brane, where $\tau_{\mu\nu}$ is the energy momentum tensor of the brane matter other than the tension. $T_{ab}$ is the energy–momentum tensor of the vector field. To be as general as possible, we also have included a bulk energy–momentum tensor in (4), denoted by ${\cal T}_{ab}$. Using the extrinsic curvature, the components of the left hand side of Einstein equations (4) are $\displaystyle{}^{(5)}G^{y}{}_{y}$ $\displaystyle=$ $\displaystyle-{1\over 2}R+{1\over 2}K^{2}-{1\over 2}K^{\alpha\beta}K_{\alpha\beta}=-\Lambda+\kappa^{2}T^{y}{}_{y}+\kappa^{2}{\cal T}^{y}{}_{y}\ ,$ (8) $\displaystyle{}^{(5)}G^{y}{}_{\mu}$ $\displaystyle=$ $\displaystyle- D_{\alpha}K_{\mu}{}^{\alpha}+D_{\mu}K=\kappa^{2}(T^{y}{}_{\mu}+{\cal T}^{y}{}_{\mu})\ ,$ (9) $\displaystyle{}^{(5)}G^{\mu}{}_{\nu}$ $\displaystyle=$ $\displaystyle G^{\mu}{}_{\nu}+(K^{\mu}{}_{\nu}-\delta^{\mu}_{\nu}K)_{,y}+{1\over 2}\delta^{\mu}_{\nu}(K^{2}+K^{\alpha\beta}K_{\alpha\beta})$ (10) $\displaystyle=$ $\displaystyle-\Lambda\delta^{\mu}_{\nu}+\kappa^{2}(T^{\mu}{}_{\nu}+{\cal T}^{\mu}{}_{\nu})+\kappa^{2}S^{\mu}{}_{\nu}\delta(y)\ ,$ where $G^{\mu}{}_{\nu}$ is the $4$-dimensional Einstein tensor and the covariant derivatives $D_{\mu}$ is calculated with respect to the four- dimensional metric $g_{\mu\nu}$. The components of the energy momentum tensor of the vector field are given by $\displaystyle T^{y}{}_{y}$ $\displaystyle=$ $\displaystyle\beta_{2}K^{2}+(\beta_{1}+\beta_{3})K^{\alpha\beta}K_{\alpha\beta}\ ,$ (11) $\displaystyle T^{y}{}_{\mu}$ $\displaystyle=$ $\displaystyle 0\ ,$ (12) $\displaystyle T^{\mu}{}_{\nu}$ $\displaystyle=$ $\displaystyle 2(\beta_{1}+\beta_{3})K^{\mu}{}_{\nu}K+\beta_{2}\delta^{\mu}{}_{\nu}K^{2}-\delta^{\mu}_{\nu}(\beta_{1}+\beta_{3})K^{\alpha\beta}K_{\alpha\beta}-2(\beta_{1}+\beta_{3})K^{\mu}{}_{\nu,y}-2\beta_{2}\delta^{\mu}_{\nu}K_{,y}\ .$ (13) Combining Eqs. (8) with (10) and using (11) and (13), we have $\displaystyle-{1\over 3}\left(R^{\mu}{}_{\nu}-{1\over 4}\delta^{\mu}_{\nu}R\right)$ $\displaystyle=$ $\displaystyle{1\over 6}\delta^{\mu}_{\nu}\Lambda+{(1-\alpha_{0})\over 12}\delta^{\mu}_{\nu}K^{2}-{(1+\alpha_{1})\over 3}\left(KK^{\mu}{}_{\nu}-{3\over 4}\delta^{\mu}_{\nu}K_{\alpha\beta}K^{\alpha\beta}\right)$ (14) $\displaystyle+{(1+\alpha_{1})\over 3}K^{\mu}{}_{\nu,y}-{(1-\alpha_{0})\over 3}\delta^{\mu}_{\nu}K_{,y}-{\kappa^{2}\over 3}\left({\cal T}^{\mu}{}_{\nu}-{1\over 2}\delta^{\mu}_{\nu}{\cal T}^{y}{}_{y}\right)\ ,$ where we have defined $\displaystyle\alpha_{0}=2\kappa^{2}\beta_{2},\quad\alpha_{1}=2\kappa^{2}(\beta_{1}+\beta_{3})\ .$ (15) The trace of equation (14) yields $\displaystyle(3-4\alpha_{0}-\alpha_{1})K_{,y}=2\Lambda-(\alpha_{0}+\alpha_{1})K^{2}+3(1+\alpha_{1})K_{\alpha\beta}K^{\alpha\beta}-{\kappa^{2}\over 3}\left({\cal T}^{\mu}{}_{\mu}-2{\cal T}^{y}{}_{y}\right).$ (16) Substituting Eqs. (14) and (16) into the following components of the Weyl tensor $\displaystyle C_{y\mu y\nu}$ $\displaystyle=$ $\displaystyle-{1\over 3}\left(R_{\mu\nu}-{1\over 4}g_{\mu\nu}R\right)+{1\over 3}\left(KK_{\mu\nu}-{1\over 4}g_{\mu\nu}K^{2}\right)+{1\over 3}\left(K_{\mu}{}^{\alpha}K_{\alpha\nu}+{3\over 4}g_{\mu\nu}K_{\alpha\beta}K^{\alpha\beta}\right)$ (17) $\displaystyle+{2\over 3}\left(K_{\mu\nu,y}-{1\over 4}g_{\mu\nu}K_{,y}\right)\ ,$ we have $\displaystyle\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}C_{y\mu y\nu}$ $\displaystyle=$ $\displaystyle{1\over 2}\Lambda g_{\mu\nu}-\frac{3\alpha_{0}+(2+\alpha_{0})\alpha_{1}}{4(3+\alpha_{1})}g_{\mu\nu}K^{2}-\frac{(1+\alpha_{1})\alpha_{1}}{(3+\alpha_{1})}KK_{\mu\nu}+\frac{(1+\alpha_{1})(3+2\alpha_{1})}{(3+\alpha_{1})}K_{\mu}{}^{\lambda}K_{\lambda\nu}$ (18) $\displaystyle+\frac{3(1+\alpha_{1})(4+\alpha_{1})}{4(3+\alpha_{1})}g_{\mu\nu}K_{\alpha\beta}K^{\alpha\beta}+(1+\alpha_{1})K_{\mu\nu,y}-(1-\alpha_{0})g_{\mu\nu}K_{,y}$ $\displaystyle+{\kappa^{2}\over 2}g_{\mu\nu}{\cal T}^{y}{}_{y}-{\kappa^{2}\over 3}\left({\cal T}_{\mu\nu}+{1\over 2}g_{\mu\nu}{\cal T}^{\alpha}{}_{\alpha}\right)\ .$ Here, we have defined that the term ${\cal T}^{\alpha}{}_{\alpha}$ is the trace defined with respect to the four-dimensional metric $g$, and not the full trace defined with respect to $\tilde{g}$. Equation (10) can be expressed as $\displaystyle G_{\mu\nu}$ $\displaystyle=$ $\displaystyle-\Lambda g_{\mu\nu}+(1+\alpha_{1})KK_{\mu\nu}-{(1-\alpha_{0})\over 2}g_{\mu\nu}K^{2}-2(1+\alpha_{1})K_{\mu}{}^{\alpha}K_{\alpha\nu}-{(1+\alpha_{1})\over 2}g_{\mu\nu}K_{\alpha\beta}K^{\alpha\beta}$ (19) $\displaystyle-(1+\alpha_{1})K_{\mu\nu,y}+(1-\alpha_{0})g_{\mu\nu}K_{,y}+\kappa^{2}{\cal T}_{\mu\nu}\ .$ Using Eq. (18), Eq. (19) is expressed as $\displaystyle G_{\mu\nu}$ $\displaystyle=$ $\displaystyle-\frac{1}{2}\Lambda g_{\mu\nu}-\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}E_{\mu\nu}-\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}(K_{\mu}{}^{\alpha}K_{\alpha\nu}-KK_{\mu\nu})-\frac{6+4\alpha_{1}-(3+\alpha_{1})\alpha_{0}}{4(3+\alpha_{1})}g_{\mu\nu}K^{2}$ (20) $\displaystyle+\frac{(1+\alpha_{1})(6+\alpha_{1})}{4(3+\alpha_{1})}g_{\mu\nu}K_{\alpha\beta}K^{\alpha\beta}+{\kappa^{2}\over 2}g_{\mu\nu}{\cal T}^{y}{}_{y}+{2\kappa^{2}\over 3}\left({\cal T}_{\mu\nu}-{1\over 4}g_{\mu\nu}{\cal T}^{\alpha}{}_{\alpha}\right)\ ,$ where the projected Weyl tensor is $E_{\mu\nu}=C_{y\mu y\nu}|_{y=0}$. Note that the coefficient of the four-dimensional Einstein tensor (20) is modified by factor $(3+\alpha_{1})$. Here, we take $\alpha_{1}\neq-3$. The case $\alpha_{1}=-3$ provides a relation between the extrinsic curvature and the projected Weyl tensor. To eliminate the extrinsic curvature, we use the junction conditions. It can be obtained by collecting together the terms in field equations which contain a $\delta$-function. From Eqs. (10) and (13), we then obtain $\displaystyle\left[K^{\mu}{}_{\nu}-\delta^{\mu}_{\nu}K\right]|_{y=0}$ $\displaystyle=$ $\displaystyle{\kappa^{2}\over 2(1+\alpha_{1})}\left(S^{\mu}{}_{\nu}+\alpha_{2}\delta^{\mu}_{\nu}S\right)\ ,$ (21) where $\displaystyle\alpha_{2}=\frac{\alpha_{0}+\alpha_{1}}{3-4\alpha_{0}-\alpha_{1}}\ .$ (22) For convenient we will take $\alpha_{1}\neq-3$ and $\alpha_{1}\neq-1$ in order to avoid unreal singularities in Eqs. (20) and (21). Substituting (21) into (20), we finally obtain the modified effective SMS equation on the brane as $\displaystyle G_{\mu\nu}$ $\displaystyle=$ $\displaystyle-\Lambda_{b}g_{\mu\nu}+8\pi G\left(\tau_{\mu\nu}+{\alpha_{1}\over 12}g_{\mu\nu}\tau\right)+\kappa^{4}\pi_{\mu\nu}-\widetilde{E}_{\mu\nu}+F_{\mu\nu}\ ,$ (23) where we have defined the quantities $\displaystyle\Lambda_{b}$ $\displaystyle=$ $\displaystyle\frac{1}{2}\Lambda+\frac{\kappa^{4}}{4(3-4\alpha_{0}-\alpha_{1})}\sigma^{2},$ (24) $\displaystyle 8\pi G$ $\displaystyle=$ $\displaystyle\frac{3\kappa^{4}}{2(3+\alpha_{1})(3-4\alpha_{0}-\alpha_{1})}\sigma,$ (25) $\displaystyle\pi_{\mu\nu}$ $\displaystyle=$ $\displaystyle\frac{3}{4(3+\alpha_{1})(1+\alpha_{1})}\left[{(1-2\alpha_{0}-\alpha_{1})\over(3-4\alpha_{0}-\alpha_{1})}\tau\tau_{\mu\nu}-\tau_{\mu}{}^{\alpha}\tau_{\alpha\nu}+{(6+\alpha_{1})\over 12}g_{\mu\nu}\tau_{\alpha\beta}\tau^{\alpha\beta}\right.$ (26) $\displaystyle\left.-{2(3-\alpha_{1})-(9+\alpha_{1})\alpha_{0}\over 12(3-4\alpha_{0}-\alpha_{1})}g_{\mu\nu}\tau^{2}\right]\ ,$ $\displaystyle\widetilde{E}_{\mu\nu}$ $\displaystyle=$ $\displaystyle\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}E_{\mu\nu}\ ,$ (27) and the bulk energy-momentum tensor projected on the brane is given by $\displaystyle F_{\mu\nu}$ $\displaystyle=$ $\displaystyle\left[{\kappa^{2}\over 2}g_{\mu\nu}{\cal T}^{y}{}_{y}+{2\kappa^{2}\over 3}\left({\cal T}_{\mu\nu}-{1\over 4}g_{\mu\nu}{\cal T}^{\alpha}{}_{\alpha}\right)\right]_{y=0}\ .$ (28) There are four features in the effective Einstein equations (23). The first one is the presence of the bulk energy-momentum tensor. This term allows exotic matter such as the dilaton can propagate in the bulk. The second departure from the standard four-dimensional Einstein equation arises from the presence of the Weyl tensor which is undetermined on the brane. The third is a quadratic in the brane energy-momentum tensor. The last one is a linear in addition to the brane energy-momentum tensor. It is our main result. This trace part of the brane energy-momentum tensor is measured by local observers at the brane and vanishes when $\alpha_{1}=2\kappa^{2}(\beta_{1}+\beta_{3})=0$. Equation (9) and the junction conditions (21) imply $\displaystyle D_{\mu}\tau^{\mu}{}_{\nu}+\alpha_{2}D_{\nu}\tau-(1+4\alpha_{2})D_{\nu}\sigma=-2(1+\alpha_{1}){\cal T}^{y}{}_{\nu}\ .$ (29) This equation tell us that the energy momentum tensor $\tau_{\mu\nu}$ is not conserved on the brane. Taking the divergence of the four–dimensional effective equations and using four–dimensional Bianchi identity, we obtain the constraint equations for $E_{\mu\nu}$ as $\displaystyle D_{\mu}\widetilde{E}^{\mu}{}_{\nu}$ $\displaystyle=$ $\displaystyle-D_{\nu}\Lambda_{b}+8\pi G\left(D_{\mu}\tau^{\mu}{}_{\nu}+{\alpha_{1}\over 12}D_{\nu}\tau\right)+\kappa^{4}D_{\mu}\pi^{\mu}{}_{\nu}$ (30) $\displaystyle+{\kappa^{2}\over 2}D_{\nu}{\cal T}^{y}{}_{y}+{2\kappa^{2}\over 3}\left(D_{\mu}{\cal T}_{\mu\nu}-{1\over 4}D_{\nu}{\cal T}^{\alpha}{}_{\alpha}\right).$ Equations (29) and (30) indicate a time variation of the brane tension, the cosmological constant, and the gravitational constant in general. In the following section, we study analytically the cosmological consequences of Eqs. (23), (29) and (30). Here, for simplicity, we consider constant $\sigma$, because there are no theoretical observational arguments for the evolution of $\sigma$ in time. For cosmology on the brane, we suppose here that we can ignore the bulk matter, $F_{\mu\nu}=0$. The bulk matter is important to get a well–behaved geometry in the bulk. We also assume that the bulk cosmological constant is truly constant. Then, Eqs. (29) and (30) become $\displaystyle D_{\mu}\tau^{\mu}{}_{\nu}=-\alpha_{2}D_{\nu}\tau\ ,$ (31) $\displaystyle D_{\mu}\widetilde{E}^{\mu}{}_{\nu}=-8\pi G\left(\alpha_{2}-{\alpha_{1}\over 12}\right)D_{\nu}\tau+\kappa^{4}D_{\mu}\pi^{\mu}{}_{\nu}\ .$ (32) Note that the projected Weyl tensor is affected by the energy–momentum tensor on the brane even at low energies. Thus, the model is quite different from the conventional braneworld even at low energies. ## III Braneworld cosmology The projected Weyl tensor in the modified Einstein equation (23) is a priori undetermined. This comes from the five-dimensional nature of the theory and the fact that the system of equations is not closed on the brane. This tensor mediates some information from the bulk to the brane. In this section, we will try to solve Einstein equation to study the cosmology braneworld from equation (23), by assuming that there is no cosmological constant on the brane and the constant vacuum energy. Although these assumptions are usual in braneworld scenario, we will show, which is the main result of present paper, the effective Friedmann equations is modified by the effect of Lorentz violation, and the components of the projected Weyl tensor are related to the matter on the brane. We then discuss the method to obtain the components of the projected Weyl tensor from the brane data. For cosmological applications, we consider a metric of the form $\displaystyle ds^{2}=-dt^{2}+a^{2}(t)\delta_{ij}dx^{i}dx^{j}\ ,$ (33) where $x^{i}$ are the three ordinary spatial coordinates and $a$ is the scale factor. The Hubble parameter $H$ on the brane, describing the cosmological dynamics of the Universe, is defined as $H=\dot{a}/a$. For simplicity, we ignore the bulk matter for the cosmology on the brane. Hereafter, we will consider only the matter on the brane. For further discussions on the gravitational field equations in the braneworld model with Lorentz violation and their cosmological applications see Ahmadi:2006cr . We restrict the energy-momentum tensor on the brane of the form $\displaystyle\tau_{\mu\nu}=(\rho,Pa^{2}\delta_{ij})\ ,$ (34) where $\rho$ is the energy density and $P$ the pressure. We will assume that the equation of state relating $\rho$ and $P$ has the form $P=\omega\rho$, where $\omega$ is constant. Similarly, the projected Weyl tensor is of the form $\displaystyle E_{\mu\nu}=(\rho_{d},P_{d}a^{2}\delta_{ij})\ .$ (35) The traceless property of $E_{\mu\nu}$ implies: $-\rho_{d}+3P_{d}=0$. We will be interested in the relation between the components of the projected Weyl tensor and the brane energy-momentum tensor. The components of the quadratic in the energy-momentum tensor (26) are given by $\displaystyle\pi_{00}$ $\displaystyle=$ $\displaystyle\frac{1+3\alpha_{3}}{4(3+\alpha_{1})(1+\alpha_{1})^{2}}\rho^{2}\ ,$ (36) $\displaystyle\pi_{ij}$ $\displaystyle=$ $\displaystyle\frac{1+2\omega-3\alpha_{4}}{4(3+\alpha_{1})(1+\alpha_{1})^{2}}\rho^{2}a^{2}\delta_{ij}\ ,$ (37) where $\displaystyle\alpha_{3}$ $\displaystyle=$ $\displaystyle\frac{1}{12(3-4\alpha_{0}-\alpha_{1})}\\{[7-9(2+\omega)\omega-3(1+\omega)^{2}(2-\alpha_{1})\alpha_{1}]\alpha_{0}-[17-3\omega(8+3\omega)$ $\displaystyle+2(1-12\omega-3\omega^{2}+(1+3\omega^{2})\alpha_{1}^{2})]\alpha_{1}\\}\ ,$ $\displaystyle\alpha_{4}$ $\displaystyle=$ $\displaystyle\frac{1}{12(3-4\alpha_{0}-\alpha_{1})}\\{[-1-2\omega+15\omega^{2}+3(1+\omega)^{2}(6+\alpha_{1})\alpha_{1}]\alpha_{0}-[15+32\omega$ (38) $\displaystyle-15\omega^{2}-(1+3\omega^{2})\alpha_{1}^{2}-2(1+9\omega^{2})\alpha_{1}]\alpha_{1}\\}\ .$ Substituting metric (33) and tensors (34), (35) and (36), (37) in the effective Einstein equations (23), one finds $\displaystyle 3H^{2}=8\pi G\left[1+\frac{(1-3\omega)\alpha_{1}}{12}\right]\rho+\frac{\kappa^{4}(1+3\alpha_{3})}{4(1+\alpha_{1})^{2}(3+\alpha_{1})}\rho^{2}-\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}\rho_{d}\ ,$ (39) $\displaystyle-2\dot{H}-3H^{2}=8\pi G\left[\omega-\frac{(1-3\omega)\alpha_{1})}{12}\right]\rho+\frac{\kappa^{4}(1+2\omega-3\alpha_{4})}{4(1+\alpha_{1})^{2}(3+\alpha_{1})}\rho^{2}-\frac{(1+\alpha_{1})}{(3+\alpha_{1})}\rho_{d}\ .$ (40) Obviously, these equations are quite different from the usual braneworld equations due to the effect of bulk Lorentz violation. From Eq. (31) and the constraint equation for the projected Weyl tensor (32), we have $\displaystyle[1+(1-\omega)\alpha_{2}]\dot{\rho}+3H\rho(1+\omega)=0\ ,$ (41) and $\displaystyle\dot{\rho}_{d}+4H\rho_{d}$ $\displaystyle=$ $\displaystyle\frac{8\pi G(1+\omega)(1-3\omega)(3+\alpha_{1})(3-4\alpha_{0}-\alpha_{1})}{3(1+\alpha_{1})^{3}}\left[\alpha_{2}-\frac{(1+\alpha_{1})^{2}\alpha_{1}}{12(1-\omega\alpha_{1}-(1+\omega)\alpha_{0})}\right]H\rho$ (42) $\displaystyle-\frac{\kappa^{4}(1+\omega)\alpha_{5}}{4(1+\alpha_{1})^{3}(1+(1-3\omega)\alpha_{2})}H\rho^{2},$ where $\displaystyle\alpha_{5}$ $\displaystyle=$ $\displaystyle\frac{(1+\alpha_{1})}{2(3-4\alpha_{0}-\alpha_{1})}\\{12(1+\omega)^{2}\alpha_{0}^{2}\alpha_{1}+[9(1+3\omega^{2})+(1+3\omega^{2})\alpha_{1}^{2}-2(1+12\omega-9\omega^{2})\alpha_{1}]\alpha_{1}$ (43) $\displaystyle+[3(1-3\omega^{2})-2(7+30\omega-9\omega^{2})\alpha_{1}+(7+6\omega+15\omega^{2})\alpha_{1}^{2}]\alpha_{0}\\}\ .$ For $\omega\neq-1$, equation (41) is solved to yield $\displaystyle\rho=a^{-\frac{3(1+\omega)}{1+(1-\omega)\alpha_{2}}}\ .$ (44) Here, we have absorbed a constant factor into the scale factor by rescaling it. Equation (42) can be integrated. We find $\displaystyle{\rho}_{d}$ $\displaystyle=$ $\displaystyle-{3C\over a^{4}}+\frac{8\pi G(1+\omega)(3+\alpha_{1})(3-4\alpha_{0}-\alpha_{1})^{2}}{9(1+\alpha_{1})^{4}}\left\\{[1+(1-3\omega)\alpha_{2}]\alpha_{2}-\frac{\alpha_{1}(1+\alpha_{1})^{2}}{4(3-4\alpha_{0}-\alpha_{1})}\right\\}a^{-\frac{3(1+\omega)}{1+(1-\omega)\alpha_{2}}}$ (45) $\displaystyle-\frac{\kappa^{4}(1+\omega)\alpha_{5}}{8(1+\alpha_{1})^{3}[2(1-3\omega)\alpha_{2}-(1+3\omega)]}a^{-\frac{6(1+\omega)}{1+(1-\omega)\alpha_{2}}}\ ,$ where $C$ is a constant of integration. This effect of the bulk acts as radiation fluid, hence it is called as dark radiation. Substituting Eq. (45) into Eq. (39), we obtain the effective Friedmann equation $\displaystyle H^{2}$ $\displaystyle=$ $\displaystyle{8\pi G_{eff}\over 3}\rho+A\rho^{2}+{\bar{C}\over a^{4}}\ ,$ (46) where $\displaystyle G_{eff}$ $\displaystyle=$ $\displaystyle\left\\{1-\frac{[1-\omega\alpha_{1}-(1+\omega)\alpha_{0}][(2+3\omega-(2+\alpha_{1})\alpha_{1})\alpha_{1}+3(1+\omega)\alpha_{0}]}{3(1+\alpha_{1})^{3}}\right\\}G\ ,$ (47) $\displaystyle A$ $\displaystyle=$ $\displaystyle\frac{\kappa^{4}}{12(3+\alpha_{1})(1+\alpha_{1})^{2}}\left[1+3\alpha_{3}-\frac{3(1+\omega)\alpha_{5}}{2[(1+3\omega)-2(1-3\omega)\alpha_{2}]}\right],$ (48) $\displaystyle\bar{C}$ $\displaystyle=$ $\displaystyle\frac{3(1+\alpha_{1})}{(3+\alpha_{1})}C\ .$ (49) Note that the effective Newton constant depends on the Lorentz violating parameters and the equations of state. It is different from the conventional braneworld cosmology in five-dimensional case even at low energy. If the effects of Lorentz violations are ignored, $\beta_{i}=0$, we have $G_{eff}=G$, $A=\kappa^{4}/36$ and $\bar{C}=C$. In the alternative theory of gravity including Brans–Dicke theory, the effective Newton constant need not be constant in time. Observational bounds on $\dot{G}/G$ then constrain the theory. In our case, we have the relation (47), hence the Newton constant is always constant. If the effective cosmological constant is included, the Friedmann equation (46) becomes $\displaystyle H^{2}$ $\displaystyle=$ $\displaystyle{1\over 3}\Lambda_{b}+{8\pi G_{eff}\over 3}\rho+A\rho^{2}+{\bar{C}\over a^{4}}\ ,$ (50) where the relation between the vacuum energy and the effective cosmological constant on a brane is given by Eq. (24). It is different from the usual four- dimensional theory. In the RS braneworld, the vacuum energy in the brane is not directly related to the cosmological constant on the brane in the effective Einstein equation as in Eq. (24). In the RS braneworld, there should be a cancellation between the four-dimensional and five-dimensional contribution of the vacuum energy in order to have a vanishing cosmological constant on the brane. This requires a fine-tuning for the parameters in the action. In the present model the RS type relation is given by $\displaystyle\sigma=\frac{6}{\kappa^{2}l}\left(1-{4\over 3}\alpha_{0}-{1\over 3}\alpha_{1}\right)^{1/2}\ ,$ (51) and $\displaystyle 8\pi G=\frac{3\kappa^{2}}{l(3+\alpha_{1})(1+\alpha_{1})^{1/2}}\ .$ (52) Here, the bulk cosmological constant is defined as $\Lambda=-6/\kappa^{2}l^{2}$, where $l$ is the scale of the bulk curvature radius. ## IV Low Energy Constraint on $\beta_{i}$ For a well-defined theory, the constraints on the theory parameters $\beta_{i}$ are given by Lim:2004js (see also Carroll:2004ai ): 1. 1. Subluminal propagation of spin-0 field: $(\beta_{1}+\beta_{2}+\beta_{3})/\beta_{1}\leq 1$, 2. 2. Positivity of Hamiltonian: $\beta_{1}>0$, 3. 3. Non-tachyonic propagation of spin-0 field: $(\beta_{1}+\beta_{2}+\beta_{3})/\beta_{1}\geq 0$, 4. 4. Subluminal propagation of spin-2 field: $\beta_{1}+\beta_{3}\leq 0$. All these conditions together imply $(\beta_{1}+\beta_{2}+\beta_{3})\geq 0$ and $\beta_{2}\geq 0$. At low energies, we can neglect the quadratic term of the Friedmann equation (46). Then we have $\displaystyle H^{2}$ $\displaystyle=$ $\displaystyle{8\pi G_{eff}\over 3}\rho+{\bar{C}\over a^{4}}\ .$ (53) Here, we have assumed $3A/8\pi G_{eff}<<1$. Therefore, one can set $A\approx 0$ without loss of generality. Solving Eq. (48) one finds $\displaystyle\alpha_{1}=\frac{1-\alpha_{0}(1+\omega)}{\omega},~{}~{}\text{or}~{}~{}\alpha_{1}=\frac{2(1+3\omega)-3\alpha_{0}(1+\omega)^{2}}{1+3\omega^{2}}\ ,$ (54) where $\alpha_{0}$ and $\alpha_{1}$ is given by Eq. (15). In other word, the effect of Lorentz violation in the bulk is dependent on the equation of state of the energy components of the Universe. Remarkable, the first solution (54) yields $G_{eff}=G$. In this case, using the above constraints we find 1. 1. For $\omega<-1$, $\displaystyle\alpha_{0}>\frac{1+3\omega}{1+\omega},\qquad\alpha_{1}<-3\ ,$ (55) and $\displaystyle 1<\alpha_{0}<\frac{1+3\omega}{1+\omega},\qquad-3<\alpha_{1}<-1\ .$ (56) 2. 2. For $-1<\omega<0$, $\displaystyle 1<\alpha_{0}\leq\frac{1}{1+\omega},\qquad-1<\alpha_{1}\leq 0\ .$ (57) 3. 3. For $\omega>0$, $\displaystyle\frac{1}{1+\omega}\leq\alpha_{0}<1,\qquad-1<\alpha_{1}\leq 0\ .$ (58) The above constraints give the correction in the coefficient of the dark radiation. The second solution (54) gives the constraints: 1. 1. For $\omega<-1$, $\displaystyle\alpha_{0}>\frac{5+6\omega+9\omega^{2}}{3(1+\omega)^{2}},\qquad\alpha_{1}<-3\ ,$ (59) and $\displaystyle 1<\alpha_{0}<\frac{5+6\omega+9\omega^{2}}{3(1+\omega)^{2}},\qquad-3<\alpha_{1}<-1\ .$ (60) 2. 2. For $-1<\omega\leq-1/3$, $\displaystyle\alpha_{0}>\frac{5+6\omega+9\omega^{2}}{3(1+\omega)^{2}},\qquad\alpha_{1}<-3\ ,$ (61) and $\displaystyle 1<\alpha_{0}<\frac{5+6\omega+9\omega^{2}}{3(1+\omega)^{2}},\qquad-3<\alpha_{1}<-1\ .$ (62) 3. 3. For $\omega\geq-1/3$, $\displaystyle\frac{2(1+3\omega)}{3(1+\omega)^{2}}\leq\alpha_{0}<1,\qquad-1<\alpha_{1}\leq 0\ .$ (63) These constraints give the corrections both in the effective Newton constant and the dark radiation. ## V Conclusions In the present paper, we have considered a five-dimensional braneworld model with bulk Lorentz invariance violation, and derived the effective four- dimensional Einstein equations on the brane. The main result of this paper is the existence of the trace part of the brane energy-momentum tensor in the modified Einstein equations on the brane, which is a modification of the SMS effective equation Shiromizu:1999wj . Thus, the divergence of the projected Weyl tensor is modified. Therefore, due to Lorentz violating effect, we have obtained an expression for the projected Weyl tensor as a function of the source on the brane. It becomes clear that the bulk effect can be determined by matter localized on the brane even at low energies. As an application, we have used the modified SMS effective equation to determine the Friedmann equation on the brane. We have showed the effective Newton constant that relates geometry to the matter density in Friedmann equation is dependent on the equation of state of the energy component of the Universe, and the Lorentz violating parameters. Note that if the brane was isotropic and homogeneous, the matter part would have the additional property, $D^{\mu}\pi_{\mu\nu}=0$. However, due to effect of Lorentz violation in the bulk, the effect of matter still appears in Eq. (32). Thus, the brane matter will deform the bulk geometry. In other word, the back-reaction of this to the brane will modify the effective Friedmann equation even at low energies. It is interesting to understand the low energy description of this braneworld model. The low energy perturbation scheme proposed in Kanno:2006ty is a major achievement as it allows for the derivation of the effective theory on the brane and for the full comprehension of the Weyl tensor contribution to the effective theory. We leave this issue for future studies. Finally, we also find that the effect of Lorentz violation in the bulk is dependent on the equation of state of the energy components of the brane matter. This model also provides a convenient framework within which one may study dark energy. ###### Acknowledgements. Arianto wishes to acknowledge all members of the Theoretical Physics Laboratory, the THEPI Divison of the Faculty of Mathematics and Natural Sciences, ITB, for the warmest hospitality. This work was supported by Hibah Kompetensi DIKTI, 2009\. ## References * (1) V. A. Kostelecky and S. Samuel, Phys. Rev. D 39, 683 (1989). * (2) J. D. Bekenstein, Phys. Rev. D 70, 083509 (2004) [Erratum-ibid. D 71, 069901 (2005)] [arXiv:astro-ph/0403694]. * (3) C. Skordis, D. F. Mota, P. G. Ferreira and C. Boehm, Phys. Rev. Lett. 96, 011301 (2006) [arXiv:astro-ph/0505519] ;C. Skordis, Phys. Rev. D 74, 103513 (2006) [arXiv:astro-ph/0511591]. * (4) T. Jacobson and D. Mattingly, Phys. Rev. D 64, 024028 (2001) [arXiv:gr-qc/0007031]. * (5) T. G. Zlosnik, P. G. Ferreira and G. D. Starkman, Phys. Rev. D 74, 044037 (2006) [arXiv:gr-qc/0606039]. * (6) T. G. Zlosnik, P. G. Ferreira and G. D. Starkman, Phys. Rev. D 75, 044017 (2007) [arXiv:astro-ph/0607411]. * (7) C. Bonvin, R. Durrer, P. G. Ferreira, G. Starkman and T. G. Zlosnik, Phys. Rev. D 77, 024037 (2008) [arXiv:0707.3519 [astro-ph]]. * (8) S. M. Carroll and E. A. Lim, Phys. Rev. D 70, 123525 (2004) [arXiv:hep-th/0407149]. * (9) B. Li, D. Fonseca Mota and J. D. Barrow, Phys. Rev. D 77, 024032 (2008) [arXiv:0709.4581 [astro-ph]]. * (10) V. A. Kostelecky, Phys. Rev. D 69, 105009 (2004) [arXiv:hep-th/0312310]. * (11) S. Kanno and J. Soda, Phys. Rev. D 74, 063505 (2006) [arXiv:hep-th/0604192]. * (12) M. a. Watanabe, S. Kanno and J. Soda, arXiv:0902.2833 [hep-th]. * (13) P. P. Avelino, D. Bazeia, L. Losano, R. Menezes and J. J. Rodrigues, arXiv:0903.5297 [astro-ph.CO]. * (14) E. A. Lim, Phys. Rev. D 71, 063504 (2005) [arXiv:astro-ph/0407437]. * (15) A. Tartaglia and N. Radicella, Phys. Rev. D 76, 083501 (2007) [arXiv:0708.0675 [gr-qc]]. * (16) Arianto, F. P. Zen, B. E. Gunara, Triyanta and Supardi, JHEP 0709, 048 (2007) [arXiv:0709.3688 [hep-th]]; Arianto, F. P. Zen, Triyanta and B. E. Gunara, Phys. Rev. D 77, 123517 (2008) [arXiv:0801.0331 [hep-th]]; F. P. Zen, Arianto, B. E. Gunara, Triyanta and A. Purwanto, arXiv:0809.3847 [hep-th]. * (17) K. Nozari and S. D. Sadatian, Eur. Phys. J. C 58, 499 (2008) [arXiv:0809.4744 [gr-qc]]. * (18) P. Horava and E. Witten, Nucl. Phys. B 460, 506 (1996) [arXiv:hep-th/9510209]. * (19) For a review see, e.g., R. Maartens, Living Rev. Rel. 7, 7 (2004) [arXiv:gr-qc/0312059]. * (20) L. Randall and R. Sundrum, Phys. Rev. Lett. 83, 3370 (1999) [arXiv:hep-ph/9905221]. * (21) L. Randall and R. Sundrum, Phys. Rev. Lett. 83, 4690 (1999) [arXiv:hep-th/9906064]. * (22) T. Shiromizu, K. i. Maeda and M. Sasaki, Phys. Rev. D 62, 024012 (2000) [arXiv:gr-qc/9910076]. * (23) D. Ida, JHEP 0009, 014 (2000) [arXiv:gr-qc/9912002]. * (24) P. Kraus, JHEP 9912, 011 (1999) [arXiv:hep-th/9910149]. * (25) S. Mukohyama, Phys. Lett. B 473, 241 (2000) [arXiv:hep-th/9911165]. * (26) K. Ichiki, M. Yahiro, T. Kajino, M. Orito and G. J. Mathews, Phys. Rev. D 66, 043521 (2002) [arXiv:astro-ph/0203272]. * (27) P. Koroteev and M. Libanov, Phys. Rev. D 79, 045023 (2009) [arXiv:0901.4347 [hep-th]]; P. Koroteev and M. Libanov, JHEP 0802, 104 (2008) [arXiv:0712.1136 [hep-th]]. * (28) O. Bertolami and C. Carvalho, Phys. Rev. D 74, 084020 (2006) [arXiv:gr-qc/0607043]. * (29) F. Ahmadi, S. Jalalzadeh and H. R. Sepangi, Class. Quant. Grav. 23, 4069 (2006) [arXiv:gr-qc/0605038]; F. Ahmadi, S. Jalalzadeh and H. R. Sepangi, Phys. Lett. B 647, 486 (2007) [arXiv:gr-qc/0702103]. * (30) C. Csaki, J. Erlich and C. Grojean, Nucl. Phys. B 604, 312 (2001) [arXiv:hep-th/0012143]. * (31) H. Stoica, JHEP 0207, 060 (2002) [arXiv:hep-th/0112020]. * (32) M. V. Libanov and V. A. Rubakov, JCAP 0509, 005 (2005) [arXiv:astro-ph/0504249]. * (33) K. Nozari and S. D. Sadatian, JCAP 0901, 005 (2009) [arXiv:0810.0765 [gr-qc]]. * (34) K. Farakos, arXiv:0903.3356 [hep-th]. * (35) R. Maartens, Phys. Rev. D 62, 084023 (2000) [arXiv:hep-th/0004166].
arxiv-papers
2009-04-24T16:07:36
2024-09-04T02:49:02.148051
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "A. Arianto, Freddy P. Zen, Bobby E. Gunara", "submitter": "Arianto Arianto", "url": "https://arxiv.org/abs/0904.3899" }
0904.3927
# A Critique of “Solving the P/NP Problem Under Intrinsic Uncertainty” Andrew Keenan Richardson Cole Arthur Brown Although whether P equals NP is an important, open problem in computer science, and although Jaeger’s 2008 [1] paper, “Solving the P/NP Problem Under Intrinsic Uncertainty” presents an attempt at tackling the problem by discussing the possibility that all computation is uncertain to some degree, there are a number of logical oversights present in that paper which preclude it from serious consideration toward having resolved P-versus-NP. There are several differences between the model of computation presented in Jaeger’s paper [1] and the standard model, as well as several bold assumptions that are not well supported in Jaeger’s paper [1] or in the literature. In addition, we find several omissions of rigorous proof that ultimately weaken this paper to a point where it cannot be considered a candidate solution to the P-versus-NP problem. ## 1 Overview Jaeger [1] presents a paper which attempts to show that P is not equal to NP. This follows from a novel model of computation which has intrinsic uncertainty in its computation of all problems. However, we will show that this model cannot be used to solve the same class of decisions that a Turing machine can. ### 1.1 Summary of the Paper in Question Jaeger [1] in his paper: Solving the P/NP Problem Under Intrinsic Uncertainty, attempts to resolve P-versus-NP through unique, unconventional means, by sketching a computer science analogue to the Heisenberg Uncertainty Principle. He begins by establishing a supposedly Turing equivalent computing machine largely based off of the Turing machine that contains a tape of binary storage cells of any length, infinite or finite. Rather than assuming the machine is preprogrammed to accept certain inputs, the model described has a single tape in which both the input and the program code are randomly placed. This allows him to introduce the uncertainty that the paper is based on. He argues that since multiple, unique programs can perform the same actions at different speeds, program size should be considered when analyzing program complexity. He continues that his concept of “intrinsic uncertainty” implies that it is impossible to distinguish whether, given a segment of the input, a part of this segment is program code or input. Jaeger [1] likens the relationship of the parts of this segment to the relationship described in Heisenberg’s Uncertainty Principle – that you can not determine whether a part is code or input, rather you can compute the answer given both options and then compute the “certainty” that each computation is correct. There is a problem with this, he explains, because according to his model every computation done on the machine has uncertainty, including his certainty calculations. To solve this problem, he proposes what he calls “self-computation”, or applying his Turing-machine-based machine to itself to compute a confidence value for its output, thus increasing the confidence value of its output. As a result of this self-computation he claims that the confidence value of a computation is directly proportional to the ratio of code length to input length. Through use of the sigmoid function, he claims one can calculate the entropy, or the probability that this confidence value is smaller than, larger than or equal to 0.5. To relate this all to the P/NP problem, Jaeger [1] constructs three lemmas. His first lemma says that a Turing machine simulating a computable decision in NP to an arbitrary precision is itself computable regardless of the precision. Lemma three states that this Turing machine is also in NP for some given uncertainties. Lemma two allows him to state an uncertainty threshold for which the Turing machine is not in P, thus proving that there exists some function in NP but not in P. ### 1.2 P = NP Problem The problem known as P=NP is arguably the biggest open problem in computer science [2]. The Clay Mathematics Institute has offered a $1,000,000 prize for anyone who provides a proof one way or another. This incentive has attracted quite a few attempts by amateurs as well as professionals, since the problem at first seems deceptively simple. The basic question asked by this problem is this: if an answer to a yes or no problem can be verified in polynomial time, can the answer also be computed in polynomial time? The answer is commonly assumed to be ‘no’, although no proof has yet emerged. One way to prove that P is not equal to NP is to give a counter example of a problem that is in NP but proveably not in P. This is more difficult than it sounds because it is difficult to prove that there are no algorithms in P which compute the answer. Jaeger’s paper [1] attempts to prove that there is some inrinsic information necessary for having the answer to a problem, and that this intrinsic information can only be computed in nonpolynomial time. ### 1.3 Turing Machines Jaeger 2008 [1] uses the model of a Turing machine, a theoretical model of computing yes or no answers. The model of a Turing machine has several parts [3]: a finite set of states including the initial state and a subset of final or accepting states, a finite set of tape alphabet symbols composed of the blank symbol and a set of input symbols, and a transition function which computes the new state, the alphabet symbol to be printed, and the direction to move (right or left), based on the current state and the current tape symbol. Informally there are two parts in a Turing machine: a finite set of states in which the current state is arrived at deterministically, and an infinite tape which may start with a finite number of non-blank symbols printed on it. ## 2 Challenging the Arguments Made We will show that the model presented in this paper is flawed because it is not equivalent to a Turing machine. Moreover, the self-computation algorithm presented here has several major shortcomings which prevent it from resolving that uncertainty. ### 2.1 Theoretical Differences with Turing Machines The most fundamental flaw to the argument presented in the paper under consideration is that rather than using a theoretically established model like a Turing machine, it presents a model in which the “code” of the model, presumably corresponding to the set of states and the transition function, is indistinguishable from the “input” to the code, presumably corresponding to the initial content of the tape. Although there are numerous very obvious theoretical and practical ways of distinguishing “code” from “input”, they are not clearly marked in this model, causing the intrinsic uncertainty upon which the core argument is based. “Let us assume in the following that we have a Turing-complete machine architecture…”, reads paragraph 2, pg 5. The paper seems to rely on this model being Turing-complete, a term which is never clearly defined but which we assume to mean Turing equilavent. However, this is clearly not the case, since the elements of the 7-tuple defining a Turing machine are clearly identifiable, and the same can be said for the initial state of the tape. This method of arbitrarily introducing uncertainty to the computation of a Turing machine does not produce a Turing equivalent model, as it cannot be used to simulate a Turing machine, nor can it compute the same class of decisions that a Turing machine can. Because the output of this model is always uncertain, there are no problems in NP that can be reduced to it. It is similar to a model that flips a coin and upon seeing a heads, returns an arbitrary answer. ### 2.2 Lack of Rigor in Analysis The definition of the machine the proof revolves around is seemingly flawed. The machine which is supposed to be equivalent to a Turing machine in computational power detailed has a tape that contains both its program code and input, with both being randomly distributed throughout the tape. The machine reads the tape which is partitioned into two subsets, $S_{1}$ and $S_{2}$. We are lead to assume that these subsets form the direct sum of the original input, but this is never verified. As a result, one could infer that perhaps there is some intersection between $S_{1}$ and $S_{2}$. This is an example of the unrigorous definitions throughout the paper. These subsets are never fully defined - no methods for finding them are ever given. The machine evaluates the tape by computing the results as if $S_{1}$ were the code and $S_{2}$ the input and vice-versa, then calculates confidence values for both of those computations to help decide which configuration is correct. This has some problems, namely that the method for partitioning the input into two distinct blocks is non-existent. On page 6, the partition is described as being N bits long, but no further information is given. Given the fact that the input and code are randomly intermixed, one could go as far as to say that its impossible to partition the input with any precision - both the code and input string are represented in binary and are thus indistinguishable. This means that not only would the machine have to evaluate for all possible $S_{1}$-$S_{2}$ dichotomies, but also for all possible partitions of the input. This additional factor is left completely unaccounted for in the remainder of the paper. There is another error on page 6 in the uncertainty section. The claim that, ”we can accept the interpretation whose program code encompasses the larger number of bits as more likely,” is never justified. Such a statement is invalid - in many cases, for instance any program dealing with databases, the size of the input vastly exceeds the size of the program code. One mistake that appears quite often in Jaeger 2008 [1] is the constant changing of terms. In section 2, page 5, the machine used throughout the paper is described as a ”Turing-complete” machine based on the Turing machine. Just two pages later on page 7, the same machine is referred to as a Turing machine. This inconsistency is detrimental to the reader’s understanding as well as the validity of the paper itself. The paper also mentions an ”outside program” that performs the interpreting and execution aspects of the previously defined computing machine. While the existence of such a ”program” is provable, the author has omitted any kind of proof that such a program exists. ### 2.3 The Self Computation Algorithm The bulk of this article describes an algorithm to be used for calculation of certainty measurements to be reported alongside the actual findings of a Turing machine. The method of self-computation proposed is hugely complex, riddled with nonstandard notation and very confusing; the authors of this paper were unable to make much sense of it. Self-computation, as described in the paper, involves executing the uncertain Turing machine on a copy of a similar machine running arbitrary ”code”. The chance that the machine could execute a copy of itself and gain higher precision is unlikely and left completely unproven. The insinuation is that as you run the machine on itself, the bitlength of the ”code” portion gets longer and longer, increasing the ratio of code to data, which is directly proportional to certainty. While this method may appear useful for calculating uncertainty, it is unlikely that this will work because it assumes, among other things, that bit length is a useful metric for telling code and data apart, that this is a necessary determination in a Turing machine, that Turing equivalent models can report a certainty measurement, and that no other algorithms exist for computing this function. As we have shown these things to be untrue, the internal merit of the self computation algorithm is irrelevant. ### 2.4 There is No Proof of Nonpolynomiality for Certainty Calculation One problem with the argumunt presented in Jaeger 2008 [1] (Lemmas 1 and 3) is that it is nowhere proven that the method of self-computation presented in there is the only method of determining the certainty of a result. Even granting that there is a problem of determining certainty of answers produced by Turing machines, and given that this method of self-computation is a reasonable way of determining certainty, and given that a certainty threshold can be set such that computing certainty by this method cannot be done in polynomial time, all doubtful claims, nothing in Jaeger’s paper [1] attempts to prove that there is no other method of computing this certainty measurement. It could very well be that there is a polynomial time algorithm for computing this measurement that the author simply did not think of. Indeed, it is unclear from the paper under consideration why it should be possible to set a threshold ”dynamically” so that it requires NP time to reach that level of certainty. Even using the algorithm outlined there, it is not clearly explained why this would require exponential time rather than polynomial time. This trick of requiring that an exponential amount of computation go into producing the answer is only possible as a use of the certainty value which is produced by the modified Turing machine. As the output of a standard Turing machine is binary, this type of trick, which requires using the extra non-binary output, would not normally be possible. It is as if one constructed an algorithm to run in exponential time by requiring that it print an exponential number of characters. ## 3 Conclusion Overall, we have shown several things which should each individually render the argument described in Jaeger’s paper [1] impotent. We have shown that a model of computation that requires a measure of intrinsic uncertainty cannot be reduceable to a Turing machine nor can it reliably compute any NP-complete problem. We have also shown that the algorithm proposed for calculating uncertainty relies on faulty or unproven assumptions. Finally, we note that while one algorithm is presented here, which may very well have an exponential runtime, there is no attempt to prove that there cannot be a polynomial-time algorithm to compute the same. Any of these things strikes a fatal blow to the argument outlined by Jaeger [1]. As such, we do not find this compelling support for P not equal to NP. ## 4 Acknowledgements This work was done as a project in the Spring 2009 CSC 200H course at the University of Rochester. We thank the professor, Lane A. Hemaspaandra, and the TA, Adam Sadilek, for their comments and advice. Any opinions, errors, or omissions are the sole responsibility of the authors. ## References * [1] Stefan Jaeger. Solving the P/NP Problem under Intrinsic Uncertainty. 2008\. * [2] Michael Sipser. The History and Status of the P Versus NP Question. Proceedings of the Twenty-fourth Annual ACM Symposium on Theory of Computing, pages 603–618, May 1992. * [3] Michael Sipser. Introduction to the Teory of Computation, Second Edition. Course Technology, Camridge, Massachusetts, 2005.
arxiv-papers
2009-04-24T19:32:10
2024-09-04T02:49:02.155236
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Andrew Keenan Richardson, Cole Arthur Brown", "submitter": "Cole Brown", "url": "https://arxiv.org/abs/0904.3927" }
0904.3954
# On supremum of bounded quantum observable††thanks: This project is supported by Natural Science Found of China (10771191 and 10471124). Liu Weihua, Wu Junde Department of Mathematics, Zhejiang University, Hangzhou 310027, P. R. China E-mail: wjd@zju.edu.cn Abstract. In this paper, we present a new necessary and sufficient condition for which the supremum $A\vee B$ exists with respect to the logic order $\preceq$. Moreover, we give out a new and much simpler representation of $A\vee B$ with respect to $\preceq$, our results have nice physical meanings. Keywords: Quantum observable, logic order, supremum. PACS numbers: 02.10-v, 02.30.Tb, 03.65.Ta. ## 1 Introduction There some basic notations: $H$ is a complex Hilbert space, $S(H)$ is the set of all bounded linear self-adjoint operators on $H$, $S^{+}(H)$ is the set of all positive operators in $S(H)$, $P(H)$ is the set of all orthogonal projection operators on $H$, ${\cal B}(\mathbb{R})$ is the set of all Borel subsets of real number set $\mathbb{R}$. Each element in $P(H)$ is said to be a quantum event on $H$. Each element in $S(H)$ is said to be a bounded quantum observable on $H$. For $A\in S(H)$, let $R(A)$ be the range of $A$, $\overline{R(A)}$ be the closure of $R(A)$, $P_{A}$ be the orthogonal projection on $\overline{R(A)}$, $P^{A}$ be the spectral measure of $A$, null$(A)$ be the null space of $A$, and $N_{A}$ be the orthogonal projection on null$(A)$. Let $A,B\in S(H)$. If for each $x\in H$, $[Ax,x]\leq[Bx,x]$, then we say that $A\leq B$. Equivalently, there exists a $C\in S^{+}(H)$ such that $A+C=B$. $\leq$ is a partial order on $S(H)$. The physical meaning of $A\leq B$ is that the expectation of $A$ is not greater than the expectation of $B$ for each state of the system. So the order $\leq$ is said to be a numerical order of $S(H)$. But $(S(H),\leq)$ is not a lattice. Nevertheless, as a well known theorem due to Kadison, $(S(\mathbb{H}),\leq)$ is an anti-lattice, that is, for any two elements $A$ and $B$ in $S(\mathbb{H})$, the infimum $A\wedge B$ of $A$ and $B$ exists with respect to $\leq$ iff $A$ and $B$ are comparable with respect to $\leq$ ([1]). In 2006, Gudder introduced a new order $\preceq$ on $S(H)$: if there exists a $C\in S(H)$ such that $AC=0$ and $A+C=B$, then we say that $A\preceq B$ ([2]). Equivalently, $A\preceq B$ iff for each $\Delta\in{\cal B}(\mathbb{R})$ with $0\notin\Delta$, $P^{A}(\Delta)\leq P^{B}(\Delta)$ ([2]). The physical meaning of $A\preceq B$ is that for each $\Delta\in{\cal B}(\mathbb{R})$ with $0\notin\Delta$, the quantum event $P^{A}(\Delta)$ implies the quantum event $P^{B}(\Delta)$. Thus, the order $\preceq$ is said to be a logic order of $S(H)$ ([2]). In [2], it is proved that $(S(H),\preceq)$ is not a lattice since the supremum of arbitrary $A$ and $B$ may not exist in general. In [3], it is proved that the infimum $A\wedge B$ of $A$ and $B$ with respect to $\preceq$ always exists. In [4, 5], the representation theorems of the infimum $A\wedge B$ of $A$ and $B$ with respect to $\preceq$ were obtained. In more recent, Xu and Du and Fang in [6] discussed the existence of the supremum $A\vee B$ of $A$ and $B$ with respect to $\preceq$ by the technique of operator block. Moreover, they gave out a sufficient and necessary conditions for the existence of $A\vee B$ with respect to $\preceq$. Nevertheless, their conditions are difficult to be checked since the conditions depend on an operator $W$, but $W$ is not easy to get. Moreover, their proof is so much algebraic that we can not understand its physical meaning. In this paper, we present a new necessary and sufficient condition for which $A\vee B$ exists with respect to $\preceq$ in a totally different form. furthermore, we give out a new and much simpler representation of $A\vee B$ with respect to $\preceq$, our results have nice physical meanings. Lemma 1.1 [2]. Let $A,B\in S(H)$. If $A\preceq B$, then $A=BP_{A}$. Lemma 1.2 [2]. If $P,Q\in P(H)$, then $P\leq Q$ iff $P\preceq Q$, and $P$ and $Q$ have the same infimum $P\wedge Q$ and the supremum $P\vee Q$ with respect to the orders $\leq$ and $\preceq$, we denote them by $P\wedge Q$ and $P\vee Q$, respectively. Lemma 1.3 [7]. Let $A,B\in S(H)$. Then $P^{A}(\\{0\\})=N(A)$, $P_{A}=P^{A}(R\backslash\\{0\\})$, $P_{A}+N(A)=I$, $P_{A}\vee P_{B}=I-N(A)\wedge N(B)$. ## 2 Some elementary lammas Let $A,B\in S(H)$ and they have the following forms: $A=\int\limits_{-M}^{M}\lambda dA_{\lambda}$ and $B=\int\limits_{-M}^{M}\lambda dB_{\lambda},$ where $\\{A_{\lambda}\\}_{\lambda\in\mathbb{R}}$ and $\\{B_{\lambda}\\}_{\lambda\in\mathbb{R}}$ be the identity resolutions of $A$ and $B$ ([7]), respectively, and $M=\max(\|A\|,\|B\|)$. If $A$ has an upper bound $F$ in $S(H)$ with respect to $\preceq$, then it follows from Lemma 1.1 that $A=FP_{A}$. Note that $A\in S(H)$, so $FP_{A}=P_{A}F$ and thus $AF=FA$. Let $F$ have the following form: $F=\int\limits_{-G}^{G}\lambda dF_{\lambda},$ where $\\{F_{\lambda}\\}_{\lambda\in\mathbb{R}}$ is the identity resolution of $F$ and $G=\max(\|F\|,M)$. Then we have $A=FP_{A}=(\int\limits_{-G}^{G}\lambda dF_{\lambda})P_{A}=\int\limits_{-G}^{G}\lambda d(F_{\lambda}P_{A}).$ Lemma 2.1. Let $A\in S(H)$ and $F\in S(H)$ be an upper bound of $A$ with respect to $\preceq$. Then for each $\Delta\in{\cal B}(\mathbb{R})$, we have $P^{A}(\Delta)=\left\\{\begin{array}[]{ccc}P^{F}(\Delta)P_{A},&&0\not\in\Delta\\\ N(A),&&\Delta=\\{0\\}\\\ P^{F}(\Delta\backslash\\{0\\})P_{A}+N(A).&&0\in\Delta\\\ \end{array}\right.$ Proof. We just need to check $P^{A}(\Delta)=P^{F}(\Delta)P_{A}$ when $0\not\in\Delta$, the rest is trivial. Note that if we restrict on the subspace $P_{A}(H)=\overline{R(A)}$, since $AF=FA$, then $\\{F_{\lambda}P_{A}\\}_{\lambda\in\mathbb{R}}$ is the identity resolution of $F|_{P_{A}(H)}$ ([7]). Let $f$ be the characteristic function of $\Delta$. Then the following equality proves the conclusion: $P^{A}(\Delta)=f(A)=f(FP_{A})=\int\limits_{-G}^{G}f(\lambda)d(F_{\lambda}P_{A})=\int\limits_{\lambda\in\Delta}d(F_{\lambda}P_{A})=P^{F}(\Delta)P_{A}.$ It follows from Lemma 2.1 immediately: Lemma 2.2. Let $A,B\in S(H)$ and $F\in S(H)$ be an upper bound of $A$ and $B$ with respect to $\preceq$. Then for any two Borel subsets $\Delta_{1}$ and $\Delta_{2}$ of $\mathbb{R}$, if $\Delta_{1}\cap\Delta_{2}=\emptyset$, $0\notin\Delta_{1}$, $0\notin\Delta_{2}$, we have $P^{A}(\Delta_{1})P^{B}({\Delta_{2}})=P^{F}(\Delta_{1})P_{A}P^{F}(\Delta_{2})P_{B}=P_{A}P^{F}(\Delta_{1})P^{F}(\Delta_{2})P_{B}=\theta.$ Lemma 2.3. Let $A,B\in S(H)$ and have the following property: For each pair $\Delta_{1},\Delta_{2}\in{\cal B}(\mathbb{R})$, whenever $\Delta_{1}\cap\Delta_{2}=\emptyset$ and $0\not\in\Delta_{1}$, $0\not\in\Delta_{2}$, we have $P^{A}(\Delta_{1})P^{B}({\Delta_{2}})=\theta$, then the following mapping $E:{\cal B}(\mathbb{R})\rightarrow P(H)$ defines a spectral measure: $E(\Delta)=\left\\{\begin{array}[]{ccc}P^{A}(\Delta)\vee P^{B}(\Delta),&&0\not\in\Delta\\\ N(A)\wedge N(B)=I-P_{A}\vee P_{B},&&\Delta=\\{0\\}\\\ P^{A}(\Delta\backslash\\{0\\})\vee P^{B}(\Delta\backslash\\{0\\})+N(A)\wedge N(B).&&0\in\Delta\\\ \end{array}\right.$ Proof. First, we show that for each $\Delta\in{\cal B}(\mathbb{R})$, $E(\Delta)\in P(H)$. It is sufficient to check the case of $0\in\Delta$. Since $P^{A}(\Delta\backslash\\{0\\})\vee P^{B}(\Delta\backslash\\{0\\})\leq P^{A}(R\backslash\\{0\\})\vee P^{B}(R\backslash\\{0\\})=P_{A}\vee P_{B}$, so it follows from Lemma 1.3 that $P^{A}(\Delta\backslash\\{0\\})\vee P^{B}(\Delta\backslash\\{0\\})+N(A)\wedge N(B)\in P(H)$ and the conclusion is hold. Second, we have $E(\emptyset)=P^{A}(\emptyset)\vee P^{B}(\emptyset)=\theta\vee\theta=\theta,$ $E(R)=P^{A}(R\backslash\\{0\\})\vee P^{B}(R\backslash\\{0\\})+N(A)\wedge N(B)$ $=P_{A}\vee P_{B}+N(A)\wedge N(B)=I.$ Third, if $\Delta_{1}\cap\Delta_{2}=\emptyset$, there are two cases: (i). $0$ doesn’t belong to any one of $\Delta_{1}$ and $\Delta_{2}$. It follows from the definition of $E$ that $E(\Delta_{1})E(\Delta_{2})=(P^{A}(\Delta_{1})\vee P^{B}(\Delta_{1}))(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2})).$ Note that $P^{B}(\Delta_{1})P^{A}(\Delta_{2})=\theta$ by the conditions of the lemma and $P^{B}(\Delta_{1})P^{B}(\Delta_{2})=\theta$, we have $P^{B}(\Delta_{1})(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))=\theta$, similarly, we have also $P^{A}(\Delta_{1})(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))=\theta$, thus, $E(\Delta_{1})E(\Delta_{2})=\theta.$ Furthermore, we have $\begin{array}[]{rcl}E(\Delta_{1}\cup\Delta_{2})&=&P^{A}(\Delta_{1}\cup\Delta_{2})\vee P^{B}(\Delta_{1}\cup\Delta_{2})\\\ &=&P^{A}(\Delta_{1})\vee P^{A}(\Delta_{2})\vee P^{B}(\Delta_{1})\vee P^{B}(\Delta_{2})\\\ &=&(P^{A}(\Delta_{1})\vee P^{B}(\Delta_{1}))\vee(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))\\\ &=&(P^{A}(\Delta_{1})\vee P^{B}(\Delta_{1}))+(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))\\\ &=&E(\Delta_{1})+E(\Delta_{2}).\end{array}$ That is, in this case, we proved that $E(\Delta_{1})E(\Delta_{2})=\theta,$ $E(\Delta_{1}\cup\Delta_{2})=E(\Delta_{1})+E(\Delta_{2}).$ (ii). $0$ belongs to one of $\Delta_{1}$ and $\Delta_{2}$. Without of losing generality, we suppose that $0\in\Delta_{1}$, since $\Delta_{1}\cap\Delta_{2}=\emptyset$, so $0\notin\Delta_{2}$, thus we have $\begin{array}[]{rcl}E(\Delta_{1})E(\Delta_{2})&=&(P^{A}(\Delta_{1}\backslash\\{0\\})\vee P^{B}(\Delta_{1}\backslash\\{0\\})+N(B)\wedge N(A))(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))\\\ &=&(P^{A}(\Delta_{1}\backslash\\{0\\})\vee P^{B}(\Delta_{1}\backslash\\{0\\}))(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))=\theta,\\\ \end{array}$ $\begin{array}[]{rcl}E(\Delta_{1}\cup\Delta_{2})&=&P^{A}(\Delta_{1}\backslash\\{0\\}\cup\Delta_{2})\vee P^{B}(\Delta_{1}\backslash\\{0\\}\cup\Delta_{2})+(N(B)\wedge N(A))\\\ &=&(P^{A}(\Delta_{1}\backslash\\{0\\})\vee P^{B}(\Delta_{1}\backslash\\{0\\})+(N(B)\wedge N(A)))+(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))\\\ &=&(P^{A}(\Delta_{1}\backslash\\{0\\})\vee P^{B}(\Delta_{1}\backslash\\{0\\})+(N(A)\wedge N(B)))+(P^{A}(\Delta_{2})\vee P^{B}(\Delta_{2}))\\\ &=&E(\Delta_{1})+E(\Delta_{2}).\\\ \end{array}$ Thus, it follows from (i) and (ii) that whenever $\Delta_{1}\cap\Delta_{2}=\emptyset$, we have $E(\Delta_{1})E(\Delta_{2})=\theta,$ $E(\Delta_{1}\cup\Delta_{2})=E(\Delta_{1})+E(\Delta_{2}).$ Final, if $\\{\Delta_{n}\\}_{n=1}^{\infty}$ is a sequence of pairwise disjoint Borel sets in ${\cal B}(\mathbb{R})$, then it is easy to prove that $E(\bigcup\limits_{n=1}^{\infty}\Delta_{n})=\sum\limits_{n=1}^{\infty}E(\Delta_{n}).$ Thus, the lemma is proved. ## 3 Main results and proofs Theorem 3.1. Let $A,B\in S(H)$ and have the following property: For each pair $\Delta_{1},\Delta_{2}\in{\cal B}(\mathbb{R})$, whenever $\Delta_{1}\cap\Delta_{2}=\emptyset$ and $0\not\in\Delta_{1}$, $0\not\in\Delta_{2}$, we have $P^{A}(\Delta_{1})P^{B}({\Delta_{2}})=\theta$. Then the supremum $A\vee B$ of $A$ and $B$ exists with respect to the logic order $\preceq$. Proof. By Lemma 2.3, $E(\cdot)$ is a spectral measure and so it can generate a bounded quantum observable $K$ and $K$ can be represented by $K=\int\limits_{-M}^{M}\lambda dE_{\lambda}$, where $\\{E_{\lambda}\\}=E(-\infty,\lambda]$, $\lambda\in\mathbb{R}$ and $M=\max(\|A\|,\|B\|)$. Moreover, for each $\Delta\in{\cal B}(\mathbb{R})$, $P^{K}(\Delta)=E(\Delta)$ ([7]). We confirm that $K$ is the supremum $A\vee B$ of $A$ and $B$ with respect to $\preceq$. In fact, for each $\Delta\in{\cal B}(\mathbb{R})$ with $0\notin\Delta$, by the definition of $E$ we knew that $P^{K}(\Delta)=E(\Delta)=P^{A}(\Delta)\vee P^{B}(\Delta)\geq P^{A}(\Delta)$, $P^{K}(\Delta)=E(\Delta)=P^{A}(\Delta)\vee P^{B}(\Delta)\geq P^{B}(\Delta)$. So it following from the equivalent properties of $\preceq$ that $A\preceq K$, $B\preceq K$ ([2]). If $K^{\prime}$ is another upper bound of $A$ and $B$ with respect to $\preceq$, then for each $\Delta\in{\cal B}(\mathbb{R})$ with $0\notin\Delta$, we have $P^{A}(\Delta)\leq P^{K^{\prime}}(\Delta)$, $P^{B}(\Delta)\leq P^{K^{\prime}}(\Delta)$ ([2]), so $P^{A}(\Delta)\vee P^{B}(\Delta)=E(\Delta)=P^{K}(\Delta)\leq P^{K^{\prime}}(\Delta)$, thus we have $K\preceq K^{\prime}$ and $K$ is the supremum of $A$ and $B$ with respect to $\preceq$ is proved. It follows from Lemma 2.2 and theorem 3.1 that we have the following theorem immediately: Theorem 3.2. Let $A,B\in S(H)$. Then the supremum $A\vee B$ of $A$ and $B$ exists with respect to the logic order $\preceq$ iff for each pair $\Delta_{1},\Delta_{2}\in{\cal B}(\mathbb{R})$, whenever $\Delta_{1}\cap\Delta_{2}=\emptyset$ and $0\not\in\Delta_{1}$, $0\not\in\Delta_{2}$, we have $P^{A}(\Delta_{1})P^{B}({\Delta_{2}})=\theta$. Moreover, in this case, we have the following nice representation: $A\vee B=\int\limits_{-M}^{M}\lambda dE_{\lambda},$ where $\\{E_{\lambda}\\}=E(-\infty,\lambda]$, $\lambda\in\mathbb{R}$ and $M=\max(\|A\|,\|B\|)$. Remark 3.3. Let $A,B\in S(H)$. Note that for each $\Delta\in{\cal B}(\mathbb{R})$, $P^{A}(\Delta)$ is interpreted as the quantum event that the quantum observable $A$ has a value in $\Delta$ ([2]), and the conditions: $\Delta_{1}\cap\Delta_{2}=\emptyset$, $0\not\in\Delta_{1}$, $0\not\in\Delta_{2}$ must have $P^{A}(\Delta_{1})P^{B}({\Delta_{2}})=\theta$ told us that the quantum events $P^{A}(\Delta_{1})$ and $P^{B}(\Delta_{2})$ can not happened at the same time, so, the physical meanings of the supremum $A\vee B$ exists with respect to $\preceq$ iff for each pair $\Delta_{1},\Delta_{2}\in{\cal B}(\mathbb{R})$, whenever $\Delta_{1}\cap\Delta_{2}=\emptyset$ and $0\not\in\Delta_{1}$, $0\not\in\Delta_{2}$, the quantum observable $A$ takes value in $\Delta_{1}$ and the quantum observable $B$ takes value in $\Delta_{2}$ can not happen at the same time. References [1]. Kadison, R. Order properties of bounded self-adjoint operators. _Proc. Amer. Math. Soc_. 34: 505-510, (1951) [2]. Gudder S. An Order for quantum observables. _Math Slovaca_. 56: 573-589, (2006) [3]. Pulmannova S, Vincekova E. Remarks on the order for quantum observables. _Math Slovaca_. 57: 589-600, (2007) [4]. Liu Weihua, Wu Junde. A representation theorem of infimum of bounded quantum observables. _J Math Physi_. 49: 073521-073525, (2008) [5]. Du Hongke, Dou Yanni. A spectral representation of infimum of self- adjoint operators in the logic order. Acta Math. Sinica. To appear [6]. Xu Xiaoming, Du Hongke, Fang Xiaochun. An explicit expression of supremum of bounded quantum observables. _J Math Physi_. 50: 033502-033509, (2009) [7]. Kadison. R. V., Ringrose J. R. Fundamentals of the Theory of Operator Algebra. Springer-Verlag, New York, (1983)
arxiv-papers
2009-04-25T00:54:38
2024-09-04T02:49:02.161803
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Liu Weihua, Wu Junde", "submitter": "Junde Wu", "url": "https://arxiv.org/abs/0904.3954" }
0904.4094
# On the Upper Bounds of MDS Codes Jiansheng Yang111Supported by Shanghai Leading Academic Discipline Project Project Number S30104. Email: yjsyjs@staff.shu.edu.cn , Yunying Zhang Department of Mathematics, Shanghai University Shanghai 200444, China ###### Abstract Let $M_{q}(k)$ be the maximum length of MDS codes with parameters $q,k$. In this paper, the properties of $M_{q}(k)$ are studied, and some new upper bounds of $M_{q}(k)$ are obtained. Especially we obtain that $M_{q}(q-1)\leq q+2(q\equiv 4(mod~{}6)),~{}M_{q}(q-2)\leq q+1(q\equiv 4(mod~{}6)),~{}M_{q}(k)\leq q+k-3~{}(q=36(5s+1),~{}s\in N$ and $k=6,7).$ Keywords: MDS codes; Hamming distance; codes equivalence; weight distribution ## 1 Introduction Let $C$ be an $(n,q^{k},d)$ code, if $d=n-k+1$, then $C$ is called a maximum distance separable (MDS) code. MDS codes are at the heart of combinatorics and finite geometries. In their book [9] MacWilliams and Sloane describe MDS codes as one of the most fascinating chapters in all of coding theory. These codes can be linear or non-linear. Very little is known about non-linear $(n,q^{k},n-k+1)$ MDS codes. R.H.Bruck , H.J.Ryser, R.Silverman and A.A.Bruen had proved some results on MDS codes [4,5,10] early. Recently, T.L.Alderson studies MDS codes extension. And he has obtained some important results[1,2,3]. In this paper, we assume that $A$=$\\{0,1,2,\cdots,q-1\\}$ is a additive group(not necessary cyclic group). Denote the maximum number $n$ of an $(n,q^{k},n-k+1)$ MDS code over $A$ by $M_{q}(k)$. If $A$ is a field, then denote the maximum number $n$ of a linear $(n,q^{k},n-k+1)$ MDS code over $A$ by $m_{q}(k)$. The Main Conjecture of $m_{q}(k)$ is the following. $m_{q}(k)=\left\\{{\begin{array}[]{*{20}c}{q+2}&{for\;k=3\;and\;k=q-1\;both\;q\;even,}\\\ {q+1}&{in\;all\;other\;cases.}\\\ \end{array}}\right.$ The Main Conjecture has been proved in some cases, [7] gave us a good summarize. For $M_{q}(k)$, it is well known that $M_{q}(k)\leq q+k-1$. In [5], A.A.Bruen and R.Silverman proved that: Theorem 1.1 [5] (1) If $C$ is a $(q+k-1;k)$-MDS code with $k\geq 3$ and $q>2$, then $4$ divides $q$. (2) If $C$ is a $(q+k-1;k)$-MDS code with $k>3$ and $q>2$, then $36$ divides $q$. In [2], T.L.Alderson proved that: Theorem 1.2 [2] (1) If 36 does not divide $q$ and $k\geq 4$, then a $q-ary~{}(n,k)$-MDS code satisfies $n\leq q+k-3$. (2) If $q>2$ and $q\equiv 2~{}mod~{}4$ then no q-ary $(q+1;3)$-MDS codes exist. In [11], Wang proved that Theorem 1.3 [11] $M_{q}(q-1)\leq q+1$ for $q$ is odd. In this paper, we use the generalized weight enumerator(see below) and combinatorial methods to study $M_{q}(k)$. Some new upper bounds of $M_{q}(k)$ are obtained. Especially we obtain that $M_{q}(q-1)\leq q+2(q\equiv 4(mod~{}6)),~{}M_{q}(q-2)\leq q+1(q\equiv 4(mod~{}6)),~{}M_{q}(k)\leq q+k-3~{}(q=36(5s+1),~{}s\in N$ and $k=6,7).$ For the convenient, we introduce some notations and results as following. Let $C$ and $D$ be two codes of length $n$ over $A$. If there exist $n$ permutations $\pi_{1},\cdots,\pi_{n}$ of the $q$ elements and a permutation $\sigma$ of the $n$ coordinate positions such that $(u_{1},\cdots,u_{n})\in C$ iff $(\pi_{1}(u_{\sigma{(1)}}),\cdots,\pi_{n}(u_{\sigma{(n)}}))\in D$, then we call $C$ is equivalent to $D$. If $C$ is equivalent to $D$, then $C$ and $D$ have the same Hamming distance. It is clear, if $c_{0}\in A^{n}$, $D=c_{0}+C=\\{c_{0}+\alpha|\alpha\in C\\}$ is equivalent to $C$. Then we may always assume that code $C$ contains the zero element $\textbf{0}=(0,0,\cdots,0,0)$. The generalized weight enumerator which is introduced by M.El-Khamy and R.J.McEliece[6] is called the partition weight enumerator(PWE) . Suppose the coordinate set $N=\\{1,2,\cdots,n\\}$ is partitioned into $p$ disjoint subsets $N_{1},\cdots,N_{p}$, with $|N_{i}|=n_{i}$ , for $i=1,\cdots,p$. Denoting this partition by $\mathcal{T}$, the $\mathcal{T}$-weight profile of an $v\in A^{n}$ is defined as $\mathcal{W}_{\mathcal{T}}(v)=(\omega_{1},\cdots,\omega_{p})$, where $\omega_{i}$ is the Hamming weight of $v$ restricted to $N_{i}$. Given a code $C$ of length $n$, and an $(n_{1},\cdots,n_{p})$ partition $\mathcal{T}$ of the $n$ coordinates of $C$, the $\mathcal{T}$-weight enumerator of $C$ is defined as following. $A^{\mathcal{T}}(\omega_{1},\cdots,\omega_{p})=|\\{c\in C:\mathcal{W}_{\mathcal{T}}(c)=(\omega_{1},\cdots,\omega_{p})\\}|.$ Theorem 1.4 [6] For an $(n,q^{k},d)$ MDS code $C$ which contains the zero element, the $p$-partition weight enumerator is given by $A^{\mathcal{T}}(\omega_{1},\cdots,\omega_{p})=E(\omega)\frac{{n_{1}\choose\omega_{1}}{n_{2}\choose\omega_{2}}\cdots{n_{p}\choose\omega_{p}}}{{n\choose\omega}}$ where $\omega=\sum_{i=1}^{n}\omega_{i}$, $E(\omega)=|\\{c\in C:\mathcal{W}(c)=\omega\\}|$ and $\mathcal{W}(c)$ is the Hamming weight of $C$. Remark: In the proof, [6] assume that $A$ is a field, however, the proof is true for any $A$(It only need the MDS codes have the zero element). Therefore, the formula holds for non-linear MDS codes which contain the zero element. For an $(n,q^{k},d)$ MDS code over $A$, the weight distribution is known as $E(\omega)=(q-1){n\choose\omega}\sum_{j=0}^{\omega-d}(-1)^{j}{\omega-1\choose j}q^{\omega-d-j}$ where $\omega\geq d$ [9], and we can know that the formula holds for MDS codes(which contain the zero element) not only for linear MDS codes[8]. For any $\alpha=(a_{1},\cdots,a_{n})\in A^{n}$, define the support of $\alpha$ by $Supp\alpha=\\{i|a_{i}\neq 0,~{}1\leq i\leq n\\}$, and $\overline{Supp}\alpha=\\{j|a_{j}=0,~{}1\leq j\leq n\\}$. ## 2 New Upper Bounds for MDS Codes Theorem 2.1 If $q\equiv 4(mod~{}6)$, then $M_{q}(q-1)\leq q+2$. Proof: Suppose $C$ is an $(q+3,q^{q-1},5)(q~{}is~{}even)$ MDS code which contains the zero element. The partition $\mathcal{T}$ is given as following. $\mathcal{T}=\mathcal{T}_{1}\cup\mathcal{T}_{2},~{}\mathcal{T}_{1}=\\{1,2,3\\},~{}\mathcal{T}_{2}=\\{4,5,\cdots,q+3\\}.$ $n_{1}=|\mathcal{T}_{1}|=3,~{}n_{2}=|\mathcal{T}_{2}|=q,~{}\omega_{1}=2,~{}\omega_{2}=3.$ From Theorem 1.4, we have $A^{\mathcal{T}}(2,3)=E(5)\frac{{3\choose 2}{q\choose 3}}{{q+3\choose 5}}=\frac{3q(q-1)^{2}(q-2)}{6}.$ where $E(5)=(q-1){q+3\choose 5}$. For $(x,y)$, there are altogether $(q-1)^{2}$ pairs $(x,y)$ with $x,y\in S$ where $S=\\{1,2,\cdots,q-1\\}$. Thus there exists $(a,b)\in S$ such that $|C_{a,b,0}|\geq\frac{3q(q-1)^{2}(q-2)}{6\times 3(q-1)^{2}}=\frac{q(q-2)}{6}.$ where $C_{a,b,0}=\\{(a_{1},a_{2},a_{3},\cdots,a_{q+3})\in C|a_{1}=a,a_{2}=b,a_{3}=0,a_{k}\in A,k=4,5,\cdots,q+3\\}.$ Since $C$ is an MDS code, w.l.g. we may assume $a=1,b=1$. Then $C_{1,1,0}=\\{(1,1,0,a_{4},\cdots,a_{q+3})\in C|a_{k}\in A,k=4,5,\cdots,q+3\\}.$ Let $C_{i}=C_{1,1,0,i}=\\{(1,1,0,a_{4},\cdots,a_{q+3})\in C|a_{i}\neq 0\\}~{}(i\in\\{4,5,\cdots,q+3\\}).$ We will prove that $|C_{1,1,0}|=\frac{q(q-2)}{6}$ when $q$ is even. If this is not true, we have $|C_{1,1,0}|>\frac{q(q-2)}{6}$, then there exists $i$, w.l.g. assume $i$=4, such that $|C_{4}|\geq\frac{|C_{1,1,0}|{3\choose 1}}{{q\choose 1}}>\frac{3q(q-2)}{6q}=\frac{q-2}{2}.$ Assume $\alpha=(1,1,0,a_{4},\cdots,a_{q+3}),~{}\beta=(1,1,0,b_{4},\cdots,b_{q+3})\in C_{4}$, we have $a_{4}\neq 0,~{}b_{4}\neq 0$. If $i\in Supp\alpha\cap Supp\beta~{}(5\leq i\leq q+3)$, then we have $d(\alpha,\beta)\leq 4$, a contradiction. Thus we have $Supp\alpha\cap Supp\beta=\\{1,2,4\\}$. Let $\alpha_{1},\alpha_{2},\cdots,\alpha_{t}\in C_{4}$. Since $Supp\alpha_{i}\cap Supp\alpha_{j}=\\{1,2,4\\}$ for all $i\neq j$ and $\omega(\alpha)=5$, we have $\cup_{i=1}^{t}|Supp\alpha_{i}|=2t+3$. This implies $2t+3\leq q+2$, i.e. $t\leq\frac{q-1}{2}$. Since $q$ is even, we have $t\leq\frac{q-2}{2}$. Hence$|C_{4}|\leq\frac{q-2}{2}~{}(q~{}is~{}even)$, a contradiction. By this, we have $|C_{1,1,0}|=\frac{q(q-2)}{6}~{}(q~{}is~{}even).$ Thus $\frac{q(q-2)}{6}$ must be an integer, however, if $q\equiv 4(mod~{}6)$, $\frac{q(q-2)}{6}$ is not an integer. Therefore, if $q\equiv 4(mod~{}6)$, then $M_{q}(q-1)\leq q+2$. $\Box$ Theorem 2.2 If $q$ is even and $(l+2)!$ does not divide $(q+l-1)\cdots(q+1)q(q-2)$ where $l\geq 1$, then $M_{q}(q-2)\leq q+l$. Proof: Suppose $C$ is an $(q+l+1,q^{q-2},l+4)(q~{}is~{}even)$ MDS code which contains the zero element. The partition $\mathcal{T}$ is given as following. $\mathcal{T}=\mathcal{T}_{1}\cup\mathcal{T}_{2},~{}\mathcal{T}_{1}=\\{1,2\\},~{}\mathcal{T}_{2}=\\{3,4,\cdots,q+l+1\\}.$ $n_{1}=|\mathcal{T}_{1}|=2,~{}n_{2}=|\mathcal{T}_{2}|=q+l-1,~{}\omega_{1}=2,~{}\omega_{2}=l+2.$ From Theorem 1.4, we have $A^{\mathcal{T}}(2,l+2)=E(l+4)\frac{{2\choose 2}{q+l-1\choose l+2}}{{q+l+1\choose l+4}}={q+l-1\choose l+2}(q-1).$ where $E(l+4)=(q-1){q+l+1\choose l+4}$. For $(x,y)$, there are altogether $(q-1)^{2}$ pairs $(x,y)$ with $x,y\in S$ where $S=\\{1,2,\cdots,q-1\\}$. Thus there exists $(a,b)\in S$ such that $|C_{a,b}|\geq\frac{{q+l-1\choose l+2}(q-1)}{(q-1)^{2}}=\frac{{q+l-1\choose l+2}}{q-1}.$ where $C_{a,b}=\\{(a_{1},a_{2},a_{3},\cdots,a_{q+l+1})|a_{1}=a,a_{2}=b,a_{k}\in A,k=3,4,\cdots,q+l+1\\}.$ Since $C$ is an MDS code, we may assume $a=1,b=1$. Then $C_{1,1}=\\{(1,1,a_{3},\cdots,a_{q+l+1})|a_{k}\in A,k=3,4,\cdots,q+l+1\\}.$ Let $B_{\underbrace{i,j,\cdots,k}_{l}}=C_{1,1,\underbrace{i,j,\cdots,k}_{l}}=\\{(1,1,a_{3},\cdots,a_{q+l+1})|a_{k}\in A,k=3,4,\cdots,q+l+1~{}and~{}a_{i},a_{j},\cdots,a_{k}\neq 0\\},$ where $i,j,\cdots,k$ are the $l$ distinct numbers of $\\{3,4,\cdots,q+l+1\\}.$ We claim that $|C_{1,1}|=\frac{{q+l-1\choose l+2}}{q-1}$ when $q$ is even. If this is not true, since$|C_{1,1}|\geq\frac{{q+l-1\choose l+2}}{q-1}$, we have$|C_{1,1}|>\frac{{q+l-1\choose l+2}}{q-1}$ and there exist $i,j,\cdots,k$, w.l.g. assume the $l$ numbers are $3,4,\cdots,l+2$, such that $|B_{3,4,\cdots,l+2}|\geq\frac{|C_{1,1}|{l+2\choose l}}{{q+l-1\choose l}}>\frac{q-2}{2}.$ Assume $\alpha=(1,1,a_{3},\cdots,a_{q+l+1}),~{}\beta=(1,1,b_{3},\cdots,b_{q+l+1})\in B_{3,4,\cdots,l+2}$, we have $a_{r}\neq 0,~{}b_{s}\neq 0,3\leq r,s\leq l+2$. If $i\in Supp\alpha\cap Supp\beta~{}(l+3\leq i\leq q+l+1)$, since $|Supp\alpha|=|Supp\beta|=l+4$, then we have $d(\alpha,\beta)\leq l+3$, a contradiction. Thus we have $Supp\alpha\cap Supp\beta=\\{1,2,\cdots,l+2\\}$. Let $\alpha_{1},\alpha_{2},\cdots,\alpha_{t}\in B_{3,4,\cdots,l+2}$. Since $Supp\alpha_{i}\cap Supp\alpha_{j}=\\{1,2,\cdots,l+2\\}$ for all $i\neq j$ and $\omega(\alpha)=l+4$, we have $\cup_{i=1}^{t}|Supp\alpha_{i}|=2t+l+2$. This implies $2t+l+2\leq q+l+1$, i.e. $t\leq\frac{q-1}{2}$. Since $q$ is even, we have $t\leq\frac{q-2}{2}$. Hence$|B_{3,4,\cdots,l+2}|\leq\frac{q-2}{2}~{}(q~{}is~{}even)$, a contradiction. By this, we have $|C_{1,1}|=\frac{{q+l-1\choose l+2}}{q-1}=\frac{(q+l-1)\cdots(q+1)q(q-2)}{(l+2)!}~{}(q~{}is~{}even).$ Thus $\frac{(q+l-1)\cdots(q+1)q(q-2)}{(l+2)!}$ must be an integer. Therefore, if $q$ is even and $(l+2)!$ does not divide $(q+l-1)\cdots(q+1)q(q-2)$ where $l\geq 1$, then $M_{q}(q-2)\leq q+l$. $\Box$ By calculating, we can get the following. Corollary 2.2.1 $M_{q}(q-2)\leq q+1~{}(q\equiv 4(mod~{}6)).$ Corollary 2.2.2 $M_{q}(q-2)\leq q+3~{}(q\equiv 6~{}or~{}26(mod~{}30)).$ Corollary 2.2.3 $M_{q}(q-2)\leq q+5~{}(q\equiv 8~{}or~{}36(mod~{}42)).$ Theorem 2.3 If $q$ is even and $(k-1)!$ does not divide $(q+k-4)\cdots(q+1)q(q-2)$ where $k\geq 4$, then $M_{q}(k)\leq q+k-3$. Proof: Suppose $C$ is an $(q+k-2,q^{k},q-1)(q~{}is~{}even)$ MDS code which contains the zero element. The partition $\mathcal{T}$ is given as following. $\mathcal{T}=\mathcal{T}_{1}\cup\mathcal{T}_{2},~{}\mathcal{T}_{1}=\\{1,2\\},~{}\mathcal{T}_{2}=\\{3,4,\cdots,q+k-2\\}.$ $n_{1}=|\mathcal{T}_{1}|=2,~{}n_{2}=|\mathcal{T}_{2}|=q+k-4,~{}\omega_{1}=2,~{}\omega_{2}=q-3.$ From Theorem 1.4, we have $A^{\mathcal{T}}(2,q-3)=E(q-1)\frac{{2\choose 2}{q+k-4\choose q-3}}{{q+k-2\choose q-1}}={q+k-4\choose q-3}(q-1).$ where $E(q-1)=(q-1){q+k-2\choose q-1}$. For $(x,y)$, there are altogether $(q-1)^{2}$ pairs $(x,y)$ with $x,y\in S$ where $S=\\{1,2,\cdots,q-1\\}$. Thus there exists $(a,b)\in S$ such that $|C_{a,b}|\geq\frac{{q+k-4\choose q-3}(q-1)}{(q-1)^{2}}=\frac{{q+k-4\choose q-3}}{q-1}.$ (1) where $C_{a,b}=\\{(a_{1},a_{2},a_{3},\cdots,a_{q+k-2})|a_{1}=a,a_{2}=b,a_{m}\in A,m=3,4,\cdots,q+k-2\\}.$ Since $C$ is an MDS code, we may assume $a=1,b=1$. Then $C_{1,1}=\\{(1,1,a_{3},\cdots,a_{q+k-2})|a_{m}\in A,m=3,4,\cdots,q+k-2\\}.$ Let $B_{\underbrace{i,j,\cdots,r}_{k-3}}=C_{1,1,\underbrace{i,j,\cdots,r}_{k-3}}=\\{(1,1,a_{3},\cdots,a_{q+k-2})|a_{m}\in A,~{}m=3,4,\cdots,q+k-2~{}and~{}a_{i}=a_{j}=\cdots=a_{r}=0\\},$ where $i,j,\cdots,r$ are the $k-3$ distinct numbers of $\\{3,4,\cdots,q+k-2\\}.$ We will prove that $|C_{1,1}|=\frac{{q+k-4\choose q-3}}{q-1}$ when $q$ is even. If this is not true, we have $|C_{1,1}|>\frac{{q+k-4\choose q-3}}{q-1}$ and there exist $i,j,\cdots,r$, w.l.g. assume the $k-3$ numbers are $3,4,\cdots,k-1$, such that $|B_{3,4,\cdots,k-1}|\geq\frac{|C_{1,1}|{k-1\choose k-3}}{{q+k-4\choose k-3}}>\frac{q-2}{2}.$ Assume $\alpha=(1,1,a_{3},\cdots,a_{q+k-2}),~{}\beta=(1,1,b_{3},\cdots,b_{q+k-2})\in B_{3,4,\cdots,k-1}$, we have $a_{r}=0,~{}b_{s}=0,3\leq r,s\leq k-1$. If $i\in\overline{Supp}\alpha\cap\overline{Supp}\beta~{}(k\leq i\leq q+k-2)$, then we have $d(\alpha,\beta)\leq q-2$, a contradiction. Thus we have $\overline{Supp}\alpha\cap\overline{Supp}\beta=\\{3,4,\cdots,k-1\\}$. Let $\alpha_{1},\alpha_{2},\cdots,\alpha_{t}\in B_{3,4,\cdots,k-1}$. Since $\overline{Supp}\alpha_{i}\cap\overline{Supp}\alpha_{j}=\\{3,4,\cdots,k-1\\}$ for all $i\neq j$ and $\omega(\alpha)=q-1$, we have $\cup_{i=1}^{t}|Supp\alpha_{i}|=2t+k-3$. This implies $2t+k-3\leq q+k-4$, i.e. $t\leq\frac{q-1}{2}$. Since $q$ is even, we have $t\leq\frac{q-2}{2}$. Hence$|B_{3,4,\cdots,k-1}|\leq\frac{q-2}{2}~{}(q~{}is~{}even)$, a contradiction. By this,we have $|C_{1,1}|=\frac{{q+k-4\choose q-3}}{q-1}=\frac{(q+k-4)\cdots(q+1)q(q-2)}{(k-1)!}~{}(q~{}is~{}even)$ Thus $\frac{(q+k-4)\cdots(q+1)q(q-2)}{(k-1)!}$ must be an integer. Therefore, if $q$ is even and $(k-1)!$ does not divide $(q+k-4)\cdots(q+1)q(q-2)$ where $k\geq 4$, then $M_{q}(k)\leq q+k-3$. $\Box$ By the Theorem 2.3, we have the following. Corollary 2.3.1 $M_{q}(k)\leq q+k-3~{}(q=36(5s+1),~{}s\in N$ and $k=6,7).$ ## 3 Conclusion In this paper, we use the generalized weight enumerator and combinatorial methods to study $M_{q}(k)$ which denote the maximum number $n$ of an $(n,q^{k},n-k+1)$ MDS code. Compared to Theorem 1.1, Theorem 1.2 and Theorem 1.3, we obtain some new upper bounds of $M_{q}(k)$. Especially we obtain that $M_{q}(q-1)\leq q+2(q\equiv 4(mod~{}6)),~{}M_{q}(q-2)\leq q+1(q\equiv 4(mod~{}6)),~{}M_{q}(k)\leq q+k-3~{}(q=36(5s+1),~{}s\in N$ and $k=6,7).$ ## References * [1] T.L. Alderson, “On MDS codes and Bruen-Silverman codes,” Ph.D. Thesis, University of Western Ontario, 2002. * [2] T.L.Alderson, “Extending MDS codes,” Annals of Combinatorics, vol. 9, pp. 125-135, 2005. * [3] T. L. Alderson and A. A. Bruen, “Codes from cubic curves and their extensions,” the electronic journal of combinatorics, vol. 15, 2008. * [4] R.H.Bruck and H.J.Ryser, “The nonexistence of certain finite projective planes,” Canad J.Math, vol. 1, pp. 88-93, 1949\. * [5] A.A.Bruen and R.Silverman, “On the nonexistence of certain MDS codes and projective planes,” Math.Z, vol. 183, pp. 171-175, 1983. * [6] M.El-Khamy and R.J.McEliece, “The Partition Weight Enumerator of MDS Codes and its Applications,” Information Theory, vol. 9, pp. 926-930, 2005. * [7] J. W. P. Hirschfeld, “The Main Conjecture for MDS Codes,” Lecture Notes In Computer Science; Proceedings of the 5th IMA Conference on Cryptography and Coding, Springer-Verlag London, UK, vol. 1025, pp. 44-52, 1995\. * [8] Ludo M.G.M. and Tolhuizen, “On Maximum Distance Separable codes over alphabets of arbitrary size,” Information Theory, vol. 7, pp. 431, 1994. * [9] F.J.MacWilliams and N.J.A.Slane, “Theory of Error-Correcting Codes,” North-Holland,Amsterdam, pp. 317-329, 1977. * [10] R.Silverman, “A metrization for power-sets with applications to combinatorial analysis,” Canad.J.Math, vol. 12, pp. 158-176, 1960. * [11] D.X.Wang, “The MDS codes of small dimension and small weight,” Ms.Thesis, University of Shanghai, 2008.
arxiv-papers
2009-04-27T06:47:15
2024-09-04T02:49:02.169001
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Jiansheng Yang, Yunying Zhang", "submitter": "Yang Jiansheng", "url": "https://arxiv.org/abs/0904.4094" }
0904.4143
# Maximizing the probability of attaining a target prior to extinction Debasish Chatterjee Automatic Control Laboratory ETL I19, ETH Zürich Physikstrasse 3 8092 Zürich Switzerland chatterjee@control.ee.ethz.ch http://control.ee.ethz.ch/~chatterd , Eugenio Cinquemani INRIA-Grenoble - Rhône-Alpes 655 avenue de l’Europe Montbonnot 38334 Saint Ismier cedex France Eugenio.Cinquemani@inria.fr http://ibis.inrialpes.fr/article941.html and John Lygeros Automatic Control Laboratory ETL I22, ETH Zürich Physikstrasse 3 8092 Zürich Switzerland lygeros@control.ee.ethz.ch http://control.ee.ethz.ch/~lygeros ###### Abstract. We present a dynamic programming-based solution to the problem of maximizing the probability of attaining a target set before hitting a cemetery set for a discrete-time Markov control process. Under mild hypotheses we establish that there exists a deterministic stationary policy that achieves the maximum value of this probability. We demonstrate how the maximization of this probability can be computed through the maximization of an expected total reward until the first hitting time to either the target or the cemetery set. Martingale characterizations of thrifty, equalizing, and optimal policies in the context of our problem are also established. ###### Key words and phrases: dynamic programming, probability maximization, Markov control processes ###### 2000 Mathematics Subject Classification: Primary: 90C39, 90C40; Secondary: 93E20 This research was partially supported by the Swiss National Science Foundation under grant 200021-122072. ## 1\. Introduction There are two basic categories of discrete-time controlled Markov processes that deal with random temporal horizons. The first is the well-known optimal stopping problem [Dynkin, 1963], in which the random horizon arises from some dynamic optimization protocol based on the past history of the process. The random ‘stopping time’ thus generated is regarded as a decision variable. This problem arises in, among other areas, stochastic analysis, mathematical statistics, mathematical finance, and financial engineering; see the comprehensive monograph [Peskir and Shiryaev, 2006] for details and further references. The second is relatively less common, and is characterized by the fact that the random horizon arises as a result of an endogenous event of the stochastic process, e.g., the process hitting a particular subset of the state-space, variations in the process paths crossing a certain threshold. This problem arises in, among others, optimization of target-level criteria [Dubins and Savage, 1976; Bouakiz and Kebir, 1995], optimal control of retirement investment funds [Boda et al., 2004], minimization of ruin probabilities in insurance funds [Schmidli, 2008], ‘satisfaction of needs’ problems in economics [Simon, 1957], risk minimizing stopping problems [Ohtsubo, 2003], attainability problems under stochastic perturbations [Digaĭlova and Kurzhanskiĭ, 2004], and optimal control of Markov control processes up to an exit time [Borkar, 1991]. The problem treated in this article falls under the second category above. In broad strokes, we consider a discrete-time Markov control process with Borel state and action spaces. We assume that there is a certain target set located inside a safe region, the latter being a subset of the state-space. The problem is to maximize the probability of attaining the target set before exiting the safe set (or equivalently, hitting the cemetery set or unsafe region). This ‘reach a good set while avoiding a bad set’ formulation arises in, e.g., air traffic control, where aircraft try to reach their destination while avoiding collision with other aircraft or the ground despite uncertain weather conditions. It also arises in portfolio optimization, where it is desired to reach a target level of wealth without falling below a certain baseline capital with high probability. Finally, it forms the core of the computation of safe sets for hybrid systems where the ‘good’ and the ‘bad’ sets represent states from which a discrete transition into the unsafe set is possible [Gao et al., 2007; Tomlin et al., 2000]. Special cases of this problem have been investigated in, e.g., [Watkins and Lygeros, 2003; Prandini and Hu, 2006] in the context of air traffic applications, [Abate et al., 2008; Prajna et al., 2007] in the context of probabilistic safety, [Boda et al., 2004] in the context of maximizing the probability of attaining a preassigned comfort level of retirement investment funds. It is clear from the description of our problem in the preceding paragraph that there are two random times involved, namely, the hitting times of the target and the cemetery sets. In this article we formulate our problem as the maximization of an expected total reward accumulated up to the minimum of these two hitting times. As such, this formulation falls under the broad framework of optimal control of Markov control processes up to an exit time, which has a long and rich history. It has mostly been studied as the minimization of an expected total cost until the first time that the state enters a given target set, see e.g., [Borkar, 1991, Chapter II], [Hernández- Lerma and Lasserre, 1999, Chapter 8], and the references therein. In particular, if a unit cost is incurred as long as the state is outside the target set, then the problem of minimizing the cost accumulated until the state enters the target is known variously as the pursuit problem [Eaton and Zadeh, 1962], transient programming [Whittle, 1983], the first passage problem [Derman, 1970; Kushner, 1971], the stochastic shortest path problem [Bertsekas, 2007], and control up to an exit time [Borkar, 1988, 1991; Kesten and Spitzer, 1975]. Here we exploit certain additional structures of our problem in the dynamic programming equations that we derive leading to methods fine-tuned to the particular problem at hand. Our main results center around the assertion that there exists a deterministic stationary policy that maximizes the probability of hitting the target set before the cemetery set. This maximal probability as a function of the initial state is the optimal value function for our problem. We obtain a Bellman equation for our problem which is solved by the optimal value function. Furthermore, we provide martingale-theoretic conditions characterizing ‘thrifty’, ‘equalizing’, and optimal policies via methods derived from [Dubins and Savage, 1976; Karatzas and Sudderth, 2009]; see also [Zhu and Guo, 2006] and the references therein for martingale characterization of average optimality. The principal techniques employed in this article are similar to the ones in [Chatterjee et al., 2008], where the authors studied optimal control of a Markov control process up its first entry time to a safe set. In [Chatterjee et al., 2008] we developed a recovery strategy to enter a given target set from its exterior while minimizing a discounted cost. The problem was posed as one of minimizing the sum of a discounted cost-per-stage function $c$ up to the first entry time $\tau$ to a target set, namely, minimize $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau-1}\alpha^{t}c(x_{t},a_{t})\bigr{]}$ over a class of admissible policies $\pi$, where $\alpha\in\;]0,1[$ is a discount factor. Here we extend this approach to problems with two sets, a target and a cemetery, and the case of $\alpha=1$. This article unfolds as follows. The main results are stated in §2. In §2.1 we define the general setting of the problem, namely, Markov control processes on Polish spaces, their transition kernels, and the admissible control strategies. In §2.2 we present our main Theorem (2.10) which guarantees the existence of a deterministic stationary policy that leads to the maximal probability of hitting the target set while avoiding the specified dangerous set, and also provides a Bellman equation that the value function must satisfy. In §2.3 we look at a martingale characterization of the optimal control problem; thrifty and equalizing policies are defined in the context of our problem, and we establish necessary and sufficient conditions for optimality in terms of thrifty and equalizing policies in Theorem (2.17). We discuss related reward-per-stage functions and their relationships to our problem and treat several examples in §3. Proofs of the main results appear in §4. The article concludes in §5 with a discussion of future work. ## 2\. Main Results Our main results are stated in this section after some preliminary definitions and conventions. ### 2.1. Preliminaries We employ the following standard notations. Let $\mathbb{N}$ denote the natural numbers $\\{1,2,\ldots\\}$ and $\mathbb{N}_{0}$ denote the nonnegative integers $\\{0\\}\cup\mathbb{N}$. Let $\boldsymbol{1}_{A}(\cdot)$ be the usual indicator function of a set $A$, i.e., $\boldsymbol{1}_{A}(\xi)=1$ if $\xi\in A$ and $0$ otherwise. For real numbers $a$ and $b$ let $a\wedge b\mathrel{\mathop{:}\\!\\!=}\min\\{a,b\\}$. A function $f:X\longrightarrow\mathbb{R}$ restricted to $A\subseteq X$ is depicted as $f|_{A}$. Given a nonempty Borel set $X$ (i.e., a Borel subset of a Polish space), its Borel $\sigma$-algebra is denoted by $\mathfrak{B}\\!\left(X\right)$. By convention, when referring to sets or functions, “measurable” means “Borel- measurable.” If $X$ and $Y$ are nonempty Borel spaces, a _stochastic kernel_ on $X$ given $Y$ is a function $Q(\cdot|\cdot)$ such that $Q(\cdot|y)$ is a probability measure on $X$ for each fixed $y\in Y$, and $Q(B|\cdot)$ is a measurable function on $Y$ for each fixed $B\in\mathfrak{B}\\!\left(X\right)$. We briefly recall some standard definitions below, see, e.g., [Hernández-Lerma and Lasserre, 1996] for further details. A _Markov control model_ is a five- tuple ((2.1)) $\bigl{(}X,A,\\{A(x)\mid x\in X\\},Q,r\bigr{)}$ consisting of a nonempty Borel space $X$ called the _state-space_ , a nonempty Borel space $A$ called the _control_ or _action set_ , a family $\\{A(x)\mid x\in X\\}$ of nonempty measurable subsets $A(x)$ of $A$, where $A(x)$ denotes the set of _feasible controls_ or _actions_ when the system is in state $x\in X$ and with the property that the set $\mathbb{K}\mathrel{\mathop{:}\\!\\!=}\bigl{\\{}(x,a)\big{|}x\in X,a\in A(x)\bigr{\\}}$ of feasible state-action pairs is a measurable subset of $X\times A$, a stochastic kernel $Q$ on $X$ given $\mathbb{K}$ called the _transition law_ , and a measurable function $r:\mathbb{K}\longrightarrow\mathbb{R}$ called the _reward-per-stage function_. ###### (2.2) Assumption. The set $\mathbb{K}$ of feasible state-action pairs contains the graph of a measurable function from $X$ to $A$. $\diamondsuit$ Consider the Markov model ((2.1)), and for each $i=0,1,\ldots,$ define the space $H_{i}$ of _admissible histories_ up to time $i$ as $H_{0}\mathrel{\mathop{:}\\!\\!=}X$ and $H_{i}\mathrel{\mathop{:}\\!\\!=}\mathbb{K}^{i}\times X=\mathbb{K}\times H_{i-1},i\in\mathbb{N}$. A generic element $h_{i}$ of $H_{i}$, which is called an admissible $i$-history, or simply $i$-history, is a vector of the form $h_{i}=(x_{0},a_{0},\ldots,x_{i-1},a_{i-1},x_{i})$, with $(x_{j},a_{j})\in\mathbb{K}$ for $j=0,\ldots,i-1$, and $x_{i}\in X$. Hereafter we let the $\sigma$-algebra generated by the history $h_{i}$ be denoted by $\mathfrak{F}_{i}$, $i\in\mathbb{N}_{0}$. Recall that a _policy_ is a sequence $\pi=(\pi_{i})_{i\in\mathbb{N}_{0}}$ of stochastic kernels $\pi_{i}$ on the control set $A$ given $H_{i}$ satisfying the constraint $\pi_{i}(A(x_{i})|h_{i})=1\;\;\forall\,h_{i}\in H_{i},i\in\mathbb{N}_{0}$. The set of all policies is denoted by $\Pi$. Let $(\Omega,\mathfrak{F})$ be the measurable space consisting of the (canonical) sample space $\Omega\mathrel{\mathop{:}\\!\\!=}\overline{H}_{\infty}=(X\times A)^{\infty}$ and let $\mathfrak{F}$ be the corresponding product $\sigma$-algebra. The elements of $\Omega$ are sequences of the form $\omega=(x_{0},a_{0},x_{1},a_{1},\ldots)$ with $x_{i}\in X$ and $a_{i}\in A$ for all $i\in\mathbb{N}_{0}$; the projections $x_{i}$ and $a_{i}$ from $\Omega$ to the sets $X$ and $A$ are called _state_ and _control_ (or _action_) variables, respectively. Let $\pi=(\pi_{i})_{i\in\mathbb{N}_{0}}$ be an arbitrary control policy, and let $\nu$ be an arbitrary probability measure on $X$, referred to as the initial distribution. By a theorem of Ionescu-Tulcea [Rao and Swift, 2006, Chapter 3, §4, Theorem 5], there exists a unique probability measure $\mathsf{P}_{\nu}^{\pi}$ on $(\Omega,\mathfrak{F})$ supported on $H^{\infty}$, such that for all $B\in\mathfrak{B}\\!\left(X\right)$, $C\in\mathfrak{B}\\!\left(A\right)$, $h_{i}\in H_{i}$, $i\in\mathbb{N}_{0}$, we have $\mathsf{P}_{\nu}^{\pi}(x_{0}\in B)=\nu(B)$, ((2.3)a) $\displaystyle\mathsf{P}_{\nu}^{\pi}\bigl{(}a_{i}\in C\,\big{|}\,h_{i}\bigr{)}$ $\displaystyle=\pi_{i}\bigl{(}C\,\big{|}\,h_{i}\bigr{)}$ ((2.3)b) $\displaystyle\mathsf{P}_{\nu}^{\pi}\bigl{(}x_{i+1}\in B\,\big{|}\,h_{i},a_{i}\bigr{)}$ $\displaystyle=Q\bigl{(}B\,\big{|}\,x_{i},a_{i}\bigr{)}.$ ###### (2.4) Definition. The stochastic process $\bigl{(}\Omega,\mathfrak{F},\mathsf{P}_{\nu}^{\pi},(x_{i})_{i\in\mathbb{N}_{0}}\bigr{)}$ is called a discrete-time _Markov control process_. $\Diamond$ We note that the Markov control process in Definition (2.4) is not necessarily Markovian in the usual sense due to the dependence on the entire history $h_{i}$ in ((2.3)a); however, it is well-known [Hernández-Lerma and Lasserre, 1996, Proposition 2.3.5] that if $(\pi_{i})_{i\in\mathbb{N}_{0}}$ is restricted to a suitable subclass of policies, then $(x_{i})_{i\in\mathbb{N}_{0}}$ is a Markov process. Let $\Phi$ denote the set of stochastic kernels $\varphi$ on $A$ given $X$ such that $\varphi(A(x)|x)=1$ for all $x\in X$, and let $\mathbb{F}$ denote the set of all measurable functions $f:X\longrightarrow A$ satisfying $f(x)\in A(x)$ for all $x\in X$. The functions in $\mathbb{F}$ are called _measurable selectors_ of the set-valued mapping $X\ni x\longmapsto A(x)\subseteq A$. Recall that a policy $\pi=(\pi_{i})_{i\in\mathbb{N}_{0}}\in\Pi$ is said to be _randomized Markov_ if there exists a sequence $(\varphi_{i})_{i\in\mathbb{N}_{0}}$ of stochastic kernels $\varphi_{i}\in\Phi$ such that $\pi_{i}(\cdot|h_{i})=\varphi_{i}(\cdot|x_{i})\;\;\forall\,h_{i}\in H_{i},\;i\in\mathbb{N}_{0}$; _deterministic Markov_ if there exists a sequence $(f_{i})_{i\in\mathbb{N}_{0}}$ of functions $f_{i}\in\mathbb{F}$ such that $\pi_{i}(\cdot|h_{i})=\delta_{f(x_{i})}(\cdot)$; _deterministic stationary_ if there exists a function $f\in\mathbb{F}$ such that $\pi_{i}(\cdot|h_{i})=\delta_{f(x_{i})}(\cdot)$. As usual let $\Pi$, $\Pi_{RM}$, $\Pi_{DM}$, and $\Pi_{DS}$ denote the set of all randomized history-dependent, randomized Markov, deterministic Markov, and deterministic stationary policies, respectively. The transition kernel $Q$ in ((2.3)b) under a policy $\pi\mathrel{\mathop{:}\\!\\!=}(\varphi_{i})_{i\in\mathbb{N}_{0}}\in\Pi_{RM}$ is given by $\bigl{(}Q(\cdot|\cdot,\varphi_{i})\bigr{)}_{i\in\mathbb{N}_{0}}$, which is defined as the transition kernel $\mathfrak{B}\\!\left(X\right)\times X\ni(B,x)\longmapsto Q(B|x,\varphi_{i}(x))\mathrel{\mathop{:}\\!\\!=}\int_{A(x)}\varphi_{i}(\mathrm{d}a|x)Q(B|x,a)$. Occasionally we suppress the dependence of $\varphi_{i}$ on $x$ and write $Q(B|x,\varphi_{i})$ in place of $Q(B|x,\varphi_{i}(x))$, and $r(x_{j},\varphi_{j})\mathrel{\mathop{:}\\!\\!=}\int_{A(x_{j})}\varphi_{j}(\mathrm{d}a|x_{j})r(x_{j},a)$. We simply write $f^{\infty}$ for a policy $(f,f,\ldots)\in\Pi_{DS}$. ### 2.2. Maximizing the Probability of Hitting a Target before a Cemetery Set Let $O$ and $K$ be two nonempty measurable subsets of $X$ with $O\subsetneqq K$. Let ((2.5)) $\displaystyle\tau\mathrel{\mathop{:}\\!\\!=}\inf\bigl{\\{}t\in\mathbb{N}_{0}\;\big{|}\;x_{t}\in O\bigr{\\}}\quad\text{and}\quad\tau^{\prime}\mathrel{\mathop{:}\\!\\!=}\inf\bigl{\\{}t\in\mathbb{N}_{0}\;\big{|}\;x_{t}\in X\smallsetminus K\bigr{\\}}$ be the first hitting times of the above sets.111As usual we set the infimum over an empty set to be $\infty$. These random times are stopping times with respect to the filtration $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$. Suppose that the objective is to maximize the probability that the state hits the set $O$ before exiting the set $K$; in symbols the objective is to attain ((2.6)) $V^{\star}(x)\mathrel{\mathop{:}\\!\\!=}\sup_{\pi\in\Pi}V(\pi,x)\mathrel{\mathop{:}\\!\\!=}\sup_{\pi\in\Pi}\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<\infty\bigr{)},$ where the $\sup$ is taken over a class $\Pi$ of admissible policies. ###### (2.7). _Admissible policies._ It is clear at once that the class of admissible policies for the problem ((2.6)) is different from the classes considered in §2.1. Indeed, since the process is killed at the stopping time $\tau\wedge\tau^{\prime}$, it follows that the class of admissible policies should also be truncated at the stage $\tau\wedge\tau^{\prime}-1$. For a given stage $t\in\mathbb{N}_{0}$ we define the $t$-th policy element $\pi_{t}$ only on the set $\\{t<\tau\wedge\tau^{\prime}\\}$. Note that with this definition $\pi_{t}$ becomes a $\mathfrak{F}_{t\wedge\tau\wedge\tau^{\prime}}$-measurable randomized control. It is also immediate from the definitions of $\tau$ and $\tau^{\prime}$ that if the initial condition $x\in O\cup(X\smallsetminus K)$, then the set of admissible policies is empty in the sense that there is nothing to do by definition. Indeed, in this case $\tau\wedge\tau^{\prime}=0$ and no control is needed. We are thus interested only in $x\in K\smallsetminus O$, for otherwise the problem is trivial. In other words, the domain of $\pi_{t}$ is contained in the ‘spatial’ region $\bigl{\\{}(x,a)\in\mathbb{K}\,\big{|}\,x\in K\smallsetminus O,a\in A(x)\bigr{\\}}$. Equivalently, in view of the definitions of the ‘temporal’ elements $\tau$ and $\tau^{\prime}$, $\pi_{t}$ is well-defined on the set $\\{t<\tau\wedge\tau^{\prime}\\}$. We re-define $\mathbb{K}\mathrel{\mathop{:}\\!\\!=}\bigl{\\{}(x,a)\in\mathbb{K}\,\big{|}\,x\in K\smallsetminus O,a\in A(x)\bigr{\\}}$, and also let $\mathbb{F}$ to be the set of measurable selectors of the set-valued map $K\smallsetminus O\ni x\longmapsto A(x)\subseteq A$. _Throughout this subsection we shall denote by $\Pi_{M}$ the class of Markov policies such that if $(\pi_{t})_{t\in\mathbb{N}_{0}}\in\Pi_{M}$, then $\pi_{t}$ is defined on $\mathbb{K}$ for each $t$._ ###### (2.8). Recall that a transition kernel $Q$ on a measurable space $X$ given another measurable space $Y$ is said to be _strongly Feller_ if the mapping $y\longmapsto\int_{X}g(x)Q(\mathrm{d}x|y)$ is continuous and bounded for every measurable and bounded function $g:X\longrightarrow\mathbb{R}$. A function $g:\mathbb{K}\longrightarrow\mathbb{R}$ is _upper semicontinuous_ (u.s.c.) if for every sequence $(x_{j},a_{j})_{j\in\mathbb{N}}\subseteq\mathbb{K}$ converging to $(x,a)\in\mathbb{K}$, we have $\limsup_{j\rightarrow\infty}g(x_{j},a_{j})\leqslant g(x,a)$; or, equivalently, if for every $r\in\mathbb{R}$, the set $\bigl{\\{}(x,a)\in\mathbb{K}\,\big{|}\,g(x,a)\geqslant r\bigr{\\}}$ is closed in $\mathbb{K}$. A set-valued map $\Psi:X\longrightarrow\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\to{\;}Y$ between topological spaces is _upper hemicontinuous at a point $x$_ if for every neighborhood $U$ of $\Psi(x)$ there exists a neighborhood $V$ of $x$ such that $z\in V$ implies that $\Psi(z)\subseteq U$; $\Psi$ is _upper hemicontinuous_ if it is upper hemicontinuous at every $x$ in its domain. If $X$ is equipped with a $\sigma$-algebra $\Sigma$, then the set-valued map $\Psi$ is called _weakly measurable_ if $\Psi^{\ell}(G)\in\Sigma$ for every open $G\subseteq Y$, where $\Psi^{\ell}$ is the lower inverse of $\Psi$, defined by $\Psi^{\ell}(A)\mathrel{\mathop{:}\\!\\!=}\\{x\in X\mid\Psi(x)\cap A\neq\emptyset\\}$. See, e.g., [Aliprantis and Border, 2006, Chapters 17-18] for further details on set-valued maps.222What we call “set-valued maps” are “correspondences” in [Aliprantis and Border, 2006]. Whenever $B\subseteq X$ is a nonempty measurable set and we are concerned with any set-valued map $B\ni x\longmapsto A(x)\subseteq A$, we let $B$ be equipped with the trace of $\mathfrak{B}\\!\left(X\right)$ on $B$. Let $b\mathfrak{B}\\!\left(X\right)^{+}$ denote the convex cone of nonnegative, bounded, and measurable real-valued functions on $X$, and we define $\bar{B}\mathrel{\mathop{:}\\!\\!=}\bigl{\\{}g\in\boldsymbol{L}_{\infty}(X)\,\big{|}\,g|_{X\smallsetminus K}=0,\left\lVert g\right\rVert_{\boldsymbol{L}_{\infty}{(X)}}\leqslant 1\bigr{\\}}$. ###### (2.9) Assumption. In addition to Assumption (2.2), we stipulate that 1. (i) the set-valued map $K\smallsetminus O\ni x\longmapsto A(x)\subseteq A$ is compact-valued, upper hemicontinuous, and weakly measurable; 2. (ii) the transition kernel $Q$ on $X$ given $\mathbb{K}$ is strongly Feller, i.e., the mapping $\mathbb{K}\ni(x,a)\longmapsto\int_{X}Q(\mathrm{d}y|x,a)g(y)$ is continuous and bounded for all bounded and measurable functions $g:X\longrightarrow\mathbb{R}$.$\diamondsuit$ The following theorem gives basic existence results for the problem ((2.6)); a proof is presented in §4.1. ###### (2.10) Theorem. Suppose that Assumption ((2.9)) holds, and that $\tau\wedge\tau^{\prime}$ is finite for every policy in $\Pi_{M}$. Then: 1. (i) The value function $V^{\star}$ is a pointwise bounded and measurable solution to the _Bellman equation_ in $\psi$: ((2.11)) $\psi(x)=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\max_{a\in A(x)}\int_{X}Q(\mathrm{d}y|x,a)\boldsymbol{1}_{K}(y)\psi(y)\quad\forall\,x\in X.$ Moreover, $V^{\star}$ is minimal in $\bar{B}\cap b\mathfrak{B}\\!\left(X\right)^{+}$. 2. (ii) There exists a measurable selector $f_{\star}\in\mathbb{F}$ such that $f_{\star}(x)\in A(x)$ attains the maximum in ((2.11)) for each $x\in K\smallsetminus O$, which satisfies ((2.12)) $V^{\star}(x)=\begin{cases}1&\text{if }x\in O,\\\ \displaystyle{\int_{K}Q(\mathrm{d}y|x,f_{\star})\,V^{\star}(y)}&\text{if }x\in K\smallsetminus O,\\\ 0&\text{otherwise},\end{cases}$ where $V^{\star}$ is as defined in ((3.1)). Moreover, the deterministic stationary policy $f_{\star}^{\infty}$ is optimal. Conversely, if $f_{\star}^{\infty}$ is optimal, then it satisfies ((2.12)). ###### (2.13). As a matter of notation we shall henceforth represent the functional equation ((2.12)) with the less formal version: ((2.14)) $V^{\star}(x)=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f_{\star})\,V^{\star}(y)\quad\forall\,x\in X.$ Note that the measure $Q(\cdot|x,f_{\star})$ is not well-defined for $x\in O\cup(X\smallsetminus K)$ for $f\in\mathbb{F}$ in view of the definition in paragraph (2.7). As such the integral $\int_{K}Q(\mathrm{d}y|x,f_{\star})\,V^{\star}(y)$ is undefined for $x\in O\cup(X\smallsetminus K)$. However, to preserve the form of ((2.11)) and simplify notation, we shall stick to the representation ((2.14)) by defining any object that is written as an integral of a bounded measurable function with respect to the measure $Q(\cdot|x,f)$ to be $0$ whenever $x\in O\cup(X\smallsetminus K)$ and $f\in\mathbb{F}$. ### 2.3. A Martingale Characterization _We now return to the more general class of all possible policies (not just Markovian), denoted by $\Pi$._ Fix an initial state $x\in X$ and a policy $\pi\in\Pi$. For each $n\in\mathbb{N}$ we define the random variable $W_{n}(\pi,x)\mathrel{\mathop{:}\\!\\!=}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})$. Let us consider the process $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ defined by ((2.15)) $\displaystyle\zeta_{0}$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}V^{\star}(x),$ $\displaystyle\zeta_{n}$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}W_{n}(\pi,x)+\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}}),\;\;n\in\mathbb{N}.$ We follow the basic framework of [Karatzas and Sudderth, 2009]. ###### (2.16) Definition. A policy $\pi\in\Pi$ is called _thrifty at $x\in X$_ if $V^{\star}(x)=\Lambda^{\pi}(x)$, and _equalizing at $x\in X$_ if $\Lambda^{\pi}(x)=V(\pi,x)$. The action $a_{n}$, defined on $\\{\tau\wedge\tau^{\prime}>n\\}$, is said to _conserve $V^{\star}$ at $x_{n}$_ if $\boldsymbol{1}_{O}(x_{n})+\boldsymbol{1}_{K\smallsetminus O}(x_{n})\int_{K}Q(\mathrm{d}y|x_{n},a_{n})V^{\star}(y)=V^{\star}(x_{n})$. $\Diamond$ Connections between equalizing, thrifty, and optimal policies for our problem ((2.6)) are established by the following ###### (2.17) Theorem. A policy $\pi\in\Pi$ is * $\circ$ equalizing at $x\in X$ if and only if $\lim_{n\to\infty}\mathsf{E}^{\pi}_{x}\bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{]}=0;$ * $\circ$ optimal at $x\in X$ if and only if $\pi$ is both thrifty and equalizing. A connection between thrifty policies, the process $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ defined in ((2.15)), and actions conserving the optimal value function $V^{\star}$ is established by the following ###### (2.18) Theorem. For a given policy $\pi\in\Pi$ and an initial state $x\in X$ the following are equivalent: 1. (i) $\pi$ is trifty at $x$; 2. (ii) $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ is a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$ -martingale under $\mathsf{P}^{\pi}_{x}$; 3. (iii) $\mathsf{P}^{\pi}_{x}$-almost everywhere on $\\{\tau\wedge\tau^{\prime}>n\\}$ the action $a_{n}$ conserves $V^{\star}$. It is possible to make a connection, relying purely on martingale-theoretic arguments, between the process $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ and the value function corresponding to an optimal policy. This is the content of the following theorem, which may be viewed as a partial converse to Theorem (2.18). ###### (2.19) Theorem. Suppose that either one of the stopping times $\tau$ and $\tau^{\prime}$ defined in ((2.5)) is finite for every policy in $\Pi$. Let $V^{\prime}$ be a nonnegative measurable function such that $V^{\prime}|_{O}=1$, $V^{\prime}|_{X\smallsetminus K}=0$, and bounded above by $1$ elsewhere. For a policy $\pi\in\Pi$ define the process $(\zeta^{\prime}_{n})_{n\in\mathbb{N}_{0}}$ as ((2.20)) $\displaystyle\zeta^{\prime}_{0}$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}V^{\prime}(x),$ $\displaystyle\zeta^{\prime}_{n}$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}W_{n}(\pi,x)+\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot V^{\prime})(x_{n\wedge\tau\wedge\tau^{\prime}}),\;\;n\in\mathbb{N},$ where $W_{n}(\pi,x)$ is as in ((2.15)). If for some policy $\pi^{\star}\in\Pi$ the process $(\zeta^{\prime}_{n})_{n\in\mathbb{N}_{0}}$ is a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$ -martingale under $\mathsf{P}^{\pi^{\star}}_{x}$, then $V^{\prime}(x)=\mathsf{P}^{\pi^{\star}}_{x}\bigl{(}\tau<\tau^{\prime},\tau<\infty\bigr{)}$. Proofs of the above results are presented in §4.2. ## 3\. Discussion and Examples Let us look at the stopped process $(x_{t\wedge{(n-1)}\wedge\tau\wedge\tau^{\prime}})_{t\in\mathbb{N}_{0}}$. It is clear that in this case $V_{n}(\pi,x)=1$ whenever $x\in O$ and $V_{n}(\pi,x)=0$ whenever $x\in X\smallsetminus K$ for all policies in $\Pi_{M}$; otherwise for $x\in K\smallsetminus O$ we have $\displaystyle V_{n}(\pi,x)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<n\bigr{)}$ $\displaystyle=\mathsf{P}^{\pi}_{x}\bigl{(}x_{1\wedge\tau\wedge\tau^{\prime}}\in O\bigr{)}+\mathsf{P}^{\pi}_{x}\bigl{(}x_{1\wedge\tau\wedge\tau^{\prime}}\in K\smallsetminus O,x_{2\wedge\tau\wedge\tau^{\prime}}\in O\bigr{)}$ $\displaystyle\quad+\ldots+\mathsf{P}^{\pi}_{x}\bigl{(}x_{1\wedge\tau\wedge\tau^{\prime}},\ldots,x_{(n-2)\wedge\tau\wedge\tau^{\prime}}\in K\smallsetminus O,x_{(n-1)\wedge\tau\wedge\tau^{\prime}}\in O\bigr{)}.$ Since the $k$-th term on the right-hand side is $\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=1}^{k-1}\boldsymbol{1}_{K\smallsetminus O}(x_{t\wedge\tau\wedge\tau^{\prime}})\boldsymbol{1}_{O}(x_{k\wedge\tau\wedge\tau^{\prime}})\bigr{]}$, it follows that $\displaystyle V_{n}(\pi,x)$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\Biggl{(}\prod_{i=0}^{t-1}\boldsymbol{1}_{K\smallsetminus O}(x_{i})\Biggr{)}\boldsymbol{1}_{O}(x_{t})\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{(n-1)\wedge\tau}\boldsymbol{1}_{O}(x_{t\wedge\tau^{\prime}})\Biggr{]}=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}.$ We note that $V_{n}(\pi,x)=0$ whenever $x\in O\cup(X\smallsetminus K)$. A policy that maximizes $V_{n}(\pi,x)$ is defined only on the set $K\smallsetminus O$, and it is left undefined elsewhere. Once the process exits $K\smallsetminus O$ or the stage reaches $n-1$, the task of our control policy is over. Such a deterministic stationary policy (which exists, as demonstrated below) with a measurable selector $f\in\mathbb{F}$ should be represented as $f^{\tau\wedge\tau^{\prime}}\mathrel{\mathop{:}\\!\\!=}\underset{\tau\wedge\tau^{\prime}\text{ times}}{\underbrace{(f,f,\ldots,f)}}$ since it is applied only for the first $\tau\wedge\tau^{\prime}$ stages; however, for notational brevity we simply write $f^{\infty}$ hereafter. Quite clearly, letting $n\to\infty$, the monotone convergence theorem gives $\displaystyle V(\pi,x)$ $\displaystyle=\lim_{n\to\infty}V_{n}(\pi,x)=\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<\infty\bigr{)}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{\tau}\boldsymbol{1}_{O}(x_{t\wedge\tau\wedge\tau^{\prime}})\Biggr{]}.$ We note that by definition, the random sum inside the expectation on the right-hand side of the last equality above is the limit of partial (finite) sums, and this ensures that the term inside the expectation is defined on the event $\\{\tau\wedge\tau^{\prime}<\infty\\}$. By definition note that ((3.1)) $V^{\star}(x)=\sup_{\pi\in\Pi_{M}}V(\pi,x)=\sup_{\pi\in\Pi_{M}}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}.$ Consider again the value-iteration functions defined by ((3.2)) $\begin{cases}v_{0}(x)\mathrel{\mathop{:}\\!\\!=}\boldsymbol{1}_{O}(x)\\\ v_{n}(x)\mathrel{\mathop{:}\\!\\!=}\displaystyle{\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\max_{a\in A(x)}\int_{X}Q(\mathrm{d}y|x,a)\boldsymbol{1}_{K}(y)v_{n-1}(y)}\end{cases}$ for $x\in X$ and $n\in\mathbb{N}$. The function $v_{n}$ is clearly identifiable with the optimal value function for the problem of maximizing $\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<n\bigr{)}$ of the process stopped at the $(n-1)$-th stage, $n\in\mathbb{N}$. To get an intuitive idea, fix a deterministic Markov policy $\pi^{\prime}=(f_{t})_{t\in\mathbb{N}_{0}}$ and take the first iterate $v_{0}$. (Of course the assumption underlying the notation $(f_{t})_{t\in\mathbb{N}_{0}}$ is that $f_{t}$ is defined on $\\{t<\tau\wedge\tau^{\prime}\\}$.) It is immediately clear that the reward at the first step is $1$ if and only if $x\in K$ and $0$ otherwise, and that is precisely $v_{0}$ irrespective of the policy. For the second iterate note the reward under the policy $\pi^{\prime}$ is $\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)Q(O|x,f_{0}(x))$. This is because the reward is $1$ if $x\in O$ and the process terminates at the first stage, or $x\in K\smallsetminus O$ and the reward at the second stage is the probability of hitting $O$ at the second stage. Of course there is no reward if $x\in X\smallsetminus K$. Similarly, for the third iterate the reward is $\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}\xi_{1}|x,f_{0}(x))\bigl{(}\boldsymbol{1}_{O}(\xi_{1})+\boldsymbol{1}_{K\smallsetminus O}(\xi_{1})Q(O|\xi_{1},f_{1}(\xi_{1}))\bigr{)}$. Note that only those sample paths that stay in $K\smallsetminus O$ at the first step contribute to the reward at the second stage, only those sample paths that stay in $K\smallsetminus O$ for the first and the second stages contribute to the reward at the third stage, and so on. ### 3.1. A general setting and various special cases Our problem ((2.6)) can be viewed as a special case of a more general setting. To wit, consider a nonnegative upper semicontinuous reward-per-stage function $r:\mathbb{K}\longrightarrow\mathbb{R}_{\geqslant 0}$ and the problem of maximizing the total reward up to (and including) the hitting time $\tau\wedge\tau^{\prime}$, i.e., maximize $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}r(x_{t},a_{t})\bigr{]}$ over a class of policies. This corresponds to maximization of the reward until exit from the set $K\smallsetminus O$. The value-iteration functions $(v^{\prime}_{n})_{n\in\mathbb{N}_{0}}$ corresponding to this problem can be written down readily: for $x\in X$ and $n\in\mathbb{N}$ let $\displaystyle v^{\prime}_{0}(x)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\sup_{a\in A(x)}r(x,a)\boldsymbol{1}_{O\cup(X\smallsetminus K)}(x),$ $\displaystyle v^{\prime}_{n}(x)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\sup_{a\in A(x)}\biggl{[}r(x,a)\boldsymbol{1}_{O\cup(X\smallsetminus K)}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{X}Q(\mathrm{d}y|x,a)v^{\prime}_{n-1}(y)\biggr{]}.$ Our problem ((2.6)) corresponds to the case of $r(x,a)=\boldsymbol{1}_{O}(x)$. Modulo the additional technical complications involving integrability of the value-iteration functions at each stage and the total reward corresponding to initial conditions being well-defined real numbers, the analysis of this more general problem can be carried out in exactly the same way as we do below for the problem ((2.6)). While the above more general problem treats both the target set $O$ and the cemetery state $X\smallsetminus K$ equally, the bias towards the target set $O$ is provided in our problem ((2.6)) by the special structure of the reward $r(x,a)=\boldsymbol{1}_{O}(x)$. From the general framework it is not difficult to arrive at reward-per-stage functions that are meaningful in the context of reachability, avoidance, and safety. For the sake of simplicity, till the end of this subsubsection we suppose that for all initial conditions and admissible policies $\pi\in\Pi$ the stopping times $\tau$ and $\tau^{\prime}$ are finite $\mathsf{P}^{\pi}_{x}$-almost surely. With this assumption in place, let us look at some examples: * $\circ$ Consider a discounted version of our problem ((2.6)), namely, let $V^{(1)}(\pi,x)\mathrel{\mathop{:}\\!\\!=}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\alpha^{t}\boldsymbol{1}_{O}(x_{t})\Biggr{]},$ where $\alpha\in\;]0,1[$ is a constant discount factor. From the definitions of $\tau$ and $\tau^{\prime}$ it follows that $\sum_{t=0}^{\tau\wedge\tau^{\prime}}\alpha^{t}\boldsymbol{1}_{O}(x_{t})=\alpha^{\tau}\boldsymbol{1}_{\\{\tau<\tau^{\prime}\\}}$, and in view of the range of $\alpha$ it follows that maximization of $V^{(1)}$ over admissible policies leads to small values of $\tau$ on the set $\\{\tau<\tau^{\prime}\\}$ on an average, but it is silent about the values of $\tau$ on $\\{\tau>\tau^{\prime}\\}$. To get a more quantitative idea of the role that the discount factor $\alpha$ plays, let $\tilde{\tau}$ be a random variable independent of the Markov control process defined in Definition (2.4),333The random variable $\tilde{\tau}$ can be defined in a standard way by enlarging the probability space. with distribution function $\mathsf{P}(\tilde{\tau}=n)=(1-\alpha)\alpha^{n}$ for all $n\in\mathbb{N}_{0}$. In a standard way we construct the product probability measure $\mathsf{P}^{\pi}\otimes\mathsf{P}$ and denote the expectation with respect to this measure as $\mathsf{E}^{\pi,\tilde{\tau}}_{x}[\cdot]$. We can write $V^{(1)}(\pi,x)=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\infty}\alpha^{t}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}=(1-\alpha)^{-1}\mathsf{E}^{\pi,\tilde{\tau}}_{x}\bigl{[}\boldsymbol{1}_{O}(x_{\tilde{\tau}})\boldsymbol{1}_{\\{\tilde{\tau}\leqslant\tau\wedge\tau^{\prime}\\}}\bigr{]}.$ In view of the definitions of $\tau$ and $\tau^{\prime}$ we get $V^{(1)}(\pi,x)=(1-\alpha)^{-1}\mathsf{E}^{\pi,\tilde{\tau}}_{x}\bigl{[}\boldsymbol{1}_{\\{\tilde{\tau}=\tau,\tau<\tau^{\prime}\\}}\bigr{]}$. This alternative characterization shows that maximization of $V^{(1)}$ over admissible policies leads to smaller values of $\tau$ compared to $\tau^{\prime}$; moreover, the random variable $\tilde{\tau}$ gives a quantitative idea of how the choice of $\alpha$ determines the outcome since $\tilde{\tau}$ is a geometric random variable with parameter $(1-\alpha)$. Choosing a small $\alpha$ implies smaller $\tilde{\tau}$ with higher probability and may appear to be profitable; however, in certain problems it is possible that the set $O$ may be reachable at $\tilde{\tau}$ with small probability and the corresponding event of interest $\\{\tilde{\tau}=\tau,\tau<\tau^{\prime}\\}$ may be relatively small for a given initial condition $x$. Moreover, the factor $(1-\alpha)^{-1}$ is small for small values of $\alpha$, and contributes to this phenomenon. A second quantitative view of the role of $\alpha$ is offered by the fact that $V^{(1)}(\pi,x)=\mathsf{E}^{\pi,\tilde{\tau}}_{x}\bigl{[}\sum_{t=0}^{\tilde{\tau}\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\bigr{]}$. Indeed, we have $\displaystyle\mathsf{E}^{\pi,\tilde{\tau}}_{x}$ $\displaystyle\Biggl{[}\sum_{t=0}^{\tilde{\tau}\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=\mathsf{E}^{\pi,\tilde{\tau}}_{x}\Biggl{[}\sum_{t=0}^{\tilde{\tau}}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{n=0}^{\infty}\alpha^{n}(1-\alpha)\sum_{t=0}^{n}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{n=0}^{\infty}\sum_{t=0}^{n}\alpha^{n}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}-\sum_{n=0}^{\infty}\sum_{t=0}^{n}\alpha^{n+1}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\infty}\sum_{n=t}^{\infty}\alpha^{n}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}-\sum_{t=0}^{\infty}\sum_{n=t}^{\infty}\alpha^{n+1}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\infty}\frac{\alpha^{t}}{1-\alpha}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}-\sum_{t=0}^{\infty}\frac{\alpha^{t+1}}{1-\alpha}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\infty}\alpha^{t}\boldsymbol{1}_{O}(x_{t})\boldsymbol{1}_{\\{t\leqslant\tau\wedge\tau^{\prime}\\}}\Biggr{]}=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\alpha^{t}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=V^{(1)}(\pi,x).$ In this setting we do not have the $(1-\alpha)^{-1}$ factor outside the expectation as in the second version of $V^{(1)}$ above, and it demonstrates that maximizing $V^{(1)}(\pi,x)$ over admissible policies leads to maximizing the probability of the event $\\{\tau<\tilde{\tau}\wedge\tau^{\prime}\\}$, where $\alpha$ controls the values of $\tilde{\tau}$ as before. * $\circ$ Consider the reward-per-stage function $r(x,a)=\boldsymbol{1}_{O}(x)-\boldsymbol{1}_{X\smallsetminus O}(x)$. Under integrability assumption on $\tau\wedge\tau^{\prime}$ under all admissible policies, we have $\displaystyle V^{(2)}(\pi,x)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\bigl{(}\boldsymbol{1}_{O}(x_{t})-\boldsymbol{1}_{X\smallsetminus O}(x_{t})\bigr{)}\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\bigl{(}\boldsymbol{1}_{O}(x_{t})-\boldsymbol{1}_{K\smallsetminus O}(x_{t})-\boldsymbol{1}_{X\smallsetminus K}(x_{t})\bigr{)}\Biggr{]}$ $\displaystyle=\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})-\mathsf{P}^{\pi}_{x}(\tau^{\prime}<\tau)-\mathsf{E}^{\pi}_{x}[\tau\wedge\tau^{\prime}].$ Clearly, maximization of $V^{(2)}$ over admissible policies leads to both the maximal enlargement of the set $\\{\tau<\tau^{\prime}\\}$ and minimization of the hitting time $\tau$ on this set. * $\circ$ Consider $r(x,a)=\boldsymbol{1}_{O}(x)-\boldsymbol{1}_{X\smallsetminus K}(x)$. This leads to the expected total reward until escape from $K\smallsetminus O$ as $V^{(3)}(\pi,x)\mathrel{\mathop{:}\\!\\!=}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\bigl{(}\boldsymbol{1}_{O}(x_{t})-\boldsymbol{1}_{X\smallsetminus K}(x_{t})\bigr{)}\Biggr{]}=\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})-\mathsf{P}^{\pi}_{x}(\tau^{\prime}<\tau).$ Since $\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})+\mathsf{P}^{\pi}_{x}(\tau^{\prime}<\tau)=1$, maximization of $V^{(3)}$ over admissible policies maximizes the probability of the event $\\{\tau<\tau^{\prime}\\}$. Thus, maximizing $V^{(3)}(\pi,x)$ over $\pi\in\Pi$ is a different formulation of the objective of our problem ((2.6)). The above analysis also shows that the same objective results if we take the reward-per-stage function to be $\boldsymbol{1}_{O}(x)-\gamma\boldsymbol{1}_{X\smallsetminus K}(x)$ for any $\gamma\geqslant 0$. * $\circ$ Suppose that $\tau\wedge\tau^{\prime}$ is integrable for all admissible policies and consider the reward-per-stage $r(x,a)=\boldsymbol{1}_{K\smallsetminus O}(x)$. Let $V^{(4)}(\pi,x)\mathrel{\mathop{:}\\!\\!=}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{K\smallsetminus O}(x_{t})\Biggr{]}.$ Maximization of $V^{(4)}$ over admissible policies leads to large values of $\tau\wedge\tau^{\prime}$ on an average. This is a form of safety problem, the state stays inside $K\smallsetminus O$ for as long as possible on an average. * $\circ$ Suppose that $\tau\wedge\tau^{\prime}$ is integrable for all admissible policies and consider $r(x,a)=\gamma\boldsymbol{1}_{O}(x)-\boldsymbol{1}_{K\smallsetminus O}(x)$ for $\gamma\geqslant 1$. Consider $V^{(5)}(\pi,x)\mathrel{\mathop{:}\\!\\!=}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\bigl{(}\gamma\boldsymbol{1}_{O}(x_{t})-\boldsymbol{1}_{K\smallsetminus O}(x_{t})\bigr{)}\Biggr{]},$ we see that $V^{(5)}(\pi,x)=\gamma\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})-\mathsf{E}^{\pi}_{x}[\tau\wedge\tau^{\prime}]$. We see that maximization of $V^{(5)}$ over admissible policies leads to a balance between maximizing the probability that the state hits the set $O$ before getting out of $K$ and exiting $K$ quickly. This is because it is more profitable to exit from $K$ and get a zero reward than incur negative reward by prolonging the duration of stay in $K\smallsetminus O$. The factor $\gamma$ decides the priorities of the two alternatives. It is trivially clear that $\gamma=1$ leads to rapid exit from $K$ if the initial condition is in $K\smallsetminus O$. Not all the reward-per-stage functions mentioned above can be handled in our present framework. In particular, we make the crucial assumption that the reward-per-stage function is nonnegative, which does not hold in some of the cases above. However, under appropriate growth-rate conditions on the reward- per-stage function, the nonnegativity assumption can be dispensed with. In classical finite or infinite-horizon optimal control problems a translation of the (fixed) reward-per-stage function would not change the solution to the problem. However, translations of the reward-per-stage function in random- horizon problems may lead to drastically different policies. We give two examples: * $\circ$ Consider the reward-per-stage functions $r^{\prime}(x,a)=\boldsymbol{1}_{O}(x)-\boldsymbol{1}_{X\smallsetminus K}(x)$ and $r^{\prime\prime}(x,a)=2\cdot\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)$; in this case we translate $r^{\prime}$ on $X$ by $1$, i.e., $r^{\prime\prime}=r^{\prime}+1$. On the one hand, maximizing $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}r^{\prime}(x_{t},a_{t})\bigr{]}$ yields a policy that $\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})$ as we have seen before (this is $V^{(3)}$ above). On the other hand, maximizing $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}r^{\prime\prime}(x_{t},a_{t})\bigr{]}$ yields a policy that tries to keep the state in $K\smallsetminus O$ for as long as possible, and at each stage accrue a reward of $1$, which is certainly better than jumping to $O$ and accruing a reward of $2$ at most. * $\circ$ Consider $r^{\prime}(x,a)=\boldsymbol{1}_{O}(x)-\boldsymbol{1}_{X\smallsetminus K}(x)$ and $r^{\prime\prime}(x,a)=-\boldsymbol{1}_{O}(x)-3\cdot\boldsymbol{1}_{X\smallsetminus K}(x)$; in this case we translate $r^{\prime}$ by $-2$ only on its support $O\cup(X\smallsetminus K)$. We have noted above that maximizing $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}r^{\prime}(x_{t},a_{t})\bigr{]}$ yields a policy that maximizes $\mathsf{P}^{\pi}_{x}(\tau<\tau^{\prime})$. However, maximizing $\mathsf{E}^{\pi}_{x}\bigl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}r^{\prime\prime}(x_{t},a_{t})\bigr{]}$ yields a policy that tries to keep the state in $K\smallsetminus O$ for the longest possible duration to avoid incurring negative reward. ### 3.2. Further examples For one-dimensional stochastic processes initialized somewhere between two different levels $a$ and $b$, problems such as calculating the probability of hitting the level $a$ before the level $b$ are fairly common, e.g., in random walks, Brownian motion, and diffusions, see, e.g., [Levin et al., 2009, Chapters 2-3], [Revuz and Yor, 1999]. It is possible to obtain explicit expressions of these probabilities in a handful of cases. Let us consider a controlled Markov chain $(x_{t})_{t\in\mathbb{N}_{0}}$ with a finite state-space $X=\\{1,2,\ldots,m\\}$ and a transition probability matrix $Q=[q_{ij}(a)]_{m\times m}$, where $a$ is the action or control variable. Let $O\subsetneqq X$, $K\subsetneqq X$ be subsets of $X$ with $O\subsetneqq K$. Since $X$ is finite, Assumption (2.9) is satisfied. Consider the problem ((2.6)) in the context of this Markov chain $(x_{t})_{t\in\mathbb{N}_{0}}$ initialized at some $i_{0}\in K\smallsetminus O$. By Theorem (2.10) the optimal value function $V^{\star}$ must satisfy the equation $\displaystyle V^{\star}(i)$ $\displaystyle=\boldsymbol{1}_{O}(i)+\boldsymbol{1}_{K\smallsetminus O}(i)\max_{a\in A(i)}\sum_{j\in K}q_{ij}(a)V^{\star}(j)$ $\displaystyle=\boldsymbol{1}_{O}(i)+\boldsymbol{1}_{K\smallsetminus O}(i)\max_{a\in A(i)}\Biggl{(}\sum_{j\in O}q_{ij}(a)+\sum_{j\in K\smallsetminus O}q_{ij}(a)V^{\star}(j)\Biggr{)}$ for all $i\in X$. If the control actions are finite in number, searching for a maximizer over an enumerated list all control actions corresponding to each of the states may be possible if the state and action spaces are not too large. However, the memory requirement for storing such enumerated lists clearly increases exponentially with the dimension of the state and action spaces if the Markov chain is extracted by a discretization procedure based on a grid on the state-space of a discrete-time Markov process evolving, for example, on a subset of Euclidean space. As an alternative, it is possible to search for a maximizer from a parametrized family of functions (vectors) by applying well- known suboptimal control strategies [Bertsekas, 2007, Chapter 6], [Bertsekas and Tsitsiklis, 1996; Powell, 2007]. Note that in the case of an uncontrolled Markov chain the equation above reduces to $V^{\star}(i)=\boldsymbol{1}_{O}(i)+\boldsymbol{1}_{K\smallsetminus O}(i)\bigl{(}\sum_{j\in O}q_{ij}+\sum_{j\in K\smallsetminus O}q_{ij}V^{\star}(j)\bigr{)}$, and can be solved as a linear equation on $K\smallsetminus O$ for the vector $V^{\star}|_{K\smallsetminus O}$. Thus, solving for $V^{\star}$ yields a method of calculating the probability of hitting $O$ before hitting $X\smallsetminus K$ in uncontrolled Markov chains, and can serve as a verification tool [Kwiatkowska et al., 2007]. In certain cases of uncountable state-space Markov chains the policies and value functions corresponding to maximization of $\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<n\bigr{)}$ can be explicitly calculated for small values of $n$. As an illustration, consider a scalar linear controlled system ((3.3)) $x_{t+1}=x_{t}+a_{t}+w_{t},\quad x_{0}=x,\;\;t\in\mathbb{N}_{0}.$ Here $x_{t}\in\mathbb{R}$ is the state of the system at time $t$, $a_{t}$ is the action or control at time $t$ taking values in $[-1,1]$, and $(w_{t})_{t\in\mathbb{N}_{0}}$ is a sequence of independent and identically distributed (i.i.d) standard normal random variables treated as noise inputs to the system. Let us suppose that our target set is $O=\;]-1,1[$, safe set is $K=[-3,3]$, and let us find a greedy policy for our problem, i.e., a policy that maximizes $\mathsf{P}^{\pi}_{x}\bigl{(}\tau<\tau^{\prime},\tau<2\bigr{)}$. The greedy policy tries to maximize $\mathsf{P}_{x}\bigl{(}x_{1}\in\;]-1,1[\bigr{)}=\mathsf{P}_{x}\bigl{(}x+a+w\in\;]-1,1[\bigr{)}=\mathfrak{N}(1-x-a)-\mathfrak{N}(-1-x-a)=:G(x,a)$, where $\mathfrak{N}$ is the cumulative distribution function of the standard normal random variable. The function $G$ can be expressed in terms of the complementary error function444Recall that the complementary error function is defined as $\operatorname{erfc}(r)\mathrel{\mathop{:}\\!\\!=}\frac{2}{\sqrt{\pi}}\int_{r}^{\infty}\mathrm{e}^{-t^{2}}\mathrm{d}t=1-\operatorname{erf}(r)$, where $\operatorname{erf}(\cdot)$ is the standard error function. as $G(x,a)=\frac{1}{2}\Bigl{(}\operatorname{erfc}\bigl{(}-\frac{1}{\sqrt{2}}(1-x-a)\bigr{)}-\operatorname{erfc}\bigl{(}-\frac{1}{\sqrt{2}}(-1-x-a)\bigr{)}\Bigr{)}$, and $\operatorname{arg\,max}_{a\in[-1,1]}G(x,a)$ can be solved in closed form. Indeed, $\tfrac{\partial G}{\partial a}(x,a)=\frac{1}{\sqrt{2\pi}}\bigl{(}\mathrm{e}^{-\frac{1}{2}(x+a+1)^{2}}-\mathrm{e}^{-\frac{1}{2}(x+a-1)^{2}}\bigr{)}=0$ gives $a^{\star}=f_{\star}(x)=-x$ as the unconstrained optimizer. Since $a\in[-1,1]$, we have the constrained maximizer as $f_{\star}(x)=-\operatorname{sat}(x)$, where $\operatorname{sat}(\cdot)$ is the standard saturation function.555Recall that the standard saturation function is defined as $\operatorname{sat}(r)$ equals $r$ if $\left\lvert{r}\right\rvert<1$, $1$ if $r\geqslant 1$ and $-1$ otherwise. In other words, we get a bang-bang controller since $x-\operatorname{sat}(x)\neq 0$ on the interior of $K\smallsetminus O$. It is easy to discern the maximizer from the accompanying figure. The corresponding maximal probability is found by substituting the above optimizer back into the dynamic programming equation, and this yields $V_{1}^{\star}(x)=\boldsymbol{1}_{O}(x)+\frac{1}{2}\boldsymbol{1}_{K\smallsetminus O}(x)\Bigl{(}\operatorname{erf}\bigl{(}\frac{1}{\sqrt{2}}(x-\operatorname{sat}(x)+1)\bigr{)}-\operatorname{erf}\bigl{(}\frac{1}{\sqrt{2}}(x-\operatorname{sat}(x)-1)\bigr{)}\Bigr{)}$. For $n=3$ it turns out that we can no longer compute the optimizer corresponding to the first stage in closed form; the optimizer for the second stage is, of course, $f_{\star}(x)=-\operatorname{sat}(x)$ calculated above. It is also evident from the accompanying figure that even in this simple example there will arise nontrivial issues with nonconvexity for $n\geqslant 3$. ### 3.3. Uniqueness of optimal policies So far in our discussion we have not addressed the issue of uniqueness of the optimal policy in our problem ((2.6)). (Theorem (2.10) shows that an optimal policy exists, so the uniqueness question is meaningful.) It becomes clear from considerations of the geometry of the sets $O$ and $K$ in simple examples that the optimal controller $f_{\star}$ in Theorem (2.10)_(ii)_ is nonunique in general. For instance, consider the linear system considered in ((3.3)) above with initial condition $x_{0}=0$, and let $O=\;]-2,-1[\;\cup\;]1,2[$ and $K=[-3,3]$. Since the noise is symmetric about the origin, from symmetry considerations it immediately follows that the optimal controller $f_{\star}$ is nonunique at the origin. Note that $f_{\star}$ is, of course, defined on $K\smallsetminus O$. ### 3.4. Relation to a probabilistic safety problem Let us digress a little and consider the following probabilistic safety problem: maximize the probability that the state remains inside a safe set $C\subseteq X$ for $n$ stages, beginning from an initial condition $x\in C$. This, as mentioned earlier, is the probabilistic safety problem addressed in [Abate et al., 2008]. Of course the probability of staying inside $C$ for the first $n$ stages is given by $\mathsf{P}^{\pi}_{x}\bigl{(}\bigcap_{t=0}^{n-1}\\{x_{t}\in C\\}\bigr{)}=\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=0}^{n-1}\boldsymbol{1}_{\\{x_{t}\in C\\}}\bigr{]}$. If $\sigma$ is the first exit time from $C$, then $\mathsf{P}^{\pi}_{x}\bigl{(}\bigcap_{t=0}^{n-1}\\{x_{t}\in C\\}\bigr{)}=\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=0}^{(\sigma-1)\wedge(n-1)}\boldsymbol{1}_{\\{x_{t}\in C\\}}\bigr{]}$. Therefore, in this particular problem there is no difference between the maximal values of $\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=0}^{n-1}\boldsymbol{1}_{\\{x_{t}\in C\\}}\bigr{]}$ or $\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=0}^{(\sigma-1)\wedge(n-1)}\boldsymbol{1}_{\\{x_{t}\in C\\}}\bigr{]}$. However, the policies arising from the two different maximizations are quite unlike each other. Indeed, whereas the former yields a deterministic Markov policy [Abate et al., 2008] whose every element is defined on all of $X$, the stopping time version yields a deterministic Markov policy whose $t$-th element $\pi_{t}$ is defined on the set $\\{t<\sigma\wedge n\\}$, just as discussed in paragraph (2.7). On the one hand note that the reward in the former case is not affected by further application of the control actions once the state has exited the safe set $C$; the policy resulting from this formulation, however, dictates that the control actions are carried out until (and including) the $(n-2)$-th stage nonetheless. On the other hand, the reward in the latter stopping time version saturates at the stage the state leaves $C$ and future control actions are not defined. It is interesting to note that the Bellman equation developed for probabilistic safety and reachability in [Abate et al., 2008] may be obtained as a special case of ((2.11)) in Theorem (2.10) above. This comes as no surprise. The problem of maximizing the probability of staying inside a (measurable) safe set $C\subseteq X$ for $N$ steps is given by the maximization of $\mathsf{E}^{\pi}_{x}\bigl{[}\prod_{t=0}^{\sigma\wedge(N-1)}\boldsymbol{1}_{C}(x_{t})\bigr{]}$, where $\sigma$ is the first time to exit $C$ and this clearly translates to minimizing $\mathsf{P}^{\pi}_{x}(\tau<N)$. In our setting, if we let $K$ be the entire state-space $X$, $C=X\smallsetminus O$, and $\tau$ the first time to hit the set $O$, then our problem ((2.6)) is precisely that in [Abate et al., 2008] with the exception of maximization in place of minimization. It must be mentioned however, that the analysis carried out in [Abate et al., 2008] relies on the approach in [Bertsekas and Shreve, 1978] and is purely analytical; the strong Feller assumption on the transition kernel in our formulation plays no role there. ## 4\. Proofs This section collects the proofs of the various results in §2. ### 4.1. Proof of Theorem ((2.10)) We recall a few standard results about set-valued maps first, followed by sequence of lemmas before getting to the proof of Theorem (2.10). The various definitions in paragraphs (2.7), (2.8), and (2.13) will be employed without further reference. Just as in §2.2, for the purposes of this subsection, we let $\Pi_{M}$ denote the set of admissible Markov policies such that $\pi_{t}$ is defined on $\mathbb{K}$ whenever $(\pi_{t})_{t\in\mathbb{N}_{0}}\in\Pi_{M}$. ###### (4.1) Proposition ([Aliprantis and Border, 2006, Lemma 17.30]). Let $\Psi:X\longrightarrow\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\to{\;}Y$ be an upper hemicontinuous set-valued map between topological spaces with nonempty compact values, and let $f:\mathop{Graph}(\Psi)\longrightarrow\mathbb{R}$ be upper semicontinuous.666Recall that $\mathop{Graph}(\Psi)$ is the set $\bigl{\\{}(x,\Psi(x))\,\big{|}\,x\in X\bigr{\\}}\subseteq X\times Y$, the graph of the set-valued map $\Psi$. Define the function $m:X\longrightarrow\mathbb{R}$ by $m(x)\mathrel{\mathop{:}\\!\\!=}\max_{y\in\Psi(x)}f(x,y)$. Then the function $m$ is upper semicontinuous. ###### (4.2) Proposition ([Aliprantis and Border, 2006, Theorem 18.19]). Let $X$ be a separable metrizable space and $(S,\Sigma)$ a measurable space. Let $\Psi:S\longrightarrow\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\to{\;}X$ be a weakly measurable correspondence with nonempty compact values, and suppose $f:S\times X\longrightarrow\mathbb{R}$ is a Carathéodory function.777Recall that a Carathéodory function $f:S\times X\longrightarrow Y$ is a mapping that is measurable in the first variable and continuous in the second, where $(S,\Sigma)$ is a measurable space and $X,Y$ are topological spaces. In particular, if $X$ is a separable and metrizable space, and $Y$ is a metrizable space, every Carathéodory function $f:S\times X\longrightarrow Y$ is jointly measurable [Aliprantis and Border, 2006, Lemma 4.51]; this is clearly true in the Carathéodory functions we consider. Let us also define the function $m:S\longrightarrow\mathbb{R}$ by $m(s)\mathrel{\mathop{:}\\!\\!=}\max_{x\in\Psi(s)}f(s,x)$, and the correspondence $\mu:S\longrightarrow\\!\\!\\!\\!\\!\\!\\!\\!\\!\\!\to{\;}X$ of maximizers by $\mu(s)\mathrel{\mathop{:}\\!\\!=}\bigl{\\{}x\in\Psi(s)\,\big{|}\,f(s,x)=m(s)\bigr{\\}}$. Then the argmax correspondence $\mu$ is measurable and admits a measurable selector. ###### (4.3) Definition. For $u\in b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$ we define the mapping $Tu$ ((4.4)) $X\ni x\longmapsto Tu(x)\mathrel{\mathop{:}\\!\\!=}\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\sup_{a\in A(x)}\int_{K}Q(\mathrm{d}y|x,a)u(y)\in\mathbb{R}_{\geqslant 0}.$ The operator $T$ is called the _dynamic programming operator_ corresponding to the problem ((2.6)). $\Diamond$ ###### (4.5) Lemma. Suppose that Assumption ((2.9)) holds. Then the dynamic programming operator $T$ defined in ((4.4)) takes $b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$ into itself. Moreover, there exists a measurable selector $f\in\mathbb{F}$ such that ((4.6)) $Tu(x)=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f)u(y)\quad\forall\,x\in X.$ ###### Proof. Fix $u\in b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$. Since the transition kernel $Q$ is strongly Feller on $\mathbb{K}$, the mapping $\mathbb{K}\ni(x,a)\longmapsto S(x,a)\mathrel{\mathop{:}\\!\\!=}\int_{X}Q(\mathrm{d}y|x,a)\boldsymbol{1}_{K}(y)u(y)\in\mathbb{R}_{\geqslant 0}$ is continuous on $\mathbb{K}$. Also, $S(x,a)$ is bounded whenever $u$ is, a bound of $S$ being the essential supremum norm of $u$. Therefore, since $A(x)$ is compact for each $x\in X$, the function $S^{\star}(x)\mathrel{\mathop{:}\\!\\!=}\sup_{a\in A(x)}S(x,a)$ is well- defined on $K\smallsetminus O$, i.e., the sup is attained on $A(x)$ for $x\in K\smallsetminus O$. We also note that since $K\smallsetminus O$ is a measurable set, by Assumption (2.9) * $\circ$ the correspondence $K\smallsetminus O\ni x\longmapsto A(x)\subseteq A$ is upper hemicontinuous, and since $S$ is continuous on $\mathbb{K}$, the map $K\smallsetminus O\ni x\longmapsto S^{\star}(x)\mathrel{\mathop{:}\\!\\!=}\max_{a\in A(x)}S(x,a)\in\mathbb{R}_{\geqslant 0}$ is an u.s.c. function by Proposition (4.1); * $\circ$ the correspondence $K\smallsetminus O\ni x\longmapsto A(x)\subseteq A$ is weakly measurable, and since $S$ is continuous on $\mathbb{K}$ (and therefore is a Carathéodory function), there exists a measurable selector $f\in\mathbb{F}$ such that $S^{\star}(x)=S(x,f(x))$ for all $x\in K\smallsetminus O$ by Proposition (4.2). It follows at once that $X\ni x\longmapsto Tu(x)=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f(x))u(y)\in\mathbb{R}_{\geqslant 0}$ is a member of the set $b\mathfrak{B}\\!\left(X\right)^{+}$, and the assertion follows. ∎ ###### (4.7) Lemma. Suppose that hypotheses of Theorem ((2.10)) hold. If $u\in b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$ satisfies the inequality $u\leqslant Tu$ pointwise on $X$, then also $u\leqslant V^{\star}$ pointwise on $X$, where $T$ is the dynamic programming operator in ((4.4)). ###### Proof. By definition of $T$ it is clear that we only need to examine the validity of the assertion on $K\smallsetminus O$. Suppose that $u\in b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$ satisfies the inequality $u\leqslant Tu$ pointwise on $X$. By Lemma (4.5) we know that there exists $f\in\mathbb{F}$ satisfying $Tu(x)=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f)u(y)\quad\forall\,x\in K\smallsetminus O.$ A straightforward calculation shows that if $u\leqslant Tu$ then $Tu\leqslant T\circ Tu$ on $K\smallsetminus O$. Fix $x\in K\smallsetminus O$. Applying the inequality $u\leqslant Tu$ repeatedly we have $\displaystyle u(x)$ $\displaystyle\leqslant\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}\xi_{1}|x,f)u(\xi_{1})$ $\displaystyle\leqslant\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}\xi_{1}|x,f)\biggl{[}\boldsymbol{1}_{O}(\xi_{1})+\boldsymbol{1}_{K\smallsetminus O}(\xi_{1})\int_{K}Q(\mathrm{d}\xi_{2}|\xi_{1},f)u(\xi_{2})\biggr{]}$ $\displaystyle\cdots$ and after $n$ steps $\displaystyle u(x)$ $\displaystyle\leqslant\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}\xi_{1}|x,f)\biggl{[}\boldsymbol{1}_{O}(\xi_{1})+\ldots$ $\displaystyle\qquad\qquad\ldots+\boldsymbol{1}_{K\smallsetminus O}(\xi_{n-2})\int_{K}Q(\mathrm{d}\xi_{n-1}|\xi_{n-2},f)\biggl{[}\boldsymbol{1}_{O}(\xi_{n-1})$ $\displaystyle\qquad\qquad\qquad\qquad\qquad+\boldsymbol{1}_{K\smallsetminus O}(\xi_{n-1})\int_{K}Q(\mathrm{d}\xi_{n}|\xi_{n-1},f)u(\xi_{n})\biggr{]}\cdots\biggr{]}$ $\displaystyle=\Biggl{(}\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}\xi_{1}|x,f)\biggl{[}\boldsymbol{1}_{O}(\xi_{1})+\ldots$ $\displaystyle\qquad\qquad\ldots+\boldsymbol{1}_{K\smallsetminus O}(\xi_{n-2})\int_{O}Q(\mathrm{d}\xi_{n-1}|\xi_{n-2},f)\biggr{]}\Biggr{)}$ $\displaystyle\quad+\Biggl{(}\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K\smallsetminus O}Q(\mathrm{d}\xi_{1}|x,f)\int_{K\smallsetminus O}Q(\mathrm{d}\xi_{2}|\xi_{1},f)\cdots\int_{K}Q(\mathrm{d}\xi_{n}|\xi_{n-1},f)u(\xi_{n})\Biggr{)}.$ We claim that the right-hand side of the last equality above is $\mathsf{E}^{f^{\infty}}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}+\mathsf{E}^{f^{\infty}}_{x}\Bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot u)(x_{n\wedge\tau\wedge\tau^{\prime}})\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\Bigr{]},$ where $\boldsymbol{1}_{K}\cdot u(\xi)\mathrel{\mathop{:}\\!\\!=}\boldsymbol{1}_{K}(\xi)u(\xi)$ for $\xi\in X$. To see this note that the first term is clear by definition. The second term above is due to the fact that only those trajectories that stay in $K\smallsetminus O$ for $n$ steps (i.e., from stage $0$ through stage $n-1$) contribute to the integrand that features $u$, and this accounts for the factor $\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})$. Since $\\{\tau\wedge\tau^{\prime}<\infty\\}$ is a full measure set, the factor $\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}$ does not change the value of the integral. Taking the limit of the first term above as $n\to\infty$, the monotone convergence theorem gives $\lim_{n\to\infty}\mathsf{E}^{f^{\infty}}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=\mathsf{E}^{f^{\infty}}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=V(f^{\infty},x)\leqslant V^{\star}(x),$ where the last inequality follows from the definition of $V^{\star}$. Since $u$ is bounded and nonnegative, taking the limit of the second term above as $n\to\infty$, the dominated convergence theorem gives $\displaystyle\lim_{n\to\infty}$ $\displaystyle\mathsf{E}^{f^{\infty}}_{x}\Bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot u)(x_{n\wedge\tau\wedge\tau^{\prime}})\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\Bigr{]}$ $\displaystyle=\mathsf{E}^{f^{\infty}}_{x}\Bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot u)(x_{\tau\wedge\tau^{\prime}})\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\Bigr{]}$ $\displaystyle=0$ since $\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}})=0$ on the set $\\{\tau\wedge\tau^{\prime}<\infty\\}$ by definition of the stopping times $\tau$ and $\tau^{\prime}$. Substituting back we see that $u(x)\leqslant V^{\star}(x)$, and the assertion follows since $x\in K\smallsetminus O$ is arbitrary. ∎ ###### (4.8) Lemma. Suppose that Assumption ((2.9)) holds. Then the value iteration functions $(v_{n})_{n\in\mathbb{N}_{0}}$ defined in ((3.2)) satisfy $v_{n}\uparrow V^{\star}$, and the function $V^{\star}$ satisfies the Bellman equation ((2.11)). ###### Proof. From the definition of the value-iteration functions $(v_{n})_{n\in\mathbb{N}_{0}}$ in ((3.2)) we see that $(v_{n})_{n\in\mathbb{N}_{0}}$ is a monotone increasing sequence bounded above by $\boldsymbol{1}_{X}$. Therefore there exists a measurable function $v^{\star}:X\longrightarrow[0,1]$ such that $v_{n}\uparrow v^{\star}$ pointwise on $X$. By definition of $v_{n}$ we have $\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}\leqslant\sup_{\pi\in\Pi_{M}}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=v_{n}(x),$ and the monotone convergence theorem shows that $v^{\star}(x)=\lim_{n\to\infty}v_{n}(x)\geqslant\lim_{n\to\infty}\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=\mathsf{E}^{\pi}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}=V(\pi,x).$ Taking the supremum over $\pi\in\Pi_{M}$ on the right-hand side shows that $v^{\star}\geqslant V^{\star}$ pointwise on $X$. Note that $v_{n}|_{O}=1$ and $v_{n}|_{X\smallsetminus K}=0$ for all $n$; therefore $v^{\star}|_{O}=1$ and $v^{\star}|_{X\smallsetminus K}=0$. Let us define the maps $\displaystyle\mathbb{K}\ni(x,a)\longmapsto T^{\prime}v_{n}(x,a)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\int_{K}Q(\mathrm{d}y|x,a)v_{n}(y)\in[0,1],$ $\displaystyle\mathbb{K}\ni(x,a)\longmapsto T^{\prime}v^{\star}(x,a)$ $\displaystyle\mathrel{\mathop{:}\\!\\!=}\int_{K}Q(\mathrm{d}y|x,a)v^{\star}(y)\in[0,1].$ We note that the transition kernel $Q$ is strongly Feller by Assumption (2.9), and therefore $T^{\prime}v_{n},n\in\mathbb{N}_{0}$ and $T^{\prime}v^{\star}$ are continuous functions on $\mathbb{K}$. Moreover, for all $n\in\mathbb{N}_{0}$ we define ((4.9)) $\displaystyle T^{\prime}v_{n}(x,a)$ $\displaystyle=T^{\prime}v^{\star}(x,a)=1\quad\text{for $x\in O$ and $a\in A(x)$},$ $\displaystyle T^{\prime}v_{n}(x,a)$ $\displaystyle=T^{\prime}v^{\star}(x,a)=0\quad\text{for $x\in X\smallsetminus K$ and $a\in A(x)$},$ Since $v_{n}\uparrow v^{\star}$ pointwise on $X$, it follows from the definitions above and the monotone convergence theorem that for all $x\in X$ and $a\in A(x)$ ((4.10)) $T^{\prime}v_{n}(x,a)\boldsymbol{1}_{K\smallsetminus O}(x)\uparrow T^{\prime}v^{\star}(x,a)\boldsymbol{1}_{K\smallsetminus O}(x).$ Fix $x\in K\smallsetminus O$. Since $T^{\prime}v_{n}$ and $T^{\prime}v^{\star}$ are continuous functions on $\mathbb{K}$, for each $n\in\mathbb{N}_{0}$ both $\sup_{a\in A(x)}T^{\prime}v_{n}(x,a)$ and $\sup_{a\in A(x)}T^{\prime}v^{\star}(x,a)$ are attained on $A(x)$. From the definition of $(v_{n})_{n\in\mathbb{N}_{0}}$ in ((3.2)) we have $\max_{a\in A(x)}T^{\prime}v_{n}(x,a)\leqslant\max_{a\in A(x)}T^{\prime}v^{\star}(x,a)$ for all $n\in\mathbb{N}_{0}$. Also, $\bigl{(}\max_{a\in A(x)}T^{\prime}v_{n}(x,a)\bigr{)}_{n\in\mathbb{N}_{0}}$ is a nondecreasing sequence of numbers bounded above by $1$, and therefore it attains a limit. If this limit is strictly less than $\max_{a\in A(x)}T^{\prime}v^{\star}(x,a)$, standard easy arguments may be invoked to show that the sequence of continuous functions $\bigl{(}T^{\prime}v_{n}(x,\cdot)\bigr{)}_{n\in\mathbb{N}_{0}}$ cannot converge pointwise to $T^{\prime}v^{\star}(x,\cdot)$ on $A(x)$, which contradicts ((4.10)). It follows that whenever $x\in K\smallsetminus O$, $\displaystyle v^{\star}(x)$ $\displaystyle=\lim_{n\to\infty}v_{n}(x)=\lim_{n\to\infty}Tv_{n-1}(x)$ $\displaystyle=\lim_{n\to\infty}\max_{a\in A(x)}T^{\prime}v_{n-1}(x,a)=\max_{a\in A(x)}T^{\prime}v^{\star}(x,a)$ $\displaystyle=Tv^{\star}(x).$ Together with ((4.9)) this shows that $v^{\star}$ satisfies the Bellman equation ((2.11)) pointwise on $X$, i.e., $v^{\star}=Tv^{\star}$. We have already seen above that $v^{\star}\geqslant V^{\star}$ pointwise on $X$. Since $v^{\star}=Tv^{\star}$, the reverse inequality follows from Lemma (4.7). Therefore, we conclude that $v^{\star}=V^{\star}$ identically on $X$. ∎ ###### (4.11) Lemma. Let $f^{\infty}$ be a deterministic stationary policy. Then we have ((4.12)) $V(f^{\infty},x)=\begin{cases}1&\text{if }x\in O,\\\ \displaystyle{\int_{K}Q(\mathrm{d}y|x,f)V(f^{\infty},y)}&\text{if }x\in K\smallsetminus O,\\\ 0&\text{otherwise}.\end{cases}$ ###### Proof. For $x\in O\cup(X\smallsetminus K)$ the assertions are trivial. Fix $x\in K\smallsetminus O$. From the definition of $V(f^{\infty},x)$ we have $\displaystyle V(f^{\infty},x)$ $\displaystyle=\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}$ $\displaystyle=\mathsf{E}^{f^{\infty}}\Biggl{[}\boldsymbol{1}_{O}(x_{0})\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}=0\\}}+\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}>0\\}}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}$ $\displaystyle=\boldsymbol{1}_{O}(x)+\mathsf{E}^{f^{\infty}}\Biggl{[}\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}>0\\}}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}.$ Since $\\{\tau\wedge\tau^{\prime}>0\\}=\\{x_{0}\in K\smallsetminus O\\}$ and this event is $\mathfrak{F}_{0}$-measurable, $\mathsf{E}^{f^{\infty}}\Biggl{[}\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}>0\\}}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}=\boldsymbol{1}_{K\smallsetminus O}(x)\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}.$ Therefore, $\displaystyle V(f^{\infty},x)$ $\displaystyle=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=1}^{\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\,\Bigg{|}\,x_{0}=x\Biggr{]}$ $\displaystyle=\boldsymbol{1}_{O}(x)+\boldsymbol{1}_{K\smallsetminus O}(x)\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=1}^{\tau}\boldsymbol{1}_{O}(x_{t\wedge\tau\wedge\tau^{\prime}})\,\Bigg{|}\,x_{0}=x\Biggr{]}.$ Considering the fact that $V(f^{\infty},x)=0$ for $x\in X\smallsetminus K$ by definition, the Markov property shows that the second term on the right-hand side above equals $\displaystyle\boldsymbol{1}_{K\smallsetminus O}(x)$ $\displaystyle\mathsf{E}^{f^{\infty}}\Biggl{[}\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=1}^{\tau}\boldsymbol{1}_{O}(x_{t\wedge\tau\wedge\tau^{\prime}})\,\bigg{|}\,x_{1\wedge\tau\wedge\tau^{\prime}}\Biggr{]}\,\Bigg{|}\,x_{0}=x\Biggr{]}$ $\displaystyle=\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f)\mathsf{E}^{f^{\infty}}\Biggl{[}\sum_{t=1}^{\tau}\boldsymbol{1}_{O}(x_{t\wedge\tau\wedge\tau^{\prime}})\,\Bigg{|}\,x_{1\wedge\tau\wedge\tau^{\prime}}=y\Biggr{]}$ $\displaystyle=\boldsymbol{1}_{K\smallsetminus O}(x)\int_{K}Q(\mathrm{d}y|x,f)V(f^{\infty},y).$ Collecting the above equations we obtain ((4.12)), and this completes the proof. ∎ We are now ready for the proof of the first main result. ###### Proof of Theorem ((2.10)). (i) Note that by definition $V^{\star}$ is nonnegative. The fact that $V^{\star}$ satisfies the Bellman equation follows from Lemma (4.8). In view of the definition of $\bar{B}$ in Theorem (2.10) and Lemma (4.8) we conclude that $V^{\star}$ is minimal in $b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$ because $u=Tu$ pointwise on $K\smallsetminus O$ implies that $u\leqslant V^{\star}$ pointwise on $K\smallsetminus O$ for any $u\in b\mathfrak{B}\\!\left(X\right)^{+}\cap\bar{B}$. (ii) Lemma (4.5) guarantees the existence of a selector $f_{\star}\in\mathbb{F}$ such that ((2.12)) holds. Iterating the equality ((2.12)) (or ((2.14))) it follows as in the proof of Lemma (4.7) that for $x\in X$, $V^{\star}(x)=\mathsf{E}^{f_{\star}^{\infty}}_{x}\Biggl{[}\sum_{t=0}^{(n-1)\wedge\tau\wedge\tau^{\prime}}\boldsymbol{1}_{O}(x_{t})\Biggr{]}+\mathsf{E}^{f_{\star}^{\infty}}_{x}\bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{]}.$ Taking limits as $n\to\infty$ on the right, the monotone and dominated convergence theorems give $V^{\star}(x)=V(f_{\star}^{\infty},x)$. Since $x$ is arbitrary, $V^{\star}(\cdot)=V(f_{\star}^{\infty},\cdot)$ on $K\smallsetminus O$ and that $f_{\star}^{\infty}$ is an optimal policy. Conversely, by Lemma (4.11) it follows that under the stationary deterministic strategy $f_{\star}^{\infty}$ we have ((4.12)) with $f_{\star}$ in place of $f$, which is identical to ((2.12)).∎ ### 4.2. Proofs of the results in §2.3 For the purposes of this subsection we let $\Pi$ denote the set of admissible policies such that $\pi_{t}$ is defined on $\mathbb{K}$ whenever $(\pi_{t})_{t\in\mathbb{N}_{0}}\in\Pi$. ###### (4.13) Lemma. For every policy $\pi\in\Pi$ and initial state $x\in X$ the processes $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ and $\bigl{(}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}\cdot V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{)}_{n\in\mathbb{N}_{0}}$ are both nonnegative $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$\- supermartingales under $\mathsf{P}^{\pi}_{x}$. ###### Proof. It is clear that both processes are nonnegative and $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$-adapted. Fix $n\in\mathbb{N}$, an initial state $x\in X$, a policy $\pi\in\Pi$, and on the event $\\{\tau\wedge\tau^{\prime}>n\\}$ fix a history $h_{n}=\bigl{(}x,a_{0},x_{1},a_{1},\ldots,x_{n-1},a_{n-1},x_{n}\bigr{)}$. Let $a_{n}\mathrel{\mathop{:}\\!\\!=}\pi_{n}(h_{n})$ on $\\{\tau\wedge\tau^{\prime}>n\\}$. Then $\displaystyle\zeta_{n+1}$ $\displaystyle=W_{n+1}(\pi,x)+\boldsymbol{1}_{K\smallsetminus O}(x_{n\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}})$ $\displaystyle=W_{n}(\pi,x)+\boldsymbol{1}_{O}(x_{n\wedge\tau\wedge\tau^{\prime}})\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}=n\\}}+\boldsymbol{1}_{K\smallsetminus O}(x_{n\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}})$ $\displaystyle=W_{n}(\pi,x)+\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}=n\\}}\boldsymbol{1}_{O}(x_{n\wedge\tau\wedge\tau^{\prime}})+\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}>n\\}}(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}}).$ Since $\\{x_{n\wedge\tau\wedge\tau^{\prime}}\in O\\}\subseteq\\{\tau\wedge\tau^{\prime}=n\\}$, we have $\displaystyle\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}=n\\}}$ $\displaystyle\boldsymbol{1}_{O}(x_{n\wedge\tau\wedge\tau^{\prime}})+\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}>n\\}}(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}})$ $\displaystyle=\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}\geqslant n\\}}\bigl{(}\boldsymbol{1}_{O}(x_{n\wedge\tau\wedge\tau^{\prime}})+\boldsymbol{1}_{K\smallsetminus O}(x_{n\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}})\bigr{)}.$ Since $\\{\tau\wedge\tau^{\prime}\geqslant n\\}=\\{\tau\wedge\tau^{\prime}>n-1\\}=\\{x_{(n-1)\wedge\tau\wedge\tau^{\prime}}\in K\smallsetminus O\\}$, it follows that $\displaystyle\zeta_{n+1}=W_{n}(\pi,x)$ $\displaystyle+\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})\cdot$ $\displaystyle\bigl{(}\boldsymbol{1}_{O}(x_{n\wedge\tau\wedge\tau^{\prime}})+\boldsymbol{1}_{K\smallsetminus O}(x_{n\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{(n+1)\wedge\tau\wedge\tau^{\prime}})\bigr{)}.$ Therefore, keeping in mind the definition of $a_{n}$ above, $\displaystyle\mathsf{E}^{\pi}_{x}\bigl{[}\zeta_{n+1}\,\big{|}\,\mathfrak{F}_{n\wedge\tau\wedge\tau^{\prime}}\bigr{]}$ $\displaystyle=W_{n}(\pi,x)+\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})T^{\prime}V^{\star}(x_{n\wedge\tau\wedge\tau^{\prime}},a_{n})$ ((4.14)) $\displaystyle\leqslant W_{n}(\pi,x)+\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})V^{\star}(x_{n\wedge\tau\wedge\tau^{\prime}})$ $\displaystyle=\zeta_{n},$ where the inequality holds $\mathsf{P}^{\pi}_{x}$-almost surely. Therefore, the process $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ is a nonnegative $(\mathfrak{F}_{n\wedge\tau\wedge\tau^{\prime}})_{n\in\mathbb{N}_{0}}$\- supermartingale, and hence also a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$\- supermartingale. Considering that the sequence $\bigl{(}W_{n}(\pi,x)\bigr{)}_{n\in\mathbb{N}_{0}}$ is nondecreasing, from the definitions in ((2.15)) and the fact that the process $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ is a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$\- supermartingale we see that the process $\bigl{(}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{)}_{n\in\mathbb{N}_{0}}$ is also a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$\- supermartingale under $\mathsf{P}^{\pi}_{x}$. ∎ ###### Proof of Theorem ((2.17)). Lemma (4.13) confirms that both of the two adapted processes $(\zeta_{n})_{n\in\mathbb{N}_{0}}$ and $\bigl{(}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{)}_{n\in\mathbb{N}}$ converge almost surely and are nonincreasing in expectation, both under $\mathsf{P}^{\pi}_{x}$. Let $\Lambda^{\pi}(x)\mathrel{\mathop{:}\\!\\!=}\lim_{n\to\infty}\mathsf{E}^{\pi}_{x}[\zeta_{n}]$. We then have $\displaystyle V^{\star}(x)$ $\displaystyle=\mathsf{E}^{\pi}_{x}[\zeta_{0}]\geqslant\lim_{n\to\infty}\mathsf{E}^{\pi}_{x}[\zeta_{n}]$ ((4.15)) $\displaystyle=\lim_{n\to\infty}\Bigl{(}\mathsf{E}^{\pi}_{x}\bigl{[}W_{n}(\pi,x)\bigr{]}+\mathsf{E}^{\pi}_{x}\bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{(n-1)\wedge\tau\wedge\tau^{\prime}})(\boldsymbol{1}_{K}V^{\star})(x_{n\wedge\tau\wedge\tau^{\prime}})\bigr{]}\Bigr{)}$ $\displaystyle\geqslant V(\pi,x).$ The assertion is now an immediate consequence of (4.2).∎ ###### Proof of Theorem ((2.18)). Suppose that (i) holds. Since $\mathsf{E}^{\pi}_{x}[\zeta_{n}]$ is nonincreasing with $n$ it follows that $\mathsf{E}^{\pi}_{x}[\zeta_{n+1}]=\mathsf{E}^{\pi}_{x}[\zeta_{n}]=\ldots=\mathsf{E}^{\pi}_{x}[\zeta_{0}]=V^{\star}(x)$ for every $n\in\mathbb{N}$. Therefore, equality must hold $\mathsf{P}^{\pi}_{x}$-almost surely in (4.2), and (ii) follows. Suppose that (ii) holds. Then equality holds in (4.2) almost surely under $\mathsf{P}^{\pi}_{x}$, and therefore $\mathsf{P}^{\pi}_{x}$-almost everywhere on the set $\\{x_{n\wedge\tau\wedge\tau^{\prime}}\in K\smallsetminus O\\}=\\{\tau\wedge\tau^{\prime}>n\\}$ we have $T^{\prime}V^{\star}(x_{n},a_{n})=V^{\star}(x_{n})$, and (iii) follows. Suppose that (iii) holds. Then taking expectations in (4.2) we arrive at $\mathsf{E}^{\pi}_{x}[\zeta_{n+1}]=\mathsf{E}^{\pi}_{x}[\zeta_{n}]=\ldots=\mathsf{E}^{\pi}_{x}[\zeta_{0}]=V^{\star}(x)$. As a result we have $\Lambda^{\pi}(x)=V^{\star}(x)$, and (i) follows.∎ ###### Proof of Theorem ((2.19)). It follows readily from the definition of the stopping times $\tau$ and $\tau^{\prime}$ that the process $(\zeta^{\prime}_{n})_{n\in\mathbb{N}_{0}}$ defined in ((2.20)) is a bounded process, and by assumption it is a $(\mathfrak{F}_{n})_{n\in\mathbb{N}_{0}}$ -martingale under $\mathsf{P}^{\pi^{\star}}_{x}$. Doob’s Optional Sampling Theorem [Rao and Swift, 2006, Theorem 2, p. 422] applied to $(\zeta^{\prime}_{n})_{n\in\mathbb{N}_{0}}$ at the stopping time $\tau\wedge\tau^{\prime}$ gives us $\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\zeta^{\prime}_{\tau\wedge\tau^{\prime}}\bigr{]}=\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\zeta^{\prime}_{0}\bigr{]}=V^{\prime}(x),$ where the last equality follows from the definition of $\zeta^{\prime}_{0}$. From ((2.15)) we get $\displaystyle\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\zeta^{\prime}_{\tau\wedge\tau^{\prime}}\bigr{]}$ $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\Bigl{[}W_{\tau\wedge\tau^{\prime}-1}(\pi^{\star},x)+\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}-1})\bigl{(}\boldsymbol{1}_{K}\cdot V^{\prime}\bigr{)}(x_{\tau\wedge\tau^{\prime}})\Bigr{]}$ $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\Biggl{[}\sum_{t=0}^{\tau\wedge\tau^{\prime}-1}\boldsymbol{1}_{O}(x_{t})+\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}-1})\bigl{(}\boldsymbol{1}_{K}\cdot V^{\prime}\bigr{)}(x_{\tau\wedge\tau^{\prime}})\Biggr{]}$ $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\Bigl{[}\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}-1})\bigl{(}\boldsymbol{1}_{K}\cdot V^{\prime}\bigr{)}(x_{\tau\wedge\tau^{\prime}})\Bigr{]}.$ By definition of $\tau$ and $\tau^{\prime}$, $\boldsymbol{1}_{K\smallsetminus O}(x_{\tau\wedge\tau^{\prime}-1})$ equals $1$ on $\\{\tau\wedge\tau^{\prime}<\infty\\}$, and by our hypotheses the set $\\{\tau\wedge\tau^{\prime}<\infty\\}$ is a $\mathsf{P}^{\pi^{\star}}_{x}$-full-measure set. Continuing from the last equality above we arrive at $\displaystyle\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\zeta^{\prime}_{\tau\wedge\tau^{\prime}}\bigr{]}$ $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\Bigl{[}\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\bigl{(}\boldsymbol{1}_{K}\cdot V^{\prime}\bigr{)}(x_{\tau\wedge\tau^{\prime}})\Bigr{]}$ $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\bigl{(}\boldsymbol{1}_{\\{\tau<\tau^{\prime}\\}}\boldsymbol{1}_{K}(x_{\tau})V^{\prime}(x_{\tau})+\boldsymbol{1}_{\\{\tau>\tau^{\prime}\\}}\boldsymbol{1}_{K}(x_{\tau^{\prime}})V^{\prime}(x_{\tau^{\prime}})\bigr{)}\bigr{]}$ ((4.16)) $\displaystyle=\mathsf{E}^{\pi^{\star}}_{x}\bigl{[}\boldsymbol{1}_{\\{\tau\wedge\tau^{\prime}<\infty\\}}\boldsymbol{1}_{\\{\tau<\tau^{\prime}\\}}\bigr{]}$ $\displaystyle=\mathsf{P}^{\pi^{\star}}_{x}\bigl{(}\tau<\tau^{\prime},\tau<\infty\bigr{)},$ where the equality in ((4.16)) follows from the assumptions on $V^{\prime}$ and the definitions of $\tau$ and $\tau^{\prime}$. Collecting the equations above we get $V^{\prime}(x)=\mathsf{P}^{\pi^{\star}}_{x}\bigl{(}\tau<\tau^{\prime},\tau<\infty\bigr{)}$ as asserted.∎ It is of interest to note that the hypotheses of Theorem (2.19) requires at least one of the stopping times $\tau$ or $\tau^{\prime}$ to be finite. Let us examine the case of $\tau\wedge\tau^{\prime}$ being $\infty$ on a set of positive probability. Following the proof of Theorem (2.19), we see that in this case we have to agree on the value of $V^{\prime}(x_{\tau\wedge\tau^{\prime}})$ on $\\{\tau\wedge\tau^{\prime}=\infty\\}$. If $\lim_{n\to\infty}V^{\prime}_{n}(\pi^{\star},x)$ exists, then we can always let $V^{\prime}(x_{\tau\wedge\tau^{\prime}})$ take this value on the set $\\{\tau\wedge\tau^{\prime}=\infty\\}$. However, the context of the problem offers another alternative, namely, to set $V^{\prime}(x_{\tau\wedge\tau^{\prime}})=0$ on $\\{\tau\wedge\tau^{\prime}=\infty\\}$. This is because if $x_{t}\in K\smallsetminus O$ for all $t\in\mathbb{N}_{0}$, then the value of $x_{\tau\wedge\tau^{\prime}}$ is of no consequence at all. ## 5\. Conclusions and Future Work The purpose of this article was to present a dynamic programming based solution to the problem of maximizing the probability of attaining a target set before hitting a cemetery set, and furnish an alternative martingale characterization of optimality in terms of thrifty and equalizing policies. Several related problems of interest were sketched in §3.1. Some of these problems do not admit an immediate solution in the dynamic programming framework we established here because of our central assumption that the cost- per-stage function is nonnegative. This issue deserves further investigation. The results in this article also provide clear indications to the possibility of developing verification tools for probabilistic computation tree logic [Kwiatkowska et al., 2007] in terms of dynamic programming operators. This matter is under investigation and will be reported in [Ramponi et al., 2009]. Implementation of the dynamic-programming algorithm in this article is challenging due to integration over subsets of the state-space, and suboptimal policies are needed. In this context development of a possible connection with ‘greedy-time-optimal’ policies [Meyn, 2008, Chapters 4, 7], originally proposed as a tractable alternative to optimal policies in demand-driven large-scale production systems, is being sought. ## Acknowledgement The authors thank Onésimo Hernández-Lerma for helpful suggestions and pointers to references, and Sean Summers for posing the problem. ## References * Abate et al. [2008] Abate, A., Prandini, M., Lygeros, J., Sastry, S., 2008. Probabilistic reachability and safety for controlled discrete time stochastic hybrid systems. Automatica 44 (11), 2724–2734. * Aliprantis and Border [2006] Aliprantis, C., Border, K. C., 2006. Infinite Dimensional Analysis: a Hitchhiker’s Guide, 3rd Edition. Springer-Verlag, Berlin. * Bertsekas and Tsitsiklis [1996] Bertsekas, D., Tsitsiklis, J., 1996. Neuro-Dynamic Programming. Athena Scientific. * Bertsekas [2007] Bertsekas, D. P., 2007. Dynamic Programming and Optimal Control, 3rd Edition. Vol. 2. Athena Scientific. * Bertsekas and Shreve [1978] Bertsekas, D. P., Shreve, S. E., 1978. Stochastic Optimal Control: the Discrete-Time Case. Vol. 139 of Mathematics in Science and Engineering. Academic Press Inc. [Harcourt Brace Jovanovich Publishers], New York. * Boda et al. [2004] Boda, K., Filar, J. A., Lin, Y., Spanjers, L., 2004. Stochastic target hitting time and the problem of early retirement. IEEE Transactions on Automatic Control 49 (3), 409–419. * Borkar [1988] Borkar, V. S., 1988. A convex analytic approach to Markov decision processes. Probabability Theory and Related Fields 78 (4), 583–602. * Borkar [1991] Borkar, V. S., 1991. Topics in Controlled Markov Chains. Vol. 240 of Pitman Research Notes in Mathematics Series. Longman Scientific & Technical, Harlow. * Bouakiz and Kebir [1995] Bouakiz, M., Kebir, Y., 1995. Target-level criterion in markov decision processes. Journal of Optimization Theory and Applications 86 (1), 1–15. * Chatterjee et al. [2008] Chatterjee, D., Cinquemani, E., Chaloulos, G., Lygeros, J., 2008. Stochastic control up to a hitting time: optimality and rolling-horizon implementation. http://arxiv.org/abs/0806.3008. * Derman [1970] Derman, C., 1970. Finite State Markovian Decision Processes. Vol. 67 of Mathematics in Science and Engineering. Academic Press, New York. * Digaĭlova and Kurzhanskiĭ [2004] Digaĭlova, I. A., Kurzhanskiĭ, A. B., 2004. The attainability problem under stochastic perturbations. Differentsial′nye Uravneniya 40 (11), 1494–1499, 1582. * Dubins and Savage [1976] Dubins, L. E., Savage, L. J., 1976. Inequalities for Stochastic Processes (How to Gamble if You Must). Dover Publications Inc., New York, corrected republication of the 1965 edition. * Dynkin [1963] Dynkin, E. B., 1963. Optimum choice of the stopping moment of a Markov process. Doklady Academii Nauk SSR 150, 238–240. * Eaton and Zadeh [1962] Eaton, J. H., Zadeh, L. A., 1962. Optimal pursuit strategies in discrete-state probabilistic systems. Transactions of the ASME Ser. D. J. Basic Engineering 84, 23–29. * Gao et al. [2007] Gao, Y., Lygeros, J., Quincampoix, M., 2007. On the reachability problem for uncertain hybrid systems. IEEE Transactions on Automatic Control 52 (9), 1572–1586. * Hernández-Lerma and Lasserre [1996] Hernández-Lerma, O., Lasserre, J. B., 1996. Discrete-Time Markov Control Processes: Basic Optimality Criteria. Vol. 30 of Applications of Mathematics. Springer-Verlag, New York. * Hernández-Lerma and Lasserre [1999] Hernández-Lerma, O., Lasserre, J. B., 1999. Further Topics on Discrete-Time Markov Control Processes. Vol. 42 of Applications of Mathematics. Springer-Verlag, New York. * Karatzas and Sudderth [2009] Karatzas, I., Sudderth, W., 2009. Two characterizations of optimality in dynamic programming. Applied Mathematics & Optimization; http://www.springerlink.com/content/340m82862p817446/?p=f54a99eb8ef3432%cb45724c3d5ee8baa&pi=0. * Kesten and Spitzer [1975] Kesten, H., Spitzer, F., 1975. Controlled Markov chains. Annals of Probability 3, 32–40. * Kushner [1971] Kushner, H., 1971. Introduction to Stochastic Control. Holt, Rinehart and Winston, Inc., New York. * Kwiatkowska et al. [2007] Kwiatkowska, M., Norman, G., Parker, D., 2007. Stochastic model checking. In: Lecture Notes in Comuter Science. Vol. 4486. Springer-Verlag. * Levin et al. [2009] Levin, D. A., Peres, Y., Wilmer, E. L., 2009. Markov Chains and Mixing Times. American Mathematical Society, USA, with an Appendix written by James G. Propp and David B. Wilson. * Meyn [2008] Meyn, S. P., 2008. Control Techniques for Complex Networks. Cambridge University Press, Cambridge. * Ohtsubo [2003] Ohtsubo, Y., 2003. Value iteration methods in risk minimizing stopping problems. Journal of Computational and Applied Mathematics 152 (1-2), 427–439. * Peskir and Shiryaev [2006] Peskir, G., Shiryaev, A. N., 2006. Optimal Stopping and Free-Boundary Problems. Lectures in Mathematics ETH Zürich. Birkhäuser Verlag, Basel. * Powell [2007] Powell, W. B., 2007. Approximate Dynamic Programming. Wiley Series in Probability and Statistics. Wiley-Interscience [John Wiley & Sons], Hoboken, NJ. * Prajna et al. [2007] Prajna, S., Jadbabaie, A., Pappas, G. J., 2007. A framework for worst-case and stochastic safety verification using barrier certificates. IEEE Transactions on Automatic Control 52 (8), 1415–1428. * Prandini and Hu [2006] Prandini, M., Hu, J., 2006. A stochastic approximation method for reachability computations. In: Stochastic Hybrid Systems. Vol. 337 of Lecture Notes in Control and Information Sciences. Springer, Berlin, pp. 107–139. * Ramponi et al. [2009] Ramponi, F., Chatterjee, D., Summers, S., Lygeros, J., 2009. On the connections between PCTL and Dynamic Programming. http://arxiv.org/abs/0910.4738. * Rao and Swift [2006] Rao, M. M., Swift, R. J., 2006. Probability Theory with Applications, 2nd Edition. Vol. 582 of Mathematics and Its Applications. Springer-Verlag. * Revuz and Yor [1999] Revuz, D., Yor, M., 1999. Continuous Martingales and Brownian Motion, 3rd Edition. Vol. 293 of Grundlehren der Mathematischen Wissenschaften. Springer-Verlag, Berlin. * Schmidli [2008] Schmidli, H., 2008. Stochastic Control in Insurance. Probability and its Applications. Springer-Verlag London Ltd., London. * Simon [1957] Simon, H. A., 1957. Models of man, social and rational. Mathematical essays on rational human behavior in a social setting. John Wiley & Sons Inc., New York. * Tomlin et al. [2000] Tomlin, C. J., Lygeros, J., Sastry, S., 2000. A game theoretic approach to controller design for hybrid systems. Proceedings of IEEE 88, 949–969. * Watkins and Lygeros [2003] Watkins, O., Lygeros, J., 2003. Stochastic reachability for discrete-time systems: an application to aircraft collision avoidance. In: 42nd IEEE Conference on Decision and Control. Vol. 5. pp. 5314–5319. * Whittle [1983] Whittle, P., 1983. Optimization Over Time. Vol. II of Wiley Series in Probability and Mathematical Statistics: Applied Probability and Statistics. John Wiley & Sons Ltd., Chichester. * Zhu and Guo [2006] Zhu, Q., Guo, X., 2006. A semimartingale characterization of average optimal stationary policies for Markov decision processes. Journal of Applied Mathematics and Stochastic Analysis, Art. ID 81593.http://www.hindawi.com/GetArticle.aspx?doi=10.1155/JAMSA/2006/815%93.
arxiv-papers
2009-04-27T19:33:01
2024-09-04T02:49:02.175699
{ "license": "Creative Commons - Attribution - https://creativecommons.org/licenses/by/3.0/", "authors": "Debasish Chatterjee, Eugenio Cinquemani and John Lygeros", "submitter": "Debasish Chatterjee", "url": "https://arxiv.org/abs/0904.4143" }
0904.4145
Hölder continuity of solutions to the Monge-Ampère equations on compact Kähler manifolds PHAM HOANG HIEP ABSTRACT. We study Hölder continuity of solutions to the Monge-Ampère equations on compact Kähler manifolds. In [DNS] the authors have shown that the measure $\omega_{u}^{n}$ is moderate if $u$ is Hölder continuous. We prove a theorem which is a partial converse to this result. 2000 Mathematics Subject Classification: Primary 32W20, Secondary 32Q15. Key words and phrases: Hölder continuity, Complex Monge-Ampère operator, $\omega$-plurisubharmonic functions, compact Kähler manifolds. 1\. Introduction Let $X$ be a compact $n$-dimensional Käler manifold equipped with a fundamental form $\omega$ satisfying $\int\limits_{X}\omega^{n}=1$. An upper semicontinuous function $\varphi:\ X\to[-\infty,+\infty)$ is called $\omega$-plurisubharmonic ($\omega$-psh) if $\varphi\in L^{1}(X)$ and $\omega_{\varphi}:=\omega+dd^{c}\varphi\geq 0$. By PSH$(X,\omega)$ (resp. PSH${}^{-}(X,\omega)$) we denote the set of $\omega$-psh (resp. negative $\omega$-psh) functions on $X$. The complex Monge-Ampère equation $\omega_{u}^{n}=f\omega^{n}$ was solved for smooth positive $f$ in the fundamental work of S. T. Yau (see [Yau]). Later S. Kolodziej showed that there exists a continuous solution if $f\in L^{p}(\omega^{n})$, $f\geq 0$, $p>1$ (see [Ko2]). Recently in [Ko5] he proved that this solution is Hölder continuous in this case (see also [EGZ] for the case $X=\mathbb{C}P^{n}$). In Corollary 1.2 in [DNS] the authors have shown that the measure $\omega_{u}^{n}$ is moderate if $u$ is Hölder continuous. The main result is the following theorem which give a partial answer to the converse problem: Theorem A. Let $\mu$ be a non-negative Radon measure on $X$ such that $\mu(B(z,r))\leq Ar^{2n-2+\alpha},$ for all $B(z,r)\subset X$ ($A,\alpha>0$ are constants). Then for every $f\in L^{p}(d\mu)$ with $p>1$, $\int\limits_{X}fd\mu=1$, there exists a Hölder continuous $\omega$-psh function $u$ such that $\omega_{u}^{n}=fd\mu$. The following results are simple applications of Theorem A: Corollary B. Let $\varphi\in$PSH$(X,\omega)$ be a Hölder continuous function. Then for every $f\in L^{p}(\omega_{\varphi}\wedge\omega^{n-1})$ with $p>1$, $\int\limits_{X}f\omega_{\varphi}\wedge\omega^{n-1}=1$, there exists a Hölder continuous $\omega$-psh function $u$ such that $\omega_{u}^{n}=f\omega_{\varphi}\wedge\omega^{n-1}$. Corollary C. Let $S$ be a $C^{1}$ smooth real hypersurface in $X$ and $V_{S}$ be the volume measure on $S$. Then for every $f\in L^{p}(dV_{S})$ with $p>1$, $\int\limits_{X}fdV_{S}=1$, there exists a Hölder continuous $\omega$-psh function $u$ such that $\omega_{u}^{n}=fdV_{S}$. Acknowledgments. The author is grateful to Slawomir Dinew and Nguyen Quang Dieu for valuable comments. The author is also indebted to the referee for his useful comments that helped to improve the paper. 2\. Preliminaries First we recall some elements of pluripotential theory that will be used throughout the paper. Details can be found in [BT1-2], [Ce1-2], [CK], [CGZ], [De1-3], [Di1-3], [GZ1-2], [H], [Ko1-5], [KoTi], [Si1-2], [Ze1-2]. 2.1. In [Ko2] Kołodziej introduced the capacity $C_{X}$ on $X$ by $C_{X}(E):=\sup\\{\int\limits_{E}\omega_{\varphi}^{n}:\ \varphi\in\text{PSH}(X,\omega),\ -1\leq\varphi\leq 0\\}$ for all Borel sets $E\subset X$. 2.2. In [GZ1] Guedj and Zeriahi introduced the Alexander capacity $T_{X}$ on $X$ by $T_{X}(E)=e^{-\sup\limits_{X}V_{E,X}^{*}}$ for all Borel sets $E\subset X$. Here $V_{E,X}^{*}$ is the global extremal $\omega$-psh function for E defined as the smallest upper semicontinuous majorant of $V_{E,X}$ i.e, $V_{E,X}(z)=\sup\\{\varphi(z):\ \varphi\in\text{PSH}(X,\omega),\ \varphi\leq 0\ \text{on}\ E\\}.$ 2.3. The following definition was introduced in [EGZ]: A probability measure $\mu$ on $X$ is said to satisfy the condition $\Cal{H}(\alpha,A)$ ($\alpha,A>0$) if $\mu(K)\leq AC_{X}(K)^{1+\alpha},$ for any Borel subset $K$ of $X$. A probability measure $\mu$ on $X$ is said to satisfy the condition $\Cal{H}(\infty)$ if for any $\alpha>0$ there exist $A(\alpha)>0$ dependent on $\alpha$ such that $\mu(K)\leq A(\alpha)C_{X}(K)^{1+\alpha},$ for any Borel subset $K$ of $X$. 2.4. The following definition was introduced in [DS]: A measure $\mu$ is said to be moderate if for any open set $U\subset X$, any compact set $K\subset\subset U$ and any compact family $\Cal{F}$ of plurisubharmonic functions on $U$, there are constants $\alpha>0$ such that $\sup\\{\int\limits_{K}e^{-\alpha\varphi}d\mu:\ \varphi\in\Cal{F}\\}<+\infty.$ 2.5. The following class of $\omega$-psh functions was investigated by Guedj and Zeriahi in [GZ2]: $\Cal{E}(X,\omega)=\\{\varphi\in\text{PSH}(X,\omega):\ \lim\limits_{j\to\infty}\int\limits_{\\{\varphi>-j\\}}\omega_{\max(\varphi,-j)}^{n}=\int\limits_{X}\omega^{n}=1\\}.$ Let us also define $\Cal{E}^{-}(X,\omega)=\Cal{E}(X,\omega)\cap\text{PSH}^{-}(X,\omega).$ We refer to [GZ2] for the properties of the class $\Cal{E}(X,\omega)$. 2.6. $S$ is called a $C^{1}$ smooth real hypersurface in $X$ if for all $z\in X$ there exists a neighborhood $U$ of $z$ and $\chi\in C^{1}(U)$ such that $S\cap U=\\{z\in U:\ \chi(z)=0\\}$ and $D\chi(z)\not=0$ for all $z\in S\cap U$. Next we state a well-known result needed for our work. 2.7. Proposition. Let $\mu$ be a non-negative Radon measure on $X$ such that $\mu(B(z,r))\leq Ar^{2n-2+\alpha}$ for all $B(z,r)\subset X$ ($A,\ \alpha>0$ are constants). Then $\mu\in\Cal{H}(\infty)$. Proof. By Theorem 7.2 in [Ze2] and Proposition 7.1 in [GZ1] we can find $\epsilon,C>0$ such that $\mu(K)\leq Ah^{2n-2+\alpha}(K)\leq\frac{AC}{\alpha}T_{X}(K)^{\epsilon\alpha}\leq\frac{ACe}{\alpha}e^{-\frac{\epsilon\alpha}{C_{X}(K)^{\frac{1}{n}}}},$ for all Borel subsets $K$ of $X$, where $h^{2n-2+\alpha}$ is the Hausdorff content of dimension $2n-2+\alpha$. This implies that $\mu\in\Cal{H}(\infty)$. 3\. Stability of the solutions The stability estimate of solutions to the Monge-Ampère equations on compact Kähler manifolds was obtained by Kolodziej ([Ko2]). Recently, in [DZ] S. Dinew and Z. Zhang proved a stronger version of this estimate. We will show a generalization of the stability theorem by S. Kolodziej. As a first step we have the following proposition. This proof follows ideas of the proof of Theorem 2.5 in [DH]. We include a proof for the reader’s convenience. 3.1. Proposition. Let $\varphi,\psi\in\Cal{E}^{-}(X,\omega)$ be such that $\omega_{\varphi}^{n}\in\Cal{H}(\alpha,A)$. Then there exist constants $t\in\mathbb{R}$ and $C(\alpha,A)\geq 0$ such that $\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\varphi}^{n}+\omega_{\psi}^{n})\leq C(\alpha,A)a^{n+1},$ here $a=[\int\limits_{X}||\omega_{\varphi}^{n}-\omega_{\psi}^{n}||]^{\frac{1}{2n+3+\frac{n+1}{1+\alpha}}}$. Proof. Since $\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\varphi}^{n}+\omega_{\psi}^{n})\leq 2$, it suffices to consider the case when $a$ is small. Set $\epsilon=\frac{1}{2}\inf\\{\int\limits_{\\{|\varphi-\psi-t|>a\\}}\omega_{\varphi}^{n}:\ t\in\mathbb{R}\\}$ Hence $\int\limits_{\\{|\varphi-\psi-t|\leq a\\}}\omega_{\varphi}^{n}\leq 1-2\epsilon$ for all $t\in\mathbb{R}$. Set $t_{0}=\sup\\{t\in{\mathbb{R}}:\ \int\limits_{\\{\varphi<\psi+t+a\\}}\omega_{\varphi}^{n}\leq 1-\epsilon\\}$ Replacing $\psi$ by $\psi+t_{0}$ we can assume that $t_{0}=0$. Then $\int\limits_{\\{\varphi<\psi+a\\}}\omega_{\varphi}^{n}\leq 1-\epsilon$ and $\int\limits_{\\{\varphi\leq\psi+a\\}}\omega_{\varphi}^{n}\geq 1-\epsilon$. Hence $\displaystyle\int\limits_{\\{\psi<\varphi+a\\}}\omega_{\varphi}^{n}=1-\int\limits_{\\{\varphi+a\leq\psi\\}}\omega_{\varphi}^{n}=1-\int\limits_{\\{\varphi\leq\psi+a\\}}\omega_{\varphi}^{n}$ $\displaystyle+\int\limits_{\\{\psi-a<\varphi\leq\psi+a\\}}\omega_{\varphi}^{n}\leq 1-\epsilon.$ Since $\int\limits_{\\{|\varphi-\psi|\leq a\\}}\omega_{\varphi}^{n}\leq 1$ we can choose $s\in[-a+a^{n+2},a-a^{n+2}]$ satisfying $\int\limits_{\\{|\varphi-\psi-s|<a^{n+2}\\}}\omega_{\varphi}^{n}\leq 2{a^{n+1}}.$ Replacing $\psi$ by $\psi+s$ we can assume that $s=0$. One easily obtains the following inequalities $\int\limits_{\\{\varphi<\psi+a^{n+2}\\}}\omega_{\varphi}^{n}\leq 1-\epsilon,\ \int\limits_{\\{\psi<\varphi+a^{n+2}\\}}\omega_{\varphi}^{n}\leq 1-\epsilon,\ \int\limits_{\\{|\varphi-\psi|<a^{n+2}\\}}\omega_{\varphi}^{n}\leq 2a^{n+1}.$ $None$ By [GZ2] we can find $\rho\in\Cal{E}(X,\omega)$, such that $\omega_{\rho}^{n}=\frac{1}{1-\epsilon}1_{\\{\varphi<\psi\\}}\omega_{\varphi}^{n}+c1_{\\{\varphi\geq\psi\\}}\omega_{\varphi}^{n}\ \text{and}\ \sup\limits_{X}\rho=0,$ $None$ ($c\geq 0$ is chosen so that the measure has total mass $1$). For simplicity of notation we set $\beta=\frac{n+1}{1+\alpha}$. Set $U=\\{(1-a^{n+2+\beta})\varphi<(1-a^{n+2+\beta})\psi+a^{n+2+\beta}\rho\\}\subset\\{\varphi<\psi\\}.$ From Theorem 2.1 in [Di3] and (2) we get $\omega_{\varphi}^{n-1}\wedge\omega_{(1-a^{n+2+\beta})\psi+a^{n+2+\beta}\rho}\geq(1-a^{n+2+\beta})\omega_{\varphi}^{n-1}\wedge\omega_{\psi}+\frac{a^{n+2+\beta}}{(1-\epsilon)^{\frac{1}{n}}}\omega_{\varphi}^{n},$ $None$ on $U$. From Theorem 2.3 in [Di3], Lemma 2.6 in [DH] and (3) we obtain $\displaystyle(1-a^{n+2+\beta})\int\limits_{U}\omega_{\varphi}^{n-1}\wedge\omega_{\psi}+\frac{a^{n+2+\beta}}{(1-\epsilon)^{\frac{1}{n}}}\int\limits_{U}\omega_{\varphi}^{n}$ $\displaystyle\leq\int\limits_{U}\omega_{(1-a^{n+2+\beta})\psi+a^{n+2+\beta}\rho}\wedge\omega_{\varphi}^{n-1}$ $\displaystyle\leq\int\limits_{U}\omega_{(1-a^{n+2+\beta})\varphi}\wedge\omega_{\varphi}^{n-1}=(1-a^{n+2+\beta})\int\limits_{U}\omega_{\varphi}^{n}+a^{n+2+\beta}\int\limits_{U}\omega\wedge\omega_{\varphi}^{n-1}$ $\displaystyle\leq(1-a^{n+2+\beta})(\int\limits_{U}\omega_{\varphi}^{n-1}\wedge\omega_{\psi}+2a^{2n+3+\beta})+a^{n+2+\beta}\int\limits_{U}\omega\wedge\omega_{\varphi}^{n-1}.$ Hence $\frac{1}{(1-\epsilon)^{\frac{1}{n}}}\int\limits_{U}\omega_{\varphi}^{n}\leq 2a^{n+1}+\int\limits_{U}\omega\wedge\omega_{\varphi}^{n-1}.$ $None$ From Proposition 3.6 in [GZ1] and (4) we get $\displaystyle(5)$ $\displaystyle\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[\int\limits_{\\{\varphi\leq\psi-a^{n+2}\\}}\omega_{\varphi}^{n}-C_{1}(\alpha,A)a^{n+1}]$ $\displaystyle\leq\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[\int\limits_{\\{\varphi\leq\psi-a^{n+2}\\}}\omega_{\varphi}^{n}-A[C_{X}(\\{\rho\leq-\frac{1}{2a^{\beta}}\\})]^{1+\alpha}]$ $\displaystyle\leq\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[\int\limits_{\\{\varphi\leq\psi-a^{n+2}\\}}\omega_{\varphi}^{n}-\int\limits_{\\{\rho\leq-\frac{1}{2a^{\beta}}\\}}\omega_{\varphi}^{n}]$ $\displaystyle\leq\frac{1}{(1-\epsilon)^{\frac{1}{n}}}\int\limits_{U}\omega_{\varphi}^{n}$ $\displaystyle\leq 2a^{n+1}+\int\limits_{U}\omega\wedge\omega_{\varphi}^{n-1}$ $\displaystyle\leq 2a^{n+1}+\int\limits_{\\{\varphi<\psi\\}}\omega\wedge\omega_{\varphi}^{n-1},$ Similarly to $\rho$ we define $\vartheta\in\Cal{E}(X,\omega)$, such that $\omega_{\vartheta}^{n}=\frac{1}{1-\epsilon}1_{\\{\varphi<\psi\\}}\omega_{\varphi}^{n}+l1_{\\{\psi\geq\varphi\\}}\omega_{\varphi}^{n}\ \text{and}\ \sup\limits_{X}\vartheta=0,$ ($l$ plays the same role as $c$ above). Set $V=\\{(1-a^{n+2+\beta})\psi<(1-a^{n+2+\beta})\varphi+a^{n+2+\beta}\vartheta\\}\subset\\{\psi<\varphi\\}.$ We get $\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[\int\limits_{\\{\psi\leq\varphi-a^{n+2}\\}}\omega_{\varphi}^{n}-C_{1}(\alpha,A)a^{n+1}]\leq 2a^{n+1}+\int\limits_{\\{\psi<\varphi\\}}\omega\wedge\omega_{\varphi}^{n-1}.$ $None$ From (1), (5) and (6) we obtain $\displaystyle\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[1-2a^{n+1}-2C_{1}(\alpha,A)a^{n+1}]$ $\displaystyle\leq\frac{1}{(1-\epsilon)^{\frac{1}{n}}}[\int\limits_{\\{|\varphi-\psi|\geq a^{n+1}\\}}\omega_{\varphi}^{n}-2C_{1}(\alpha,A)a^{1+\alpha}]$ $\displaystyle\leq 4a^{n+1}+1.$ Hence $\epsilon\leq 1-[\frac{1-2(C_{1}(\alpha,A)+1)a^{n+1}}{4a^{n+1}+1}]^{n}\leq C_{2}(\alpha,A)a^{n+1}.$ This implies that there exists $t\in\mathbb{R}$ satisfying $\int\limits_{\\{|\varphi-\psi-t|>a\\}}\omega_{\varphi}^{n}\leq 2C_{2}(\alpha,A)a^{n+1}.$ Finally we have $\displaystyle\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\varphi}^{n}+\omega_{\psi}^{n})$ $\displaystyle=2\int\limits_{\\{|\varphi-\psi-t|>a\\}}\omega_{\varphi}^{n}+\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\psi}^{n}-\omega_{\varphi}^{n})$ $\displaystyle\leq 2C_{2}(\alpha,A)a^{n+1}+a^{2n+3+\beta}\leq C(\alpha,A)a^{n+1}.$ The second step in proving our stability therem is the the following 3.2. Proposition. Let $\varphi,\psi\in\Cal{E}^{-}(X,\omega)$ be such that $\omega_{\varphi}^{n},\omega_{\psi}^{n}\in\Cal{H}(\alpha,A)$. Then there exist constants $t\in\mathbb{R}$ and $C(\alpha,A)\geq 0$ such that $C_{X}(\\{|\varphi-\psi-t|>a\\})\leq C(\alpha,A)a,$ here $a=[\int\limits_{X}||\omega_{\varphi}^{n}-\omega_{\psi}^{n}||]^{\frac{1}{2n+3+\frac{n+1}{1+\alpha}}}$. Proof. Since $C_{X}(\\{|\varphi-\psi-t|>a\\})\leq C_{X}(X)=1$, it suffices to consider the case when $a$ is small. Without loss of generality we can assume that $\sup\limits_{X}\varphi=\sup\limits_{X}\psi=0$. By Remark 2.5 in [EGZ] there exists $M(\alpha,A)>0$ such that $||\varphi||_{L^{\infty}(X)}<M(\alpha,A)$, $||\psi||_{L^{\infty}(X)}<M(\alpha,A)$. By Proposition 3.1 we can find $t>0$ such that $\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\varphi}^{n}+\omega_{\psi}^{n})\leq C_{1}(\alpha,A)a^{n+1}.$ We consider the case $a<\min(1,\frac{1}{C_{1}(\alpha,A)})$. Since $\int\limits_{\\{|\varphi-\psi-t|>a\\}}(\omega_{\varphi}^{n}+\omega_{\psi}^{n})<1$ we get $\\{|\varphi-\psi-t|>a\\}\not=X$. This implies that $|t|\leq\sup\limits_{X}|\varphi-\psi|+1\leq M(\alpha,A)+1$. Replacing $\psi$ by $\psi+t$ we can assume that $t=0$ and $||\psi||_{L^{\infty}(X)}<2M(\alpha,A)+1$. Using Lemma 2.3 in [EGZ] for $s=\frac{a}{2}$, $t=\frac{a}{2(2M(\alpha,A)+1)}$ we get $\displaystyle C_{X}(\\{\varphi-\psi<-a\\})$ $\displaystyle\leq C_{X}(\\{\varphi-\psi<-\frac{a}{2}-\frac{a}{2(2M(\alpha,A)+1)}\\})$ $\displaystyle\leq\frac{2^{n}(2M(\alpha,A)+1)^{n}}{a^{n}}\int\limits_{\\{\varphi-\psi<-a\\}}\omega_{\varphi}^{n}$ $\displaystyle\leq 2^{n}(2M(\alpha,A)+1)^{n}C_{1}(\alpha,A)a.$ Similarly we get $C_{X}(\\{\psi-\varphi<-a\\})\leq 2^{n}(2M(\alpha,A)+1)^{n}C_{1}(\alpha,A)a.$ Combination of these inequalities yields $C_{X}(\\{|\varphi-\psi|>a\\})\leq C(\alpha,A)a.$ Now we prove the promised generalization of Kolodziej stability theorem (Theorem 1.1 in [Ko5]). 3.3. Theorem. Let $\varphi,\psi\in\Cal{E}^{-}(X,\omega)$ be such that $\sup\limits_{X}\varphi=\sup\limits_{X}\psi=0$ and $\omega_{\varphi}^{n},\omega_{\psi}^{n}\in\Cal{H}(\alpha,A)$. Then there exists $C(\alpha,A)>0$ such that $\sup\limits_{X}|\varphi-\psi|\leq C(\alpha,A)[\int\limits_{X}||\omega_{\varphi}^{n}-\omega_{\psi}^{n}||]^{\frac{\min(1,\frac{\alpha}{n})}{2n+3+\frac{n+1}{1+\alpha}}}.$ Proof. Set $a=[\int\limits_{X}||\omega_{\varphi}^{n}-\omega_{\psi}^{n}||]^{\frac{1}{2n+3+\frac{n+1}{1+\alpha}}}.$ By Proposition 3.2 there exists $C_{1}(\alpha,A)>0$ and $t\in\mathbb{R}$ such that $|t|\leq M(\alpha,A)+1$ and $C_{X}(\\{|\varphi-\psi-t|>a\\})\leq C_{1}(\alpha,A)a.$ Moreover, by Proposition 2.6 in [EGZ] there exists $C_{2}(\alpha,A)>0$ such that $\displaystyle\sup\limits_{X}|\varphi-\psi-t|$ $\displaystyle\leq 2a+C_{2}(\alpha,A)[C_{X}(\\{|\varphi-\psi-t|>a\\})]^{\frac{\alpha}{n}}$ $\displaystyle\leq 2a+C_{2}(\alpha,A)[C_{1}(\alpha,A)a]^{\frac{\alpha}{n}}$ $\displaystyle\leq C_{3}(\alpha,A)a^{\min(1,\frac{\alpha}{n})}.$ Moreover, since $\sup\limits_{X}\varphi=\sup\limits_{X}\psi=0$ we obtain $|t|\leq C_{3}(\alpha,A)a^{\min(1,\frac{\alpha}{n})}$. Combination of these inequalities yields $\sup\limits_{X}|\varphi-\psi|\leq\sup\limits_{X}|\varphi-\psi-t|+|t|\leq 2C_{3}(\alpha,A)a^{\min(1,\frac{\alpha}{n})}=C(\alpha,A)[\int\limits_{X}||\omega_{\varphi}^{n}-\omega_{\psi}^{n}||]^{\frac{\min(1,\frac{\alpha}{n})}{2n+3+\frac{n+1}{1+\alpha}}}.$ 3.4. Corollary. Let $\mu$ be a non-negative Radon measure on $X$ such that $\mu(B(z,r))\leq Ar^{2n-2+\alpha}$ for all $B(z,r)\subset X$ ($A,\ \alpha>0$ are constants). Given $p>1,M>0,\epsilon>0$ and $f,g\in L^{p}(d\mu)$ with $||f||_{L^{p}(d\mu)},||g||_{L^{p}(d\mu)}\leq M$ and $\int\limits_{X}fd\mu=\int\limits_{X}gd\mu=1$. Assume that $\varphi,\psi\in\Cal{E}^{-}(X,\omega)$ satisfy $\omega_{\varphi}^{n}=fd\mu$, $\omega_{\psi}^{n}=gd\mu$ and $\sup\limits_{X}\varphi=\sup\limits_{X}\psi=0$. Then there exists $C(\alpha,A,M,\epsilon)>0$ such that $\sup\limits_{X}|\varphi-\psi|\leq C(\alpha,A,M,\epsilon)[\int\limits_{X}|f-g|d\mu]^{\frac{1}{2n+3+\epsilon}}.$ Proof. By Hölder inequality we have $\int\limits_{K}fd\mu\leq||f||_{L^{p}(d\mu)}[\mu(K)]^{1-\frac{1}{p}}\leq M[\mu(K)]^{1-\frac{1}{p}},$ $\int\limits_{K}gd\mu\leq||g||_{L^{p}(d\mu)}[\mu(K)]^{1-\frac{1}{p}}\leq M[\mu(K)]^{1-\frac{1}{p}},$ for any Borel subset $K$ of $X$. By Proposition 2.7 we get $fd\mu,gd\mu\in\Cal{H}(\infty)$. Using Theorem 3.3 we can find $C(\alpha,A,M,\epsilon)>0$ such that $\sup\limits_{X}|\varphi-\psi|\leq C(\alpha,A,M,\epsilon)[\int\limits_{X}|f-g|d\mu]^{\frac{1}{2n+3+\epsilon}}.$ 4\. Local estimates in Potential theory Let $\Omega$ be a bounded domain in $\mathbb{R}^{n}$ ($n\geq 2$). By SH$(\Omega)$ (resp SH${}^{-}(\Omega)$) we denote the set of subharmonic (resp. negative subharmonic) functions on $\Omega$. For each $u\in SH(\Omega)$ and $\delta>0$ we denote $\tilde{u}_{\delta}(x)=\frac{1}{c_{n}\delta^{n}}\int\limits_{B_{\delta}}u(x+y)dV_{n}(y),$ $u_{\delta}(x)=\sup\limits_{y\in B_{\delta}}u(x+y),$ for $x\in\Omega_{\delta}=\\{x\in\Omega:d(x,\partial\Omega)>\delta\\}$. Here $B_{\delta}=\\{x\in\mathbb{R}^{n}:\ |x|=(x_{1}^{2}+...+x_{n}^{2})^{\frac{1}{2}}<\delta\\}$ and $c_{n}$ is the volume of the unit ball $B_{1}$. We state some results which will be used in our main theorems. 4.1. Theorem. Let $\mu$ be a non-negative Radon measure on $\Omega$ such that $\mu(B(z,r))\leq Ar^{n-2+\alpha}$ for all $B(z,r)\subset D\subset\subset\Omega$ ($A,\alpha>0$ are constants). Then for $K\subset\subset D$ and $\epsilon>0$ there exists $C(\alpha,A,K,\epsilon)$ such that $\int\limits_{K}[\tilde{u}_{\delta}-u]d\mu\leq C(\alpha,A,K,\epsilon)\int\limits_{\bar{D}}\Delta u\ \delta^{\frac{\alpha-\epsilon}{1+\alpha}},$ for all $u\in\text{SH}(\Omega)$, where $\Delta$ is the Laplace operator. Proof. Since the change of radii of the balls does not affect the statement we can assume that $\Omega=B_{4}$, $D=B_{3}$, $K=B_{1}$ and $u$ is smooth on $B_{4}$. By [Hö] we have $u(x)=\int\limits_{B_{2}}G(x,z)\Delta u(z)+h(x),$ where $G(x,y)$ is the fundamental solution of Laplace equation and $h$ is harmonic in $B_{2}$. By Fubini theorem we have $\begin{aligned} \int\limits_{B_{1}}[\tilde{u}_{\delta}(x)-u(x)]d\mu(x)=&\int\limits_{B_{1}}\frac{1}{c_{n}\delta^{n}}\int\limits_{B_{\delta}}[u(x+y)-u(x)]dV_{n}(y)d\mu(x)\\\ &\frac{1}{c_{n}\delta^{n}}\int\limits_{B_{1}}\int\limits_{B_{\delta}}\int\limits_{B_{2}}[G(x+y,z)-G(x,z)]\Delta u(z)dV_{n}(y)d\mu(x)\\\ &=\int\limits_{B_{2}}\Delta u(z)\frac{1}{c_{n}\delta^{n}}\int\limits_{B_{\delta}}dV_{n}(y)\int\limits_{B_{1}}[G(x+y,z)-G(x,z)]d\mu(x)\end{aligned}.$ Set $F(y,z)=\int\limits_{B_{1}}[G(x+y,z)-G(x,z)]d\mu(x).$ It is enough to prove that $F(y,z)\leq C(\alpha,A,s)\delta^{\frac{\alpha-\epsilon}{1+\alpha}}$ for all $y\in B_{\delta},z\in B_{2}$. We consider two cases: Case 1: $n=2$. For $y\in B_{\delta},z\in B_{2}$, $\delta<\frac{1}{2}$, we have $\displaystyle F(y,z)$ $\displaystyle=\int\limits_{B_{1}}[\ln|x+y-z|-\ln|x-z|]d\mu(x)$ $\displaystyle=\int\limits_{B_{1}\cap\\{|x-z|\geq|y|^{\frac{1}{1+\alpha}}\\}}\ln|1+\frac{y}{x-z}|d\mu(x)+\int\limits_{B_{1}\cap\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}\ln|1+\frac{y}{x-z}|d\mu(x)$ $\displaystyle\leq\int\limits_{B_{1}\cap\\{|x-z|\geq|y|^{\frac{1}{1+\alpha}}\\}}\ln(1+|y|^{\frac{\alpha}{1+\alpha}})d\mu(x)+\ln 4\int\limits_{B_{1}\cap\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}d\mu$ $\displaystyle\ +\int\limits_{B_{1}\cap\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}\ln\frac{1}{|x-z|}d\mu(x)$ $\displaystyle\leq|y|^{\frac{\alpha}{1+\alpha}}\mu(B_{1})+A|y|^{\frac{\alpha}{1+\alpha}}\ln 4+|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\int\limits_{\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}\frac{1}{|x-z|^{\alpha-\epsilon}}\ln\frac{1}{|x-z|}d\mu(x)$ $\displaystyle\leq A(1+\ln 4)|y|^{\frac{\alpha}{1+\alpha}}+|y|^{\frac{\alpha-\epsilon}{1+\alpha}}C_{1}(\alpha,\epsilon)\int\limits_{\\{|x-z|<1\\}}\frac{d\mu(x)}{|x-z|^{\alpha-\frac{\epsilon}{2}}}$ $\displaystyle\leq A(1+\ln 4)|y|^{\frac{\alpha}{1+\alpha}}+C_{1}(\alpha,\epsilon)|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\sum\limits_{j=0}^{\infty}\int\limits_{\\{2^{-j-1}\leq|x-z|<2^{-j}\\}}\frac{d\mu(x)}{|x-z|^{\alpha-\frac{\epsilon}{2}}}$ $\displaystyle\leq A(1+\ln 4)|y|^{\frac{\alpha}{1+\alpha}}+C_{1}(\alpha,\epsilon)|y|^{\frac{\alpha-\epsilon}{1+\alpha}}A\sum\limits_{j=0}^{\infty}2^{(j+1)(\alpha-\frac{\epsilon}{2})-j\alpha}$ $\displaystyle\leq C(\alpha,A,\epsilon)|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\leq C(\alpha,A,\epsilon)\delta^{\frac{\alpha-\epsilon}{1+\alpha}}.$ Case 2: $n\geq 3$. Similarly for $y\in B_{\delta},z\in B_{2}$, $\delta<\frac{1}{2}$, we have $\displaystyle F(y,z)$ $\displaystyle=\int\limits_{B_{1}}[-\frac{1}{|x+y-z|^{n-2}}+\frac{1}{|x-z|^{n-2}}]d\mu(x)$ $\displaystyle=\int\limits_{B_{1}\cap\\{|x-z|\geq|y|^{\frac{1}{1+\alpha}}\\}}\frac{|x+y-z|^{n-2}-|x-z|^{n-2}}{|x+y-z|^{n-2}|x-z|^{n-2}}d\mu(x)+\int\limits_{\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}\frac{d\mu(x)}{|x-z|^{n-2}}$ $\displaystyle\leq C_{2}(\alpha)|y|^{\frac{\alpha}{1+\alpha}}\int\limits_{B_{1}\cap\\{|x-z|\geq|y|^{\frac{1}{1+\alpha}}\\}}d\mu(x)+|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\int\limits_{\\{|x-z|<|y|^{\frac{1}{1+\alpha}}\\}}\frac{d\mu(x)}{|x-z|^{n-2+\alpha-\epsilon}}$ $\displaystyle\leq AC_{2}(\alpha)|y|^{\frac{\alpha}{1+\alpha}}+|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\int\limits_{\\{|x-z|<1\\}}\frac{d\mu(x)}{|x-z|^{n-2+\alpha-\epsilon}}$ $\displaystyle\leq C(\alpha,A,\epsilon)|y|^{\frac{\alpha-\epsilon}{1+\alpha}}\leq C(\alpha,A,\epsilon)\delta^{\frac{\alpha-\epsilon}{1+\alpha}},$ 4.2. Theorem. Let $\mu$ be a non-negative Radon measure on $\Omega$ such that $\mu(B(z,r))\leq Ar^{n-2+\alpha}$ for all $B(z,r)\subset D\subset\subset\Omega$ ($A,\alpha>0$ are constants). Then for $K\subset\subset D$ and $\epsilon>0$ there exists $C(\alpha,A,K,\epsilon)$ such that $\int\limits_{K}[u_{\delta}-u]d\mu\leq C(\alpha,A,K,\epsilon)||u||_{L^{\infty}(\Omega)}\ \delta^{\frac{\alpha-\epsilon}{2(1+\alpha)}},$ for all $u\in\text{SH}\cap L^{\infty}(\Omega)$. We need a well-known lemma: 4.3. Lemma. Let $u\in\text{SH}\cap L^{\infty}(\Omega)$. Then $|\tilde{u}_{\delta}(x)-\tilde{u}_{\delta}(y)|\leq\frac{||u||_{L^{\infty}(\Omega)}|x-y|}{\delta},$ for all $x,y\in\Omega_{\delta}$. Proof of Theorem 4.2. By Lemma 4.3 we have $u_{\delta}(x)=\sup\limits_{y\in B_{\delta}}u(x+y)\leq\sup\limits_{y\in B_{\delta}}\tilde{u}_{\delta^{\frac{1}{2}}}(x+y)\leq\tilde{u}_{\delta^{\frac{1}{2}}}(x)+\delta^{\frac{1}{2}}||u||_{L^{\infty}(\Omega)}.$ By Theorem 4.1 we get $\displaystyle\int\limits_{K}[u_{\delta}-u]d\mu$ $\displaystyle\leq\int\limits_{K}[\tilde{u}_{\delta^{\frac{1}{2}}}-u]d\mu+||u||_{L^{\infty}(\Omega)}\mu(K)\delta^{\frac{1}{2}}$ $\displaystyle\leq C(\alpha,A,K,\epsilon)||u||_{L^{\infty}(\Omega)}\ \delta^{\frac{\alpha-\epsilon}{2(1+\alpha)}}.$ Next we state a well-known result is a direct consequence of the Jensen formula (see [AG]) 4.4. Proposition. Let $u\in\text{SH}(B_{2})$ be such that $|u(x)-u(y)|\leq A|x-y|^{\alpha}$ for all $x,y\in B_{2}$. Then there exists $C(\alpha,A)>0$ such that $\int\limits_{B(x,r)}\Delta u\leq C(\alpha,A)r^{n-2+\alpha},$ for all $B(x,r)\subset B_{1}$. 5\. Main results Proof of Theorem A. We use the same scheme as the proof of Theorem 2.1 in [Ko5]. From Corollary 3.4 and from Theorem 4.2 we can replace $\omega^{n}$ by $d\mu$. This implies that $u$ is Hölder continuous with the Hölder exponent dependent on $\alpha$, $A$, $p$, $X$ and $||f||_{L^{p}(d\mu)}$. Proof of Corollary B. It follows from Proposition 4.4 and Theorem A. Proof of Corollary C. Direct application of Theorem A. REFERENCES [AG] D. H. Armitage and S. J. Gardiner, Classical potential theory, Springer Monogr. Math., Springer-Verlag, London, 2001. [BT1] E. Bedford and B. A. Taylor, The Dirichlet problem for the complex Monge-Ampère operator, Invent. Math. 37 (1976), 1-44. [BT2] E. Bedford and B. A. Taylor, A new capacity for plurisubharmonic functions, Acta Math. 149 (1982), 1-40. [Ce1] U. Cegrell, Pluricomplex energy, Acta Math. 180 (1998), 187-217. [Ce2] U. Cegrell, The general definition of the complex Monge-Ampère operator, Ann. Inst. Fourier (Grenoble) 54 (2004), 159-179. [CK] U. Cegrell, S. Kołodziej, The equation of complex Monge-Ampère type and stability of solutions, Math. Ann. 334 (2006), 713-729. [CGZ] D. Coman, V. Guedj and A. Zeriahi, Domains of definition of Monge-Ampère operators on compact Kähler manifolds, Math. Zeit. 259 (2008), 393-418. [De1] J. P. Demailly, Mesures de Monge-Ampère et mesures pluriharmoniques, Math. Zeit. 194 (1987), 519-564. [De2] J. P. Demailly, Monger-Ampère operators, Lelong numbers and intersection theory, Complex Analysis and Geometry, Univ. Series in Math., Plenum Press, New-York, 1993. [De3] J. P. Demailly, Complex analytic and differential geometry, self published e-book, 1997. [Di1] S. Dinew, Cegrell classes on compact Kähler manifolds, Ann. Polon. Math. 91 (2007), 179-195. [Di2] S. Dinew, An inequality for mixed Monge-Ampère measures, Math. Zeit. 262 (2009), 1-15. [Di3] S. Dinew, Uniqueness in $\Cal{E}(X,\omega)$, J. Funct. Anal. 256 (2009), 2113-2122. [DH] S. Dinew and P. H. Hiep, Convergence in capacity on compact Kähler manifolds, Preprint (2009) (http://arxiv.org). [DZ] S. Dinew and Z. Zhang, Stability of Bounded Solutions for Degenerate Complex Monge-Ampère equations, Preprint (2008) (http://arxiv.org) [DNS] T. C. Dinh, V. A. Nguyen and N. Sibony, Exponential estimates for plurisubharmonic functions and stochastic dynamics, Preprint (2008) (http://arxiv.org) [DS] T. C. Dinh, N. Sibony, Distribution des valeurs de transformations mեromorphes et applications, Comment. Math. Helv., 81 (2006), no. 1, 221-258. [EGZ] P. Eyssidieux, V. Guedj and A. Zeriahi, Singular Kähler Einstein metrics, J. Amer. Math. Soc. 22 (2009), 607-639. [GZ1] V. Guedj and A. Zeriahi, Intrinsic capacities on compact Kähler manifolds, J. Geom. Anal. 15 (2005), no. 4, 607-639. [GZ2] V. Guedj and A. Zeriahi, The weighted Monge-Ampère energy of quasiplurisubharmonic functions, J. Funct. Anal. 250 (2007), 442-482. [H] P. H. Hiep, On the convergence in capacity on compact Kähler manifolds and its applications, Proc. Amer. Math. Soc. 136 (2008), 2007-2018. [Hö] L. Hörmander, Notions of Convexity, Progess in Mathematics 127, Birkhäuser, Boston (1994). [Ko1] S. Kołodziej, The Monge-Ampère equation, Acta Math. 180 (1998), 69-117. [Ko2] S. Kołodziej, The Monge-Ampère equation on compact Kähler manifolds, Indiana Univ. Math. J. 52 (2003), 667-686. [Ko3] S.Kołodziej, The set of measures given by bounded solutions of the complex Monge-Ampère equation on compact Kähler manifolds, J. London Math. Soc. 72 (2) (2005), 225-238. [Ko4] S. Kołodziej, The complex Monge-Ampère equation and pluripotential theory, Mem. Amer. Math. Soc. 178 (2005). [Ko5] S. Kołodziej, Hölder continuity of solutions to the complex Monge-Ampère equation with the right-hand side in $L^{p}$: the case of compact Kähler manifolds, Math. Ann. 342 (2008), 379-386. [KoTi] S. Kołodziej and G. Tian, A uniform $L^{\infty}$ estimate for complex Monge-Ampère equations, Math. Ann. 342 (2008), 773-787. [Si1] J. Siciak, On some extremal functions and their applications in the theory of analytic functions of several complex variables, Trans. Amer. Math. Soc. 105 (1962) 322ֳ57. [Si2] J. Siciak, Extremal plurisubharmonic functions and capacities in $\mathbb{C}^{n}$, Sophia Univ., Tokyo (1982). [Ze1] A.Zeriahi, The size of plurisubharmonic lemniscates in terms of Hausdorff-Riesz measures and capacities, Proc. London Math. Soc. 89 (2004), no. 1, 104-122. [Ze2] A. Zeriahi, A minimum Principle for Plurisubharmonic functions, Indiana Univ. Math. J. 56 (2007), 2671-2696. [Yau] S. T. Yau, On the Ricci curvature of a compact Kähler manifold and the complex Monge-Ampère equation, Commun. Pure Appl. Math. 31 (1978), 339-411. Department of Mathematics University of Education (Dai hoc Su Pham Ha Noi) CauGiay, Hanoi, Vietnam E-mail: phhiep-vnyahoo.com
arxiv-papers
2009-04-27T15:54:19
2024-09-04T02:49:02.187523
{ "license": "Public Domain", "authors": "Pham Hoang Hiep", "submitter": "Pham Hiep hoang", "url": "https://arxiv.org/abs/0904.4145" }