saving work

This commit is contained in:
Pierre-Francois Loos 2022-09-15 15:52:03 +02:00
parent 3f006d146c
commit 6c45a387af

77
g.tex
View File

@ -243,7 +243,7 @@ $e^{-N\tau H}$ which is usually referred to as the imaginary-time dependent Gree
\titou{Introducing the set of $N-1$ intermediate states, $\{ \ket{i_k} \}_{1 \le k \le N-1}$, in the $N$th product of $T$,} $G^{(N)}$ can be written in the following expanded form
\be
\label{eq:cn}
G^{(N)}_{i_0 i_N} = \sum_{i_1} \sum_{i_2} ... \sum_{i_{N-1}} \prod_{k=0}^{N-1} T_{i_{k} i_{k+1}},
G^{(N)}_{i_0 i_N} = \sum_{i_1} \sum_{i_2} \cdots \sum_{i_{N-1}} \prod_{k=0}^{N-1} T_{i_{k} i_{k+1}},
\ee
where $T_{ij} =\mel{i}{T}{j}$.
Here, each index $i_k$ runs over all basis vectors.
@ -460,25 +460,27 @@ Details of the implementation of this effective dynamics can be in found in Refs
\label{sec:general_domains}
%=======================================%
Let us now extend the results of the preceding section to a general domain. For that,
let us associate to each state $\ket{i}$ a set of states, called the domain of $\ket{i}$ and
denoted $\cD_i$, consisting of the state $\ket{i}$ plus a certain number of states. No particular constraints on the type of domains
are imposed, for example domains associated with different states can be identical, or may have or not common states. The only important condition is
that the set of all domains ensures the ergodicity property of the effective stochastic dynamics (that is, starting from any state there is a
non-zero-probability to reach any other state in a finite number of steps). In practice, it is not difficult to impose such a condition.
Let us now extend the results of Sec.~\ref{sec:single_domains} to a general domain.
To do so, let us associate to each state $\ket{i}$ a set of states, called the domain of $\ket{i}$ denoted $\cD_i$, consisting of the state $\ket{i}$ plus a certain number of states.
No particular constraints on the type of domains are imposed.
For example, domains associated with different states can be identical, and they may or may not have common states.
The only important condition is that the set of all domains ensures the ergodicity property of the effective stochastic dynamics (that is, starting from any state there is a non-zero-probability to reach any other state in a finite number of steps).
In practice, it is not difficult to impose such a condition.
Let us write an arbitrary path of length $N$ as
\be
\ket{i_0} \to \ket{i_1} \to \cdots \to \ket{i_N}
\ee
where the successive states are drawn using the transition probability matrix, $p_{i \to j}$. This series can be rewritten
where the successive states are drawn using the transition probability matrix, $p_{i \to j}$.
This series can be rewritten
\be
\label{eq:eff_series}
(\ket*{I_0},n_0) \to (\ket*{I_1},n_1) \to \cdots \to (\ket*{I_p},n_p)
\ee
where $\ket{I_0}=\ket{i_0}$ is the initial state, $n_0$ the number of times the walker remains within the domain of $\ket{i_0}$ ($n_0=1$ to $N+1$), $\ket{I_1}$ is the first exit state, that is not belonging to $\cD_{i_0}$, $n_1$ is the number of times the walker remains within $\cD_{i_1}$ ($n_1=1$ to $N+1-n_0$), $\ket{I_2}$ the second exit state, and so on.
Here, the integer $p$ goes from 0 to $N$ and indicates the number of exit events occurring along the path. The two extreme cases, $p=0$ and $p=N$, correspond to the cases where the walker remains for ever within the initial domain, and to the case where the walker leaves the current domain at each step, respectively.
In what follows, we shall systematically write the integers representing the exit states in capital letter.
where $\ket{I_0}=\ket{i_0}$ is the initial state, $n_0$ is the number of times the walker remains within the domain of $\ket{i_0}$ (with $1 \le n_0 \le N+1$), $\ket{I_1}$ is the first exit state that does not belong to $\cD_{i_0}$, $n_1$ is the number of times the walker remains in $\cD_{i_1}$ (with $1 \le n_1 \le N+1-n_0$), $\ket{I_2}$ is the second exit state, and so on.
Here, the integer $p$ goes from 0 to $N$ and indicates the number of exit events occurring along the path.
The two extreme cases, $p=0$ and $p=N$, correspond to the cases where the walker remains in the initial domain during the entire path, and to the case where the walker exits a domain at each step, respectively.
\titou{In what follows, we shall systematically write the integers representing the exit states in capital letter.}
%Generalizing what has been done for domains consisting of only one single state, the general idea here is to integrate out exactly the stochastic dynamics over the
%set of all paths having the same representation, Eq.(\ref{eff_series}). As a consequence, an effective Monte Carlo dynamics including only exit states
@ -488,56 +490,57 @@ Let us define the probability of being $n$ times within the domain of $\ket{I_0}
It is given by
\be
\label{eq:eq1C}
\cP_{I_0 \to I}(n) = \sum_{|i_1\rangle \in {\cal D}_{I_0}} ... \sum_{|i_{n-1}\rangle \in {\cal D}_{I_0}}
p_{I_0 \to i_1} \ldots p_{i_{n-2} \to i_{n-1}} p_{i_{n-1} \to I}
\cP_{I_0 \to I}(n)
= \sum_{\ket{i_1} \in \cD_{I_0}} \cdots \sum_{\ket{i_{n-1}} \in \cD_{I_0}}
p_{I_0 \to i_1} \ldots p_{i_{n-2} \to i_{n-1}} p_{i_{n-1} \to I}
\ee
To proceed we need to introduce the projector associated with each domain
\be
P_I= \sum_{\ket{k} \in \cD_I} \dyad{k}{k}
\label{pi}
\label{eq:pi}
P_I = \sum_{\ket{k} \in \cD_I} \dyad{k}{k}
\ee
and to define the restriction of the operator $T^+$ to the domain
\be
T^+_I= P_I T^+ P_I.
\ee
$T^+_I$ is the operator governing the dynamics of the walkers moving within ${\cal D}_{I}$.
Using Eqs.(\ref{eq1C}) and (\ref{pij}), the probability can be rewritten as
$T^+_I$ is the operator governing the dynamics of the walkers moving within $\cD_{I}$.
Using Eqs.~\eqref{eq:pij} and \eqref{eq:eq1C}, the probability can be rewritten as
\be
\cP+{I_0 \to I}(n) = \frac{1}{\PsiG_{I_0}} \mel{I_0}{\qty(T^+_{I_0})^{n-1} F^+_{I_0}}{I} \PsiG_{I}
\label{eq3C}
\label{eq:eq3C}
\cP+{I_0 \to I}(n) = \frac{1}{\PsiG_{I_0}} \mel{I_0}{\qty(T^+_{I_0})^{n-1} F^+_{I_0}}{I} \PsiG_{I},
\ee
where the operator $F$, corresponding to the last move connecting the inside and outside regions of the
domain, is given by
\be
F^+_I = P_I T^+ (1-P_I),
\label{Fi}
\label{eq:Fi}
F^+_I = P_I T^+ (1-P_I),
\ee
that is, $(F^+_I)_{ij}= T^+_{ij}$ when $(|i\rangle \in {\cal D}_{I}, |j\rangle \notin {\cal D}_{I})$, and zero
that is, $(F^+_I)_{ij}= T^+_{ij}$ when $(\ket{i} \in \cD_{I}, \ket{j} \notin \cD_{I})$, and zero
otherwise.
Physically, $F$ may be seen as a flux operator through the boundary of ${\cal D}_{I}$.
Now, the probability of being trapped $n$ times within ${\cal D}_{I}$ is given by
\be
P_{I}(n)=
\frac{1}{\PsiG_{I}} \langle I | {T^+_{I}}^{n-1} F^+_{I}|\PsiG \rangle.
\label{PiN}
\label{eq:PiN}
P_{I}(n) = \frac{1}{\PsiG_{I}} \mel{ I }{ {T^+_{I}}^{n-1} F^+_{I} }{ \PsiG }.
\ee
Using the fact that
\be
{T^+_I}^{n-1} F^+_I= {T^+_I}^{n-1} T^+ - {T^+_I}^n
\label{relation}
\label{eq:relation}
{T^+_I}^{n-1} F^+_I = {T^+_I}^{n-1} T^+ - {T^+_I}^n,
\ee
we have
\be
\sum_{n=0}^{\infty} P_{I}(n) = \frac{1}{\PsiG_{I}} \sum_{n=1}^{\infty} \Big( \langle I | {T^+_{I}}^{n-1} |\PsiG\rangle
- \langle I | {T^+_{I}}^{n} |\PsiG\rangle \Big) = 1
\sum_{n=0}^{\infty} P_{I}(n)
= \frac{1}{\PsiG_{I}} \sum_{n=1}^{\infty} \qty( \mel{ I }{ {T^+_{I}}^{n-1} }{ \PsiG }
- \mel{ I }{ {T^+_{I}}^{n} }{ \PsiG } ) = 1
\ee
and the average trapping time
\be
t_{I}={\bar n}_{I} \tau= \frac{1}{\PsiG_{I}} \langle I | P_{I} \frac{1}{H^+ -E_L^+} P_{I} | \PsiG\rangle
t_{I}={\bar n}_{I} \tau = \frac{1}{\PsiG_{I}} \mel{ I }{ P_{I} \frac{1}{H^+ - \EL^+} P_{I} }{ \PsiG }.
\ee
In practice, the various quantities restricted to the domain are computed by diagonalizing the matrix $(H^+-E_L^+)$ in ${\cal D}_{I}$. Note that
it is possible only if the dimension of the domains is not too large (say, less than a few thousands).
In practice, the various quantities restricted to the domain are computed by diagonalizing the matrix $(H^+-\EL^+)$ in $\cD_{I}$.
Note that it is possible only if the dimension of the domains is not too large (say, less than a few thousands).
%=======================================%
\subsection{Expressing the Green's matrix using domains}
@ -548,12 +551,12 @@ it is possible only if the dimension of the domains is not too large (say, less
\subsubsection{Time-dependent Green's matrix}
\label{sec:time}
%--------------------------------------------%
In this section we generalize the path-integral expression of the Green's matrix, Eqs.(\ref{G}) and (\ref{cn_stoch}), to the case where domains are used.
In this section we generalize the path-integral expression of the Green's matrix, Eqs.~\eqref{eq:G} and \eqref{eq:cn_stoch}, to the case where domains are used.
For that we introduce the Green's matrix associated with each domain
\be
G^{(N),{\cal D}}_{IJ}= \langle J| T_I^N| I\rangle.
G^{(N),\cD}_{IJ}= \mel{ J }{ T_I^N }{ I }.
\ee
Starting from Eq.(\ref{cn})
Starting from Eq.~\eqref{eq:cn}
\be
G^{(N)}_{i_0 i_N}= \sum_{i_1,...,i_{N-1}} \prod_{k=0}^{N-1} \langle i_k| T |i_{k+1} \rangle.
\ee
@ -575,12 +578,12 @@ $$
\sum_{n_0 \ge 1} ... \sum_{n_p \ge 1}
\ee
\be
\label{eq:Gt}
\delta(\sum_{k=0}^p n_k=N+1) \Big[ \prod_{k=0}^{p-1} \langle I_k|T^{n_k-1}_{I_k} F_{I_k} |I_{k+1} \rangle \Big]
G^{(n_p-1),{\cal D}}_{I_p I_N}
\label{Gt}
\ee
This expression is the path-integral representation of the Green's matrix using only the variables $(|I_k\rangle,n_k)$ of the effective dynamics defined over the set
of domains. The standard formula derived above, Eq.(\ref{G}) may be considered as the particular case where the domain associated with each state is empty,
of domains. The standard formula derived above, Eq.~\eqref{eq:G} may be considered as the particular case where the domain associated with each state is empty,
In that case, $p=N$ and $n_k=1$ for $k=0$ to $N$ and we are left only with the $p$-th component of the sum, that is, $G^{(N)}_{I_0 I_N}
= \prod_{k=0}^{N-1} \langle I_k|F_{I_k}|I_{k+1} \rangle $
where $F=T$.