one more Paola ref

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Pierre-Francois Loos 2020-12-05 22:03:02 +01:00
parent 4948b00913
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3 changed files with 34 additions and 4 deletions

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@ -923,6 +923,22 @@
10.1063/1.5078565} {\bibfield {journal} {\bibinfo {journal} {J. Chem.
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%% Created for Pierre-Francois Loos at 2020-12-05 15:45:56 +0100
%% Created for Pierre-Francois Loos at 2020-12-05 22:01:16 +0100
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@article{Daas_2020,
author = {Daas,Timothy J. and Grossi,Juri and Vuckovic,Stefan and Musslimani,Ziad H. and Kooi,Derk P. and Seidl,Michael and Giesbertz,Klaas J. H. and Gori-Giorgi,Paola},
date-added = {2020-12-05 21:58:26 +0100},
date-modified = {2020-12-05 22:01:16 +0100},
doi = {10.1063/5.0029084},
journal = {J. Chem. Phys.},
number = {21},
pages = {214112},
title = {Large coupling-strength expansion of the M{\o}ller--Plesset adiabatic connection: From paradigmatic cases to variational expressions for the leading terms},
volume = {153},
year = {2020},
Bdsk-Url-1 = {https://doi.org/10.1063/5.0029084}}
@article{Barca_2014,
author = {G. M. J. Barca and A. T. B. Gilbert and P. M. W. Gill},
date-added = {2020-12-05 15:45:52 +0100},

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@ -732,7 +733,7 @@ Although practically convenient for electronic structure calculations, the MP pa
the only possibility and alternative partitionings have been considered including:
i) the Epstein-Nesbet (EN) partitioning which consists in taking the diagonal elements of $\hH$ as the zeroth-order Hamiltonian, \cite{Nesbet_1955,Epstein_1926}
ii) the weak correlation partitioning in which the one-electron part is consider as the unperturbed Hamiltonian $\hH^{(0)}$ and the two-electron part is the perturbation operator $\hV$, and
iii) the strong coupling partitioning where the two operators are inverted compared to the weak correlation partitioning. \cite{Seidl_2018}
iii) the strong coupling partitioning where the two operators are inverted compared to the weak correlation partitioning. \cite{Seidl_2018,Daas_2020}
While an in-depth comparison of these different approaches can offer insight into
their relative strengths and weaknesses for various situations, we will restrict our current discussion
to the convergence properties of the MP expansion.