Merge branch 'master' of git.irsamc.ups-tlse.fr:scemama/RSDFT-CIPSI-QMC
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%% This BibTeX bibliography file was created using BibDesk.
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%% http://bibdesk.sourceforge.net/
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%% Created for Pierre-Francois Loos at 2020-08-20 13:13:29 +0200
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%% Created for Pierre-Francois Loos at 2020-08-20 18:51:19 +0200
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%% Saved with string encoding Unicode (UTF-8)
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@ -17,18 +17,20 @@
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Pages = {3700-3703},
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Title = {Is coupled cluster singles and doubles (CCSD) more computationally intensive than quadratic configuration-interaction (QCISD)?},
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Volume = {90},
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Year = {1989}}
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Year = {1989},
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Bdsk-Url-1 = {https://doi.org/10.1063/1.455827}}
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@article{Scuseria_1988,
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Author = {G. E. Scuseria, C. L. Janssen, and H. F. Schaefer III},
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Author = {G. E. Scuseria and C. L. Janssen and H. F. Schaefer III},
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Date-Added = {2020-08-20 13:11:43 +0200},
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Date-Modified = {2020-08-20 13:12:29 +0200},
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Date-Modified = {2020-08-20 18:51:00 +0200},
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Doi = {10.1063/1.455269},
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Journal = {J. Chem. Phys.},
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Pages = {7382--7387},
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Title = {An efficient reformulation of the closed-shell coupled cluster single and double excitation (CCSD) equations},
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Volume = {89},
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Year = {1988}}
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Year = {1988},
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Bdsk-Url-1 = {https://doi.org/10.1063/1.455269}}
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@article{Cizek_1969,
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Author = {J. Cizek},
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@ -37,18 +39,20 @@
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Doi = {10.1002/9780470143599},
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Journal = {Adv. Chem. Phys.},
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Pages = {35},
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Volume = {14}}
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Volume = {14},
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Bdsk-Url-1 = {https://doi.org/10.1002/9780470143599}}
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@article{Purvis_1982,
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Author = {G. D. Purvis III and R. J. Bartlett},
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Author = {G. D. {Purvis III} and R. J. Bartlett},
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Date-Added = {2020-08-20 13:06:17 +0200},
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Date-Modified = {2020-08-20 13:07:06 +0200},
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Date-Modified = {2020-08-20 18:51:19 +0200},
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Doi = {10.1063/1.443164},
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Journal = {J. Chem. Phys.},
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Pages = {1910--1918},
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Title = {A full coupled-cluster singles and doubles model - the inclusion of disconnected triples},
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Volume = {76},
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Year = {1982}}
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Year = {1982},
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Bdsk-Url-1 = {https://doi.org/10.1063/1.443164}}
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@article{Perdew_1996,
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Author = {John P. Perdew and Matthias Ernzerhof and Kieron Burke},
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@ -993,6 +993,7 @@ cancellations of errors.
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%%%%%%%%%%%%%%%%%%%%%%%%
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\begin{acknowledgments}
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A.B was supported by the U.S.~Department of Energy, Office of Science, Basic Energy Sciences, Materials Sciences and Engineering Division, as part of the Computational Materials Sciences Program and Center for Predictive Simulation of Functional Materials.
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This work was performed using HPC resources from GENCI-TGCC (Grand
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Challenge 2019-gch0418) and from CALMIP (Toulouse) under allocation
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2020-18005.
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