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new figures from Enzo

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Pierre-Francois Loos 2021-01-17 21:28:19 +01:00
parent e2e6567947
commit 2632bf1fae
4 changed files with 5 additions and 9 deletions
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Manuscript/H2_BHHLYP.pdf
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Manuscript/sfBSE.bib
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@ -1,7 +1,7 @@
%% This BibTeX bibliography file was created using BibDesk. %% This BibTeX bibliography file was created using BibDesk.
%% http://bibdesk.sourceforge.net/ %% http://bibdesk.sourceforge.net/
%% Created for Pierre-Francois Loos at 2021-01-17 21:22:19 +0100 %% Created for Pierre-Francois Loos at 2021-01-17 21:28:04 +0100
%% Saved with string encoding Unicode (UTF-8) %% Saved with string encoding Unicode (UTF-8)
@ -137,14 +137,12 @@
@article{Krylov_2000b, @article{Krylov_2000b,
author = {Krylov,Anna I.}, author = {Krylov,Anna I.},
date-added = {2021-01-10 15:01:14 +0100}, date-added = {2021-01-10 15:01:14 +0100},
date-modified = {2021-01-10 15:01:23 +0100}, date-modified = {2021-01-17 21:27:52 +0100},
doi = {10.1063/1.1308557}, doi = {10.1063/1.1308557},
eprint = {https://doi.org/10.1063/1.1308557}, journal = {J. Chem. Phys.},
journal = {The Journal of Chemical Physics},
number = {15}, number = {15},
pages = {6052-6062}, pages = {6052-6062},
title = {Spin-contamination of coupled-cluster wave functions}, title = {Spin-contamination of coupled-cluster wave functions},
url = {https://doi.org/10.1063/1.1308557},
volume = {113}, volume = {113},
year = {2000}, year = {2000},
Bdsk-Url-1 = {https://doi.org/10.1063/1.1308557}} Bdsk-Url-1 = {https://doi.org/10.1063/1.1308557}}
@ -1681,14 +1679,12 @@
@article{Krylov_2000a, @article{Krylov_2000a,
author = {Krylov,Anna I. and Sherrill,C. David and Head-Gordon,Martin}, author = {Krylov,Anna I. and Sherrill,C. David and Head-Gordon,Martin},
date-added = {2020-12-06 14:34:27 +0100}, date-added = {2020-12-06 14:34:27 +0100},
date-modified = {2021-01-10 15:01:27 +0100}, date-modified = {2021-01-17 21:28:04 +0100},
doi = {10.1063/1.1311292}, doi = {10.1063/1.1311292},
eprint = {https://doi.org/10.1063/1.1311292}, journal = {J. Chem. Phys.},
journal = {The Journal of Chemical Physics},
number = {16}, number = {16},
pages = {6509-6527}, pages = {6509-6527},
title = {Excited states theory for optimized orbitals and valence optimized orbitals coupled-cluster doubles models}, title = {Excited states theory for optimized orbitals and valence optimized orbitals coupled-cluster doubles models},
url = {https://doi.org/10.1063/1.1311292},
volume = {113}, volume = {113},
year = {2000}, year = {2000},
Bdsk-Url-1 = {https://doi.org/10.1063/1.1311292}} Bdsk-Url-1 = {https://doi.org/10.1063/1.1311292}}