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The performance of phaseless auxiliary-field quantum Monte Carlo on the ground state electronic energy of benzene
Author(s):
Joonho Lee
1
,
Fionn D. Malone
2
,
David R. Reichman
1
Publication date
Created:
September 28 2020
Publication date
(Print):
September 28 2020
Journal:
The Journal of Chemical Physics
Publisher:
AIP Publishing
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PubMed
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Advances in molecular quantum chemistry contained in the Q-Chem 4 program package
Yihan Shao
,
Zhengting Gan
,
Evgeny Epifanovsky
…
(2015)
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Basis-set convergence of correlated calculations on water
Wim Klopper
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Henrik Koch
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Jozef Noga
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(1997)
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Py SCF: the Python-based simulations of chemistry framework
Garnet Kin-Lic Chan
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James D. McClain
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Sheng Jie Guo
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(2018)
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Author and article information
Contributors
Joonho Lee:
(View ORCID Profile)
David R. Reichman:
(View ORCID Profile)
Journal
Title:
The Journal of Chemical Physics
Abbreviated Title:
J. Chem. Phys.
Publisher:
AIP Publishing
ISSN (Print):
0021-9606
ISSN (Electronic):
1089-7690
Publication date Created:
September 28 2020
Publication date (Print):
September 28 2020
Volume
: 153
Issue
: 12
Page
: 126101
Affiliations
[
1
]
Department of Chemistry, Columbia University, New York, New York 10027, USA
[
2
]
Quantum Simulations Group, Lawrence Livermore National Laboratory, 7000 East Avenue, Livermore, California 94551, USA
Article
DOI:
10.1063/5.0024835
PubMed ID:
33003714
SO-VID:
e3cf9f11-2f8d-4e2b-97e8-ac8b6251c6e5
Copyright ©
© 2020
License:
https://publishing.aip.org/authors/rights-and-permissions
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