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Post-Hartree–Fock
Known as:
Post-Hartree-Fock methods
, Post Hartree–Fock
, Post-Hartree-Fock
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In computational chemistry, post-Hartree–Fock methods are the set of methods developed to improve on the Hartree–Fock (HF), or self-consistent field…
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Related topics
Related topics
22 relations
Ab initio quantum chemistry methods
Basis set (chemistry)
Configuration interaction
Coupled cluster
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Broader (1)
Computational chemistry
Papers overview
Semantic Scholar uses AI to extract papers important to this topic.
Review
2018
Review
2018
Post-Occupancy Evaluation for Adaptive Façades
S. Attia
,
A. L. Navarro
,
M. Juaristi
,
Aurora Monge-Barrio
,
S. Gosztonyi
,
Zein Al-Doughmi
2018
Corpus ID: 135132601
Post-occupancy evaluation is a valuable method of generating information on the performance of adaptive building facades in…
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Highly Cited
2012
Highly Cited
2012
Incorporating context into recommender systems: an empirical comparison of context-based approaches
Umberto Panniello
,
M. Gorgoglione
Electronic Commerce Research
2012
Corpus ID: 17492086
Recently, there has been growing interest in recommender systems (RSs) and particularly in context-aware RSs. Methods for…
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2010
2010
In situ growth of LiFePO4 nanorod arrays under hydrothermal condition
F. Teng
,
S. Santhanagopalan
,
R. Lemmens
,
X. Geng
,
Pragneshkumar Patel
,
D. D. Meng
2010
Corpus ID: 73673518
Highly Cited
2010
Highly Cited
2010
The Hormonal Regulation of Senescence
S. Gan
2010
Corpus ID: 87224637
Senescence occurs ubiquitously in living organisms. At the cellular level, a cell’s life history consists of two processes…
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2009
2009
New intermolecular benchmark calculations on the water dimer: SAPT and supermolecular post‐Hartree–Fock approaches
P. Reinhardt
,
Jean‐Philip Piquemal
2009
Corpus ID: 56304015
In this contribution, we propose accurate intermolecular benchmarks for the 10 standardized water dimers initially proposed by…
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2006
2006
The energetics of oxide surfaces by quantum Monte Carlo
D. Alfé
,
M. Gillan
2006
Corpus ID: 41630095
Density functional theory (DFT) is widely used in surface science, but for some properties the predictions depend strongly on the…
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2004
2004
De Bruijn ERA, Mars RB, & Hulstijn W It wasn't me... or was it? How false feedback affects performance
E. D. Bruijn
,
R. Mars
,
W. Hulstijn
2004
Corpus ID: 8317237
The reinforcement learning model (Holroyd and Coles, 2002) argues that a feedback ERN is generated when the feedback is worse…
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2000
2000
Localization-Induced Band and Cohesive Model
S. Hao
,
Wing Kam Liu
,
D. Qian
2000
Corpus ID: 16621057
A localization-induced cohesive model has been proposed for shear band evolution, crack growth, and fracture. Strain gradient…
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Highly Cited
2000
Highly Cited
2000
Hydrothermal stability of MCM-48 improved by post-synthesis restructuring in salt solution
S. Jun
,
Ji Man Kim
,
R. Ryoo
,
Y. Ahn
,
M. Han
2000
Corpus ID: 55218684
1994
1994
Structure of disiloxane: A semiempirical and Post‐Hartree–Fock study
G. Csonka
,
M. Erdösy
,
J. Réffy
Journal of Computational Chemistry
1994
Corpus ID: 39569929
The semiempirical (MNDO, AM1, and PM3) and ab initio predicted structure of disiloxane is studied with a series of basis sets and…
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