Multi-component symmetry-projected approach for molecular ground state correlations.
about
Excited electronic states from a variational approach based on symmetry-projected Hartree-Fock configurations.Communication: Configuration interaction combined with spin-projection for strongly correlated molecular electronic structures.General technique for analytical derivatives of post-projected Hartree-Fock.Hartree-Fock symmetry breaking around conical intersections.The chemical bond as an emergent phenomenon.Merging symmetry projection methods with coupled cluster theory: Lessons from the Lipkin model Hamiltonian.A hybrid configuration interaction treatment based on seniority number and excitation schemes.Time-dependent projected Hartree-Fock.Analytic energy gradient for the projected Hartree-Fock method.Global solutions of restricted open-shell Hartree-Fock theory from semidefinite programming with applications to strongly correlated quantum systems.Analytic energy gradient of projected Hartree-Fock within projection after variation.
P2860
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P2860
Multi-component symmetry-projected approach for molecular ground state correlations.
description
2013 nî lūn-bûn
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2013年の論文
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2013年学术文章
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name
Multi-component symmetry-projected approach for molecular ground state correlations.
@en
Multi-component symmetry-projected approach for molecular ground state correlations.
@nl
type
label
Multi-component symmetry-projected approach for molecular ground state correlations.
@en
Multi-component symmetry-projected approach for molecular ground state correlations.
@nl
prefLabel
Multi-component symmetry-projected approach for molecular ground state correlations.
@en
Multi-component symmetry-projected approach for molecular ground state correlations.
@nl
P2093
P2860
P356
P1476
Multi-component symmetry-projected approach for molecular ground state correlations.
@en
P2093
Carlos A Jiménez-Hoyos
Gustavo E Scuseria
R Rodríguez-Guzmán
P2860
P304
P356
10.1063/1.4832476
P407
P577
2013-11-01T00:00:00Z