Density matrix formulation of the nuclear-electronic orbital approach with explicit electron-proton correlation.
about
Time-dependent multiconfiguration theory for describing molecular dynamics in diatomic-like molecules.Nuclear-electronic orbital reduced explicitly correlated Hartree-Fock approach: Restricted basis sets and open-shell systems.Localized Hartree product treatment of multiple protons in the nuclear-electronic orbital framework.Calculation of electron-hole recombination probability using explicitly correlated Hartree-Fock method.Alternative wavefunction ansatz for including explicit electron-proton correlation in the nuclear-electronic orbital approach.Properties of the exact universal functional in multicomponent density functional theory.Analysis of electron-positron wavefunctions in the nuclear-electronic orbital framework.The two-component quantum theory of atoms in molecules (TC-QTAIM): foundations
P2860
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P2860
Density matrix formulation of the nuclear-electronic orbital approach with explicit electron-proton correlation.
description
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name
Density matrix formulation of ...... t electron-proton correlation.
@en
Density matrix formulation of ...... t electron-proton correlation.
@nl
type
label
Density matrix formulation of ...... t electron-proton correlation.
@en
Density matrix formulation of ...... t electron-proton correlation.
@nl
prefLabel
Density matrix formulation of ...... t electron-proton correlation.
@en
Density matrix formulation of ...... t electron-proton correlation.
@nl
P2860
P356
P1476
Density matrix formulation of ...... t electron-proton correlation.
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P2093
Arindam Chakraborty
P2860
P304
P356
10.1063/1.2998312
P407
P577
2008-11-01T00:00:00Z