Open-system Kohn-Sham density functional theory

Journal of Chemical Physics

Volumn 136, Issue 9, 2012, Pages

  Zhou, Yongxi ^a   Ernzerhof, Matthias ^a  

^a UNIVERSITÉ DE MONTRÉAL   (Canada)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLEX POTENTIALS; ELECTRON CURRENTS; ELECTRON TRANSPORT; ELECTRONIC STRUCTURE THEORY; EXCHANGE CURRENT DENSITIES; FINITE SYSTEMS; FIRST-PRINCIPLES; FUNCTIONAL THEORY; HARTREE-FOCK METHODS; HARTREE-FOCK THEORY; IMAGINARY PARTS; MOLECULAR ELECTRONIC DEVICE; NON-HERMITIAN HAMILTONIANS; PROOF OF PRINCIPLES; SOURCE-SINK;

ELECTRON TRANSITIONS; ELECTRON TRANSPORT PROPERTIES; ELECTRONIC STRUCTURE; MOLECULAR PHYSICS;

HAMILTONIANS;

EID: 84863229424     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3687922     Document Type: Article

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