Multicentered valence electron effective potentials: A solution to the link atom problem for ground and excited electronic states

Journal of Chemical Physics

Volumn 124, Issue 8, 2006, Pages

  Slavíček, Petr ^a   Martínez, Todd J ^a  

^a UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC EXCITATION; FUNCTIONAL GROUPS; MULTICENTERED VALENCE ELECTRON EFFECTIVE POTENTIAL (MC-VEEP);

ELECTRON ENERGY LEVELS; ELECTROSTATICS; MATHEMATICAL MODELS; QUANTUM THEORY;

ELECTRONS;

EID: 33644605066     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2173992     Document Type: Article

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