Size extensive modification of local multireference configuration interaction

Journal of Chemical Physics

Volumn 120, Issue 4, 2004, Pages 1693-1704

  Venkatnathan, Arun ^a   Szilva, Andrew B ^a   Walter, Derek ^a   Gdanitz, Robert J ^b,c,d   Carter, Emily A ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

^b NORTH CAROLINA A AND T STATE UNIVERSITY   (United States)

^c UNIVERSITY OF UTAH   (United States)

^d TECHNICAL UNIVERSITY OF BRAUNSCHWEIG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

ALGORITHMS; APPROXIMATION THEORY; CHEMICAL BONDS; CORRELATION METHODS; DISSOCIATION; HYDROCARBONS; LAPLACE TRANSFORMS; PERTURBATION TECHNIQUES; POTENTIAL ENERGY; PROBABILITY DENSITY FUNCTION;

AVERAGED COUPLED PAIR FUNCTIONAL (ACPF) METHOD; MULTIREFERENCE CONFIGURATION INTERACTION (MRCI) METHOD; POTENTIAL ENERGY SURFACES (PES);

MOLECULAR DYNAMICS;

EID: 1242332312     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1635796     Document Type: Article

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