Local correlation in the virtual space in multireference singles and double configuration interaction

Journal of Chemical Physics

Volumn 118, Issue 18, 2003, Pages 8127-8139

  Walter, Derek ^a   Venkatnathan, Arun ^a   Carter, Emily A ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; ATOMIC PHYSICS; BINDING ENERGY; BUTANE; CALCULATIONS; CHEMICAL BONDS; COMPUTER SIMULATION; ELECTRON ENERGY LEVELS; HAMILTONIANS; MOLECULAR PHYSICS; MOLECULAR STRUCTURE; NUMERICAL ANALYSIS;

BOND DISSOCIATION ENERGY; MULTIREFERENCE CONFIGURATION INTERACTION; POTENTIAL ENERGY SURFACE; QUANTUM CHEMISTRY CALCULATION;

QUANTUM THEORY;

EID: 0038476426     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1565314     Document Type: Article

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