The electronic structure of oxo-Mn(salen): Single-reference and multireference approaches

Journal of Chemical Physics

Volumn 124, Issue 14, 2006, Pages

  Sears, John S ^a   Sherrill, C David ^a  

^a GEORGIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPLETE-ACTIVE-SPACE SELF-CONSISTENT-FIELD (CASSCF); ELECTRONIC STATES; HARTREE-FOCK RESULTS;

ELECTRON ENERGY LEVELS; FUNCTION EVALUATION; GEOMETRY; PROBABILITY DENSITY FUNCTION;

ELECTRONIC STRUCTURE;

EID: 34547649109     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2187974     Document Type: Article

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