Semiempirical SCF MO Methods, Electronic Spectra, and Configurational Interaction

Comprehensive Coordination Chemistry II

Volumn 2, Issue , 2004, Pages 467-489

  Gorelsky, S I ^a  

^a STANFORD UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL CHEMISTRY; DENSITY FUNCTIONAL THEORY; ECONOMIC AND SOCIAL EFFECTS; MOLECULAR ORBITALS; NUMERICAL METHODS;

AB INITIO METHOD; COMPUTATIONAL EFFORT; COMPUTATIONAL TOOLS; DENSITY-FUNCTIONAL METHODS; ELECTRONIC SPECTRUM; HIGH-LEVEL AB INITIO CALCULATIONS; MOLECULAR ORBITAL METHOD; SELF-CONSISTENT FIELD MOLECULAR ORBITALS; SEMI-EMPIRICAL; TRADE OFF;

TRANSITION METALS;

EID: 84902428508     PISSN: None     EISSN: None     Source Type: Book    
DOI: 10.1016/B0-08-043748-6/01182-8     Document Type: Chapter

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