Benchmark configuration interaction spectroscopic constants for X 1Σq+ C2 and X 1Σ+ CN+

Journal of Chemical Physics

Volumn 108, Issue 16, 1998, Pages 6717-6721

  Leininger, Matthew L ^a   Sherrill, C David ^a,b   Allen, Wesley D ^a   Schaefer III, Henry F ^a  

^a UNIVERSITY OF GEORGIA   (United States)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CALCULATIONS; CONVERGENCE OF NUMERICAL METHODS; CORRELATION METHODS; ELECTRON ENERGY LEVELS; ELECTRONIC STRUCTURE; POLARIZATION;

FULL CONFIGURATION INTERACTION; MOLECULAR PROPERTY; POTENTIAL ENERGY SURFACES; QUARTIC FORCE FIELD;

QUANTUM THEORY;

EID: 0032048430     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.476087     Document Type: Article

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