Electronic excitations of C60 fullerene calculated using the ab initio cluster expansion method

Journal of Chemical Physics

Volumn 137, Issue 13, 2012, Pages

  Fukuda, Ryoichi ^a   Ehara, Masahiro ^a  

^a INSTITUTE FOR MOLECULAR SCIENCE   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; CLUSTER EXPANSION METHOD; CLUSTER-CONFIGURATION INTERACTION; ELECTRON CORRELATION EFFECT; ELECTRONIC EXCITATION; ELECTRONIC EXCITED STATE; ENERGY VALUE; FORBIDDEN STATE; INTENSITY BORROWING; LOW-LYING STATE; MANY-BODY; SINGLET EXCITED STATE; VIBRONIC COUPLING; VISIBLE REGION; WEAK ABSORPTION;

DENSITY FUNCTIONAL THEORY; ELECTRIC EXCITATION; ELECTRON ENERGY LEVELS; FULLERENES;

CALCULATIONS;

FULLERENE C60; FULLERENE DERIVATIVE;

ARTICLE; CHEMISTRY; ELECTRON; QUANTUM THEORY;

ELECTRONS; FULLERENES; QUANTUM THEORY;

EID: 84870170100     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4757066     Document Type: Article

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