Validation of intermolecular transfer integral and bandwidth calculations for organic molecular materials

Journal of Chemical Physics

Volumn 122, Issue 23, 2005, Pages

  Huang, Jingsong ^a   Kertesz, Miklos ^a  

^a GEORGETOWN UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

HÜCKEL THEORY; INTERMOLECULAR TRANSFER; ORGANIC ELECTROACTIVE CONDENSED MATERIALS; PERDEW-WANG FUNCTIONALS;

BANDWIDTH; ELECTRONIC STRUCTURE; FIELD EFFECT TRANSISTORS; GREEN'S FUNCTION; MATHEMATICAL MODELS; MOLECULAR DYNAMICS; PROBABILITY DENSITY FUNCTION; QUANTUM THEORY; VAN DER WAALS FORCES;

SEMICONDUCTING ORGANIC COMPOUNDS;

EID: 23344437876     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1925611     Document Type: Article

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