A self-consistent transport model for molecular conduction based on extended Hückel theory with full three-dimensional electrostatics

Journal of Chemical Physics

Volumn 123, Issue 6, 2005, Pages

  Zahid, F ^a   Paulsson, M ^b   Polizzi, E ^a   Ghosh, A W ^a   Siddiqui, L ^a   Datta, S ^a  

^a PURDUE UNIVERSITY   (United States)

^b TECHNICAL UNIVERSITY OF DENMARK   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

IMAGE CHARGES; MOLECULAR CONDUCTION; MOLECULAR TRANSISTORS; QUANTUM TRANSPORT;

ELECTRODES; ELECTROSTATICS; FERMI LEVEL; GREEN'S FUNCTION; MATHEMATICAL MODELS; QUANTUM THEORY;

MOLECULAR DYNAMICS;

EID: 24144450379     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1961289     Document Type: Article

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