A theoretical study of molecular conduction. II. A Hartree-Fock approach to transmission probability

Journal of Chemical Physics

Volumn 123, Issue 16, 2005, Pages

  Shimazaki, Tomomi ^a   Maruyama, Hitoshi ^a   Asai, Yoshihiro ^a,b   Yamashita, Koichi ^a  

^a UNIVERSITY OF TOKYO   (Japan)

^b NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY AIST   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRON TRANSMISSION PROBABILITY; HARTREE-FOCK METHOD; ORBITAL INTERFERENCE; SPECTRUM EXPRESSION;

ELECTRODES; GREEN'S FUNCTION; HAMILTONIANS; PROBABILITY;

MOLECULAR DYNAMICS;

EID: 27344447142     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2074127     Document Type: Article

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