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Journal of Chemical Physics

Volumn 115, Issue 9, 2001, Pages 4292-4299

Charge transfer and "band lineup" in molecular electronic devices: A chemical and numerical interpretation

(3) Xue, Yongqiang a,b Datta, Supriyo b Ratner, Mark A a

a NORTHWESTERN UNIVERSITY (United States)

b PURDUE UNIVERSITY (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ADSORPTION; BAND STRUCTURE; CHARGE TRANSFER; CHEMICAL BONDS; CURRENT VOLTAGE CHARACTERISTICS; ELECTRODES; ELECTRONIC DENSITY OF STATES; ELECTRONIC STRUCTURE; FERMI LEVEL; GREEN'S FUNCTION; MATHEMATICAL MODELS; MOLECULAR STRUCTURE; PROBABILITY DENSITY FUNCTION; SURFACE CHEMISTRY;

MOLECULAR ELECTRONIC DEVICES; MOLECULAR ORBITALS;

MOLECULAR DYNAMICS;

EID: 0035449733 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1391253 Document Type: Article

Times cited : (497)

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