A theoretical study of molecular conduction. V. NEGF-based MP2 approach

International Journal of Quantum Chemistry

Volumn 109, Issue 9, 2009, Pages 1834-1840

  Shimazaki, Tomomi ^a   Yamashita, Koichi ^a  

^a UNIVERSITY OF TOKYO   (Japan)

Author keywords

Electron correlation; Molecular conduction; Molecular electronics; MP2; Nonequilibrium Green's function

Indexed keywords

ACHIEVING IT; ISOLATED MOLECULES; MOLECULAR CONDUCTION; MOLECULAR-SCALE ELECTRONICS; MP2; NONEQUILIBRIUM GREEN'S FUNCTION; SECOND ORDERS; SEMI-INFINITE ELECTRODE; SINGLE MOLECULE; THEORETICAL STUDY;

ELECTRON CORRELATIONS; ELECTRON DENSITY MEASUREMENT; ELECTRONS; MOLECULAR ELECTRONICS; MOLECULES;

GREEN'S FUNCTION;

EID: 67649827609     PISSN: 00207608     EISSN: 1097461X     Source Type: Journal    
DOI: 10.1002/qua.21994     Document Type: Article

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