Inelastic Current-Voltage Characteristics of Atomic and Molecular Junctions
نویسندگان
چکیده
منابع مشابه
Quantitative current-voltage characteristics in molecular junctions from first principles.
Using self-energy-corrected density functional theory (DFT) and a coherent scattering-state approach, we explain current-voltage (IV) measurements of four pyridine-Au and amine-Au linked molecular junctions with quantitative accuracy. Parameter-free many-electron self-energy corrections to DFT Kohn-Sham eigenvalues are demonstrated to lead to excellent agreement with experiments at finite bias,...
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ژورنال
عنوان ژورنال: Nano Letters
سال: 2005
ISSN: 1530-6984,1530-6992
DOI: 10.1021/nl050410r