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Title: Communication: Energy-dependent resonance broadening in symmetric and asymmetric molecular junctions from an ab initio non-equilibrium Green's function approach

Journal Article · · Journal of Chemical Physics
DOI:https://doi.org/10.1063/1.4897448· OSTI ID:1223046

Sponsoring Organization:
USDOE
Grant/Contract Number:
AC02-05CH11231
OSTI ID:
1223046
Alternate ID(s):
OSTI ID: 1420695
Journal Information:
Journal of Chemical Physics, Journal Name: Journal of Chemical Physics Vol. 141 Journal Issue: 13; ISSN 0021-9606
Publisher:
American Institute of PhysicsCopyright Statement
Country of Publication:
United States
Language:
English
Citation Metrics:
Cited by: 20 works
Citation information provided by
Web of Science

References (32)

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Quasiparticle energies and lifetimes in a metallic chain model of a tunnel junction journal April 2013
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Applicability of the wide-band limit in DFT-based molecular transport calculations journal March 2013
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Electrical Transport through Single-Molecule Junctions: From Molecular Orbitals to Conduction Channels journal June 2002
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Comment on “Rethinking first-principles electron transport theories with projection operators: The problems caused by partitioning the basis set” [J. Chem. Phys. 139, 114104 (2013)] journal May 2014
Transmission eigenvalue distributions in highly conductive molecular junctions journal January 2012
Quantitative Current–Voltage Characteristics in Molecular Junctions from First Principles journal February 2012

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