Quantitative current-voltage characteristics in molecular junctions from first principles.
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Charge transport and rectification in molecular junctions formed with carbon-based electrodesMolecular diodes enabled by quantum interference.Reliable energy level alignment at physisorbed molecule-metal interfaces from density functional theory.Can molecular projected density of states (PDOS) be systematically used in electronic conductance analysis?Voltage tuning of vibrational mode energies in single-molecule junctions.Length dependence of electron transport through molecular wires--a first principles perspective.Conformation-controlled electron transport in single-molecule junctions containing oligo(phenylene ethynylene) derivatives.Quantum Transport Through Tunable Molecular Diodes.Electrical properties and mechanical stability of anchoring groups for single-molecule electronics.Rethinking first-principles electron transport theories with projection operators: the problems caused by partitioning the basis set.Communication: energy-dependent resonance broadening in symmetric and asymmetric molecular junctions from an ab initio non-equilibrium Green's function approach.Dynamical coupling and negative differential resistance from interactions across the molecule-electrode interface in molecular junctions.Modeling ion sensing in molecular electronics.Development and application of a 2-electron reduced density matrix approach to electron transport via molecular junctions.Perspective: Theory of quantum transport in molecular junctions.The image charge effect and vibron-assisted processes in Coulomb blockade transport: a first principles approach.Transition from Strong to Weak Electronic Coupling in a Single-Molecule Junction.
P2860
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P2860
Quantitative current-voltage characteristics in molecular junctions from first principles.
description
2012 nî lūn-bûn
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2012年の論文
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2012年学术文章
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2012年学术文章
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2012年学术文章
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2012年学术文章
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2012年学术文章
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name
Quantitative current-voltage c ...... nctions from first principles.
@en
Quantitative current-voltage c ...... nctions from first principles.
@nl
type
label
Quantitative current-voltage c ...... nctions from first principles.
@en
Quantitative current-voltage c ...... nctions from first principles.
@nl
prefLabel
Quantitative current-voltage c ...... nctions from first principles.
@en
Quantitative current-voltage c ...... nctions from first principles.
@nl
P2093
P356
P1433
P1476
Quantitative current-voltage c ...... nctions from first principles.
@en
P2093
Jeffrey B Neaton
Jonathan R Widawsky
Pierre Darancet
P304
P356
10.1021/NL3033137
P407
P577
2012-11-28T00:00:00Z