222 citations · 682 across the 5 of their papers we have counts for
5 papers
Unified description of inelastic propensity rules for electron transport through nanoscale junctions
Magnus Paulsson, Thomas Frederiksen, Hiromu Ueba +2
We present a method to analyze the results of first-principles based calculations of electronic currents including inelastic electron-phonon effects. This method allows us to deter…
Long-range repulsive interaction between TTF molecules on a metal surface induced by charge transfer
I. Fernandez-Torrente, S. Monturet, K. J. Franke +3
The low-coverage adsorption of a molecular electron donor, tetrathiafulvalene, on Au(111) is characterized by the spontaneous formation of superlattice of monomers, whose spacing e…
From tunneling to contact: Inelastic signals in an atomic gold junction
Thomas Frederiksen, Nicolas Lorente, Magnus Paulsson +1
The evolution of electron conductance in the presence of inelastic effects is studied as an atomic gold contact is formed evolving from a low-conductance regime (tunneling) to a hi…
Modeling of inelastic transport in one-dimensional metallic atomic wires
Thomas Frederiksen, Mads Brandbyge, Nicolas Lorente +1
Inelastic effects in electron transport through nano-sized devices are addressed with a method based on nonequilibrium Green's functions (NEGF) and perturbation theory to infinite…
Inelastic scattering and local heating in atomic gold wires
Thomas Frederiksen, Mads Brandbyge, Nicolas Lorente +1
We present a method for including inelastic scattering in a first-principles density-functional computational scheme for molecular electronics. As an application, we study two geom…