Quantum properties of atomic-sized conductors
Using remarkably simple experimental techniques it is possible to gently break a metallic
contact and thus form conducting nanowires. During the last stages of the pulling a neck …
contact and thus form conducting nanowires. During the last stages of the pulling a neck …
Electron transmission through molecules and molecular interfaces
A Nitzan - Annual review of physical chemistry, 2001 - annualreviews.org
▪ Abstract Electron transmission through molecules and molecular interfaces has been a
subject of intensive research due to recent interest in electron-transfer phenomena …
subject of intensive research due to recent interest in electron-transfer phenomena …
Density-functional method for nonequilibrium electron transport
We describe an ab initio method for calculating the electronic structure, electronic transport,
and forces acting on the atoms, for atomic scale systems connected to semi-infinite …
and forces acting on the atoms, for atomic scale systems connected to semi-infinite …
Ab initio modeling of quantum transport properties of molecular electronic devices
J Taylor, H Guo, J Wang - Physical Review B, 2001 - APS
We report on a self-consistent ab initio technique for modeling quantum transport properties
of atomic and molecular scale nanoelectronic devices under external bias potentials. The …
of atomic and molecular scale nanoelectronic devices under external bias potentials. The …
First-principles based matrix Green's function approach to molecular electronic devices: general formalism
Transport in molecular electronic devices is different from that in semiconductor mesoscopic
devices in two important aspects:(1) the effect of the electronic structure and (2) the effect of …
devices in two important aspects:(1) the effect of the electronic structure and (2) the effect of …
Inelastic transport theory from first principles: Methodology and application to nanoscale devices
We describe a first-principles method for calculating electronic structure, vibrational modes
and frequencies, electron-phonon couplings, and inelastic electron transport properties of …
and frequencies, electron-phonon couplings, and inelastic electron transport properties of …
Microscopic study of electrical transport through individual molecules with metallic contacts. I. Band lineup, voltage drop, and high-field transport
We present the first in a series of microscopic studies of electrical transport through
individual molecules with metallic contacts. We view the molecules as “heterostructures” …
individual molecules with metallic contacts. We view the molecules as “heterostructures” …
Onset of energy dissipation in ballistic atomic wires
Electronic transport at finite voltages in free-standing gold atomic chains of up to seven
atoms in length is studied at low temperatures using a scanning tunneling microscope. The …
atoms in length is studied at low temperatures using a scanning tunneling microscope. The …
[图书][B] First-principles calculations in real-space formalism: electronic configurations and transport properties of nanostructures
K Hirose, T Ono, Y Fujimoto, S Tsukamoto - 2005 - books.google.com
With cutting-edge materials and minute electronic devices being produced by the latest
nanoscale fabrication technology, it is essential for scientists and engineers to rely on first …
nanoscale fabrication technology, it is essential for scientists and engineers to rely on first …
Conductance, curves, and negative differential resistance of carbon atomic wires
B Larade, J Taylor, H Mehrez, H Guo - Physical Review B, 2001 - APS
We report on a first-principles analysis of transport properties of carbon atomic wires in
contact with two metallic electrodes under external bias. The equilibrium conductance of the …
contact with two metallic electrodes under external bias. The equilibrium conductance of the …