First-principles based matrix Green's function approach to molecular electronic devices: general formalism

Y Xue, S Datta, MA Ratner - Chemical Physics, 2002 - Elsevier
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 …

[图书][B] Handbook of nanoscience, engineering, and technology

WA Goddard III, D Brenner, SE Lyshevski, GJ Iafrate - 2002 - taylorfrancis.com
Nanotechnology, science, and engineering spearhead the 21st century revolution that is
leading to fundamental breakthroughs in the way materials, devices, and systems are …

Current-driven dynamics in molecular-scale devices

T Seideman - Journal of Physics: Condensed Matter, 2003 - iopscience.iop.org
We review recent theoretical work on current-triggered processes in molecular-scale
devices—a field at the interface between solid state physics and chemical dynamics with …

Atomic-scale nanowires: Physical and electronic structure

DR Bowler - Journal of Physics: Condensed Matter, 2004 - iopscience.iop.org
The technology to build and study nanowires with sizes ranging from individual atoms to
tens of nanometres has been developing rapidly over the last few years. We survey the …

Semiempirical model for nanoscale device simulations

K Stokbro, DE Petersen, S Smidstrup, A Blom… - Physical Review B …, 2010 - APS
We present a semiempirical model for calculating electron transport in atomic-scale devices.
The model is an extension of the extended Hückel method with a self-consistent Hartree …

Self-assembled monolayer organic field-effect transistors

JH Schön, H Meng, Z Bao - Nature, 2001 - nature.com
The use of individual molecules as functional electronic devices was proposed in 1974 (ref.).
Since then, advances in the field of nanotechnology have led to the fabrication of various …

Molecular spintronics: spin-dependent electron transport in molecular wires

EG Emberly, G Kirczenow - Chemical Physics, 2002 - Elsevier
We present a theoretical study of spin-dependent transport through molecular wires bridging
ferromagnetic metal nanocontacts. We extend to magnetic systems a recently proposed …

Gating of a molecular transistor: Electrostatic and conformational

AW Ghosh, T Rakshit, S Datta - Nano Letters, 2004 - ACS Publications
We derive a general result that can be used to evaluate and compare the transconductance
of different field-effect mechanisms in molecular transistors, both electrostatic and …

Theory of current and shot-noise spectroscopy in single-molecular quantum dots with a phonon mode

JX Zhu, AV Balatsky - Physical Review B, 2003 - APS
Abstract Using the Keldysh nonequilibrium Green function technique, we study the current
and shot-noise spectroscopy of a single-molecular quantum dot coupled to a local phonon …

Models of electron transport through organic molecular monolayers self-assembled on nanoscale metallic contacts

EG Emberly, G Kirczenow - Physical Review B, 2001 - APS
We propose a model of electrical conduction through self-assembled monolayers (SAM's) of
organic molecules that bridge the gap between a pair of nanoscale metallic contacts. In this …