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In this paper we study analytically a one-dimensional model for a semiconductor-metal junction. We study the formation of Tamm states and how they evolve when the semi-infinite semiconductor and metal are coupled together. The non-linear…

Mesoscale and Nanoscale Physics · Physics 2010-01-12 N. M. R. Peres

The theory of transport phenomena in multicomponent electrolyte solutions is presented here through the integration of continuum mechanics, electromagnetism, and non-equilibrium thermodynamics. The governing equations of irreversible…

Statistical Mechanics · Physics 2020-11-02 Kara D. Fong , Helen K. Bergstrom , Bryan D. McCloskey , Kranthi K. Mandadapu

An efficient implementation of the nonequilibrium Green function (NEGF) method combined with the density functional theory (DFT) using localized pseudo-atomic orbitals (PAOs) is presented for electronic transport calculations of a system…

Mesoscale and Nanoscale Physics · Physics 2015-05-14 Taisuke Ozaki , Kengo Nishio , Hiori Kino

We generalize the representation of the real time Green's functions introduced by Langreth and Nordlander [Phys. Rev. B 43 2541 (1991)] and Meir and Wingreen [Phys. Rev. Lett. 68 2512 (1992)] in stationary quantum transport in order to…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Liliana Arrachea

We study superconducting transport in homogeneous wires in the cases of both equilibrium and nonequilibrium quasiparticle populations, using the quasiclassical Green's function technique. We consider superconductors with arbitrary current…

Superconductivity · Physics 2007-05-23 J. Sánchez-Cañizares , F. Sols

We use an adiabatic approximation in terms of instantaneous resonances to study the steady-state and time-dependent transport properties of interacting electrons in biased resonant tunneling heterostructures. This approach leads, in a…

Condensed Matter · Physics 2009-10-28 Carlo Presilla , Johannes Sjöstrand

Transport through semiconductor nanostructures is a quantum-coherent process. This paper focuses on systems in which the electron's dynamics is ballistic and the transport is dominated by the scattering from structure boundaries. Opposite…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 E. R. Racec , P. N. Racec , U. Wulf

We investigate the electronic transport properties of semiconducting ($m$,$n$) carbon nanotubes (CNTs) on the mesoscopic length scale with arbitrarily distributed realistic defects. The study is done by performing quantum transport…

Mesoscale and Nanoscale Physics · Physics 2018-11-26 Fabian Teichert , Andreas Zienert , Jörg Schuster , Michael Schreiber

Quantum transport properties through single polycyclic hydrocarbon molecules attached to two metallic electrodes are studied by the use of Green's function technique. A parametric approach based on the tight-binding model is introduced to…

Mesoscale and Nanoscale Physics · Physics 2009-12-20 Santanu K. Maiti

We present an efficient implemention of a non-equilibrium Green function (NEGF) method for self-consistent calculations of electron transport and forces in nanostructured materials. The electronic structure is described at the level of…

Mesoscale and Nanoscale Physics · Physics 2015-06-04 Jingzhe Chen , Kristian S. Thygesen , Karsten W. Jacobsen

Using the non-equilibrium Keldysh Green's function formalism, we show that the non-equilibrium charge transport in nanoscopic quantum networks takes place via {\it current eigenmodes} that possess characteristic spatial patterns. We…

Mesoscale and Nanoscale Physics · Physics 2012-03-16 Tankut Can , Hui Dai , Dirk K. Morr

We derive a general expression for the electron nonequilibrium (NE) distribution function in the context of steady state quantum transport through a two-terminal nanodevice with interaction. The central idea for the use of NE distributions…

Mesoscale and Nanoscale Physics · Physics 2014-02-26 H. Ness

Nonequilibrium Greens function techniques (NEGF) combined with density functional theory (DFT) calculations have become a standard tool for the description of electron transport through single molecule nanojunctions in the coherent…

Mesoscale and Nanoscale Physics · Physics 2015-11-05 Victor Geskin , Robert Stadler , Jérôme Cornil

We review recent results on electronic and thermal transport in two different quasi one-dimensional systems: Silicon nanowires (SiNW) and atomic gold chains. For SiNW's we compute the ballistic electronic and thermal transport properties on…

Mesoscale and Nanoscale Physics · Physics 2015-05-18 A. P. Jauho , M. Engelund , T. Markussen , M. Brandbyge

We propose a simple scheme that describes accurately essential non-equilibrium effects in nanoscale electronics devices using equilibrium transport theory. The scheme, which is based on the alignment and dealignment of the junction…

Mesoscale and Nanoscale Physics · Physics 2012-10-01 V. M. García-Suárez , J. Ferrer

We present a solution to the problem of AC current partition in a multi-probe mesoscopic conductor within the nonequilibrium Green's function formalism. This allows the derivation of dynamic conductance which is appropriate for…

Condensed Matter · Physics 2009-10-31 Baigeng Wang , Jian Wang , Hong Guo

We demonstrate an efficient nonequilibrium Green's function transport calculation procedure based on the real-space finite-difference method. The direct inversion of matrices for obtaining the self-energy terms of electrodes is…

Materials Science · Physics 2024-01-09 Tomoya Ono , Yoshiyuki Egami , Kikuji Hirose

We present an ab initio approach to electronic transport in nanoscale systems which includes electronic correlations through the GW approximation. With respect to Landauer approaches based on density-functional theory (DFT), we introduce a…

Mesoscale and Nanoscale Physics · Physics 2010-09-08 Pierre Darancet , Andrea Ferretti , Didier Mayou , Valerio Olevano

Quantum dots are versatile systems for exploring quantum transport, electron correlations, and many-body phenomena such as the Kondo effect. While equilibrium properties are well understood through methods like the numerical renormalization…

Strongly Correlated Electrons · Physics 2026-01-06 Gustavo Diniz , Silvio Quintino , Vivian V. França

In this paper, we develop a nonequilibrium theory for transient electron transport dynamics in nanostructures based on the Feynman-Vernon influence functional approach. We extend our previous work on the exact master equation describing the…

Mesoscale and Nanoscale Physics · Physics 2010-08-10 Jinshuang Jin , Matisse W. Y. Tu , Wei-Min Zhang , YiJing Yan