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One of the most important problems in nanoelectronic device theory is to estimate how fast or how slow a quantum device can turn on/off a current. For an arbitrary noninteracting phase-coherent device scattering region connected to the…

Mesoscale and Nanoscale Physics · Physics 2010-09-17 Joseph Maciejko , Jian Wang , Hong Guo

We investigate theoretically nonequilibrium quantum transport in a quantum dot attached to a Majorana bound state. Our approach is based on the Keldysh Green's function formalism, which allows us to investigate the electric current…

Strongly Correlated Electrons · Physics 2014-03-17 S. J. S. da Silva , A. C. Seridonio , J. Del Nero , F. M. Souza

We give a detailed presentation of our recent scheme to include correlation effects in molecular transport calculations using the GW approximation within the non-equilibrium Keldysh formalism. We restrict the GW self-energy to the central…

Materials Science · Physics 2009-11-13 Kristian S. Thygesen , Angel Rubio

This chapter of "The Oxford Handbook of Nanoscience and Technology: Frontiers and Advances" reviews nonequilibrium Green function (NEGF) approach to modeling spin current generation, transport, and detection in semiconductor nanostructures…

Mesoscale and Nanoscale Physics · Physics 2009-07-24 Branislav K. Nikolic , Liviu P. Zarbo , Satofumi Souma

We present a non-perturbative Floquet-based non-equilibrium Green's function (NEGF) method to study electron transport in a quantum system driven simultaneously by multiple independent terms (multi-mode). We first derive the two-mode…

Other Condensed Matter · Physics 2026-05-20 Vahid Mosallanejad , Wenjie Dou

Using non-equilibrium Green's functions combined with many-body perturbation theory, we have calculated steady-state densities and currents through short interacting chains subject to a finite electric bias. By using a steady-state…

Mesoscale and Nanoscale Physics · Physics 2016-04-18 Daniel Karlsson , Claudio Verdozzi

We consider a small interacting sample coupled to several non-interacting leads. Initially, the system is at thermal equilibrium. At some instant $t_0$ the system is set into the so called partition-free transport scenario by turning on a…

Mathematical Physics · Physics 2019-01-24 H. D. Cornean , V. Moldoveanu , C. -A. Pillet

Simulations of interacting electrons and bosons out of equilibrium, starting from first principles and aiming at realistic multiscale scenarios, is a grand theoretical challenge. Here, using the formalism of nonequilibrium Green's functions…

Strongly Correlated Electrons · Physics 2022-04-06 Yaroslav Pavlyukh , Enrico Perfetto , Daniel Karlsson , Robert van Leeuwen , Gianluca Stefanucci

To explore whether the density-functional theory non-equilibrium Green's function formalism (DFT-NEGF) provides a rigorous framework for quantum transport, we carried out time-dependent density functional theory (TDDFT) calculations of the…

Materials Science · Physics 2011-07-01 ChiYung Yam , Xiao Zheng , GuanHua Chen , Yong Wang , Thomas Frauenheim , Thomas A. Niehaus

We present a set of modified quantum rate equations, with the help of the nonequilibrium Green's function and slave-particle techniques along with the correct quantization, for description of the quantum transport through an interacting…

Mesoscale and Nanoscale Physics · Physics 2009-11-10 Bing Dong , H. L. Cui , X. L. Lei

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

In a recent article, Chiang and Hsu [The Journal of Chemical Physics 153, 044103 (2020)] examine one and two site electronic junctions identically connected to finite reservoirs. For these two examples, they derive analytical solutions, as…

Quantum Physics · Physics 2021-02-23 Michael Zwolak

An open quantum system consists of leads connected to a device of interest. Within the nonequilibrium Green's function technique, we examine the replacement of leads by self-energies in continuum calculations. Our starting point is a…

Mesoscale and Nanoscale Physics · Physics 2009-11-07 Fredrick Michael , M. D. Johnson

A formulation for transport in an inhomogeneous, interacting electron gas is described. Electronic current is induced by a constraint condition imposed as a vector Lagrange multiplier. Constrained minimization of the total energy functional…

Condensed Matter · Physics 2009-11-07 D. S. Kosov , J. C. Greer

So far transport properties of nanoscale contacts have been mostly studied within the static scattering approach. The electron dynamics and the transient behavior of current flow, however, remain poorly understood. We present a numerical…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Na Sai , Neil Bushong , Ryan Hatcher , Massimiliano Di Ventra

Nonequilibrium Green's functions provide a powerful tool for computing the dynamical response and particle exchange statistics of coupled quantum systems. We formulate the theory in terms of the density matrix in Liouville space and…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 U. Harbola , S. Mukamel

We investigate the nonequilibrium transport properties of a double quantum dot system connected in parallel to two leads, including intradot electron-electron interaction. In the absence of interactions the system supports a bound state in…

Mesoscale and Nanoscale Physics · Physics 2016-07-04 Miguel A. Sierra , M. Saiz-Bretin , F. Dominguez-Adame , David Sanchez

The conductance of one-dimensional interacting electron systems is calculated in a manner similar to Landauer's argument for non-interacting systems. Unlike in previous studies in which the Kubo formula was used, the conductance is directly…

Mesoscale and Nanoscale Physics · Physics 2015-06-25 Akira Shimizu

We study the interacting quantum dot coupled to the normal and superconducting leads by means of a continuous-time quantum Monte Carlo method in the Keldysh-Nambu formalism. Deducing the steady current through the quantum dot under a finite…

Strongly Correlated Electrons · Physics 2014-11-10 Akihisa Koga

A many-body theory of molecular junction transport based on nonequilibrium Green's functions is developed, which treats coherent quantum effects and Coulomb interactions on an equal footing. The central quantity of the many-body theory is…

Mesoscale and Nanoscale Physics · Physics 2009-07-07 J. P. Bergfield , C. A. Stafford