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A quantum transport model incorporating spin scattering processes is presented using the non-equilibrium Green's function (NEGF) formalism within the self-consistent Born approximation. This model offers a unified approach by capturing the…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 Ahmet Ali Yanik , Gerhard Klimeck , Supriyo Datta

Quantum states can be described equivalently by density matrices, Wigner functions or quantum tomograms. We analyze the accuracy and performance of three related semiclassical approaches to quantum dynamics, in particular with respect to…

Quantum Physics · Physics 2009-08-27 G. Schubert , V. S. Filinov , K. Matyash , R. Schneider , H. Fehske

This paper discusses the technical aspects - mathematical and numerical - associated with the numerical simulations of a mesoscopic system in the time domain (i.e. beyond the single frequency AC limit). After a short review of the state of…

Mesoscale and Nanoscale Physics · Physics 2014-04-04 Benoit Gaury , Joseph Weston , Matthieu Santin , Manuel Houzet , Christoph Groth , Xavier Waintal

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

The work distribution is a fundamental quantity in nonequilibrium thermodynamics mainly due to its connection with fluctuations theorems. Here we develop a semiclassical approximation to the work distribution for a quench process in chaotic…

Quantum Physics · Physics 2017-05-17 Ignacio García-Mata , Augusto J. Roncaglia , Diego A. Wisniacki

Based on a proposed classical explanation, the quantum mechanical "decay of the wave packet" is shown to simply result from sub-quantum diffusion with a specific diffusivity varying in time due to a particle's changing thermal environment.…

Quantum Physics · Physics 2012-05-22 Johannes Mesa Pascasio , Siegfried Fussy , Herbert Schwabl , Gerhard Groessing

We investigate the transition from quantum to classical mechanics using a one-dimensional free particle model. In the classical analysis, we consider the initial positions and velocities of the particle drawn from Gaussian distributions.…

Quantum Physics · Physics 2024-05-30 E. Aldo Arroyo

The simulation of quantum transport in nanodevices requires the solution of the Dyson and Keldysh equations, a task dominated by the inversion of massive, block-tridiagonal matrices. While the Recursive Green's Function (RGF) method has…

Numerical Analysis · Mathematics 2026-05-20 Edoardo Di Napoli , Alessandro Pecchia , Gustavo Ramirez-Hidalgo

There is considerable interest in the application of quantum information science to advance computations in plasma physics. Many of the topics in fusion plasma physics are classical in nature. In order to implement them on quantum computers…

Plasma Physics · Physics 2024-06-12 Abhay K. Ram , George Vahala , Linda Vahala , Min Soe

The dynamics of strongly correlated fermions following an external excitation reveals extremely rich collective quantum effects. Examples are fermionic atoms in optical lattices, electrons in correlated materials, and dense quantum plasmas.…

Strongly Correlated Electrons · Physics 2020-02-26 Niclas Schluenzen , Jan-Philip Joost , Michael Bonitz

State-of-the-art industrial semiconductor device modeling is based on highly efficient Drift-Diffusion (DD) models that include some quantum corrections for nanodevices. In contrast, latest academic quantum transport models are based on the…

An effective action technique for the time evolution of a closed system consisting of one or more mean fields interacting with their quantum fluctuations is presented. By marrying large $N$ expansion methods to the Schwinger-Keldysh closed…

High Energy Physics - Phenomenology · Physics 2008-11-26 Fred Cooper , Salman Habib , Yuval Kluger , Emil Mottola , Juan Pablo Paz , Paul R. Anderson

The calculation of work distributions in a quantum many-body system is of significant importance and also of formidable difficulty in the field of nonequilibrium quantum statistical mechanics. To solve this problem, inspired by…

Statistical Mechanics · Physics 2020-07-01 Zhaoyu Fei , H. T. Quan

The Non-Equilibrium Green Function (NEGF) method was established in the 1960's through the classic work of Schwinger, Kadanoff, Baym, Keldysh and others using many-body perturbation theory (MBPT) and the diagrammatic theory for…

Mesoscale and Nanoscale Physics · Physics 2022-11-24 Kerem Y. Camsari , Shuvro Chowdhury , Supriyo Datta

We simulate the transformation of a classical fluid into a quantum-like (super)-fluid by the application of a generalized quantum potential through a retro-active loop. This numerical experiment is exemplified in the case of a non-spreading…

Quantum Physics · Physics 2007-05-23 L. Nottale , T. Lehner

Numerical simulation of individual open quantum systems has proven advantages over density operator computations. Quantum state diffusion with a moving basis (MQSD) provides a practical numerical simulation method which takes full advantage…

Quantum Physics · Physics 2009-10-28 R. Schack , T. A. Brun , I. C. Percival

Time-dependent nonequilibrium Green's functions (TDNEGF) are shown to provide a flexible, effective tool for the description of quantum mechanical single particle scattering on a spatially localized, time-dependent potential. Focusing on…

Quantum Physics · Physics 2017-12-07 Peter Foldi

We study the nonlinear elastic quantum electronic transport properties of nanoscopic devices using the Nonequilibrium Green's function (NEGF) method. The Green's function method allows us to expand the $I-V$ characteristics of a given…

Mesoscale and Nanoscale Physics · Physics 2009-07-14 Alexis R. Hernández , Caio H. Lewenkopf

The Non-Equilibrium Green's Function (NEGF) method combined with ab initio calculations has been widely used to study charge transport in molecular junctions. However, the significant computational demands of high-resolution calculations…

Computational Physics · Physics 2026-05-19 Xuan Ji , Qiang Qi , Yueqi Chen , Chen Zhou , Xi Yu

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