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We describe a method and its implementation for calculating electronic structure and electron transport without approximating the structure using periodic super-cells. This effectively removes spurious periodic images and interference…

Mesoscale and Nanoscale Physics · Physics 2019-11-27 Nick Papior , Gaetano Calogero , Susanne Leitherer , Mads Brandbyge

Many-particle QED is applied to kinetic theory of radiative processes in many- component plasmas with relativistic electrons and nonrelativistic heavy particles. Within the framework of nonequilibrium Green's function technique, transport…

Plasma Physics · Physics 2015-05-13 V. G. Morozov , G. Roepke

Based on the nonequilibrium Green's function (NEGF), we develop a quantum nonlinear theory to study time-dependent ac transport properties in the low frequency and nonlinear bias voltage regimes. By expanding NEGF in terms of time to the…

Mesoscale and Nanoscale Physics · Physics 2023-11-07 Lei Zhang , Fuming Xu , Jian Chen , Yanxia Xing , Jian Wan

The traditional atomistic Green's function (AGF) was formulated in the harmonic regime, preventing it from capturing the role of anharmonicity in interfacial thermal transport. Incorporating anharmonicity into AGF has long been desired but…

Mesoscale and Nanoscale Physics · Physics 2020-06-02 Jinghang Dai , Zhiting Tian

Recently, many works have experimentally demonstrated near-field radiative heat transfer (NFRHT) exceeding the far-field blackbody limit between planar surfaces. Due to the difficulties associated with maintaining the nanosize gaps required…

Applied Physics · Physics 2019-07-02 John DeSutter , Lei Tang , Mathieu Francoeur

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

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

Near-field radiative heat transfer between bodies at the nanoscale can surpass blackbody limits on thermal radiation by orders of magnitude due to contributions from evanescent electromagnetic fields, which carry no energy to the far-field.…

Classical Physics · Physics 2020-01-15 Sean Molesky , Prashanth S. Venkataram , Weiliang Jin , Alejandro W. Rodriguez

Heat radiation and near-field radiative heat transfer can be strongly manipulated by adjusting geometrical shapes, optical properties, or the relative positions of the objects involved. Typically these objects are considered as embedded in…

Classical Physics · Physics 2017-02-15 Boris Müller , Roberta Incardone , Mauro Antezza , Thorsten Emig , Matthias Krüger

The capability of hydrodynamics to accurately describe slow and long-wavelength fluctuations around non-equilibrium steady states (NESS), characterized by a stationary flow of energy or matter in the presence of a driving force, remains an…

Statistical Mechanics · Physics 2024-11-06 Daniel K. Brattan , Masataka Matsumoto , Matteo Baggioli , Andrea Amoretti

We propose an efficient procedure to obtain Green's functions by combining the shifted conjugate orthogonal conjugate gradient (shifted COCG) method with the nonequilibrium Green's function (NEGF) method based on a real-space…

Computational Physics · Physics 2015-02-03 Shigeru Iwase , Takeo Hoshi , Tomoya Ono

In the present work, we study heat transport through a one dimensional time-dependent nanomechanical system. The microscopic model consists of coupled chains of atoms, considering local and non-local interactions between particles. We show…

Mesoscale and Nanoscale Physics · Physics 2022-05-25 Natalia Beraha , M. Florencia Carusela , Alejandro Soba

Nanoconfinement induces many intriguing non-Fourier heat conduction phenomena that have been extensively studied in recent years, such as the nonlinear temperature profile inside the devices, the temperature jumps near the contacts, and the…

Mesoscale and Nanoscale Physics · Physics 2019-10-16 Yue Hu , Xiaokun Gu , Tianli Feng , Zheyong Fan , Hua Bao

Using non-equilibrium Green's functions (NEGF), we calculate the current through an interacting region connected to non-interacting leads. The problem is reformulated in such a way that a Landauer-like term appears in the current as well as…

Mesoscale and Nanoscale Physics · Physics 2015-05-19 H. Ness , L. K. Dash , R. W. Godby

Electron transport through a diatomic molecular tunnel junction shows wave like interference phenomenon. By using Keldysh non-equilibrium Green's function (NEGF) theory, we have explicitly presented current and differential conductance…

Mesoscale and Nanoscale Physics · Physics 2012-12-18 Muhammad Imran

In this paper, we propose a novel neural network approach, termed DeepRTE, to address the steady-state Radiative Transfer Equation (RTE). The RTE is a differential-integral equation that governs the propagation of radiation through a…

Machine Learning · Computer Science 2025-10-30 Yekun Zhu , Min Tang , Zheng Ma

The phonon Boltzmann transport equation (BTE) has been widely utilized to study thermal transport in solids. While for a number of materials the exact solution to the BTE has been obtained for a uniform heat flow, problems arising in…

Mesoscale and Nanoscale Physics · Physics 2021-11-17 Vazrik Chiloyan , Samuel Huberman , Zhiwei Ding , Jonathan Mendoza , Alexei A. Maznev , Keith A. Nelson , Gang Chen

Due to their conceptual appeal and computational convenience, two-level systems (TLS) and their generalisations are often used to investigate nonlinear behavior in quantum optics, and to assess the applicability of theoretical methods. Here…

Quantum Physics · Physics 2023-12-22 Megha Gopalakrishna , Yaroslav Pavlyukh , Claudio Verdozzi

We review recent progress in developing effective field theories (EFTs) for non-equilibrium processes at finite temperature, including a new formulation of fluctuating hydrodynamics, and a new proof of the second law of thermodynamics.…

High Energy Physics - Theory · Physics 2018-05-25 Paolo Glorioso , Hong Liu

We present a method which uses density functional theory (DFT) to treat transport through a single molecule connected to two conducting leads for the weak and intermediate coupling. This case is not accessible to standard non-equilibrium…

Mesoscale and Nanoscale Physics · Physics 2011-01-21 Fatemeh Mirjani , Joseph M. Thijssen