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Nanocomposites are promising candidates for the next generation of thermoelectric materials since they exhibit extremely low thermal conductivities as a result of phonon scattering on the boundaries of the various material phases. The…

Mesoscale and Nanoscale Physics · Physics 2017-12-06 Samuel Foster , Mischa Thesberg , Neophytos Neophytou

In this thesis we showed that Non-equilibrium Green's Function Perturbation Theory (NEGF) is really the overarching perturbative transport theory. This is shown in great detail by using NEGF as a starting point and developing in 3…

Mesoscale and Nanoscale Physics · Physics 2013-02-05 Meng Lee Leek

We review a recent theoretical development based on non-equilibrium Green's function formalism to study heat transport in nanomechanical devices modeled by phononic systems of coupled quantum oscillators driven by ac forces and connected to…

Mesoscale and Nanoscale Physics · Physics 2015-06-12 Liliana Arrachea , Bruno Rizzo

The understanding and modeling of the heat transport across nanometer and sub-nanometer gaps where the distinction between thermal radiation and conduction become blurred remains an open question. In this work, we present a…

Mesoscale and Nanoscale Physics · Physics 2022-08-17 Yangyu Guo , Christophe Adessi , Manuel Cobian , Samy Merabia

Despite the ubiquity of applications of heat transport across nanoscale interfaces, including integrated circuits, thermoelectrics, and nanotheranostics, an accurate description of phonon transport in these systems remains elusive. Here we…

Mesoscale and Nanoscale Physics · Physics 2019-09-11 Georgios Varnavides , Adam S. Jermyn , Polina Anikeeva , Prineha Narang

Employing the nonequilibrium Green's function method, we develop a fully quantum mechanical model to study the coupled electron-phonon transport in one-dimensional atomic junctions in the presence of a weak electron-phonon interaction. This…

Mesoscale and Nanoscale Physics · Physics 2008-03-04 J. T. Lü , Jian-Sheng Wang

Nonequilibrium multi-carrier thermal transport is essential for both scientific research and technological applications in electronic, spintronic, and energy conversion devices. This article reviews the fundamentals of phonon, electron,…

Materials Science · Physics 2025-02-18 Te-Huan Liu , Tianyu Wang , Jun Zhou , Xin Qian , Ronggui Yang

Some of the most promising candidates for next generation thermoelectrics are nanocomposites due to their low thermal conductivities that result from phonon scattering on the boundaries of the various material phases. However, in order to…

Materials Science · Physics 2019-03-04 Samuel Foster , Mischa Thesberg , Neophytos Neophytou

Heating and heat conduction in molecular junctions are considered within a general NEGF formalism. We obtain a unified description of heating in current carrying molecular junctions as well as the electron and phonon contributions to the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Michael Galperin , Mark A. Ratner , Abraham Nitzan

A complex approach phonon quantum discrete model (PQDM) was developed to describe dynamics, kinetics and statistics of phonons in carbon nanostructures with zero-chirality of both zig-zag and armchair geometry. The model allows include into…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 E. Ya. Glushko , V. N. Evteev , M. V. Moiseenko , N. A. Slusarenko , A. A. Zakhidov

Electron transport through a double quantum dot system is studied with taking into account electron-phonon interaction. The Keldysh nonequilibrium Green function formalism is used to compute the current and transmission coefficient of the…

Mesoscale and Nanoscale Physics · Physics 2012-04-11 M. Bagheri Tagani , H. Rahimpour Soleimani

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

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

This review summarizes recent studies of thermal transport in nanoscaled semiconductors. Different from bulk materials, new physics and novel thermal properties arise in low dimensional nanostructures, such as the abnormal heat conduction,…

Mesoscale and Nanoscale Physics · Physics 2013-01-14 Nuo Yang , Xiangfan Xu , Gang Zhang , Baowen Li

At low temperatures when the phonon modes are effectively frozen, photon transport is the dominating mechanism of thermal relaxation in metallic systems. Starting from a microscopic many-body Hamiltonian, we develop a nonequilibrium Green's…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Teemu Ojanen , Tero T. Heikkila

We present a detailed treatment of the nonequilibrium Green's function method for thermal transport due to atomic vibrations in nanostructures. Some of the key equations, such as self-energy and conductance with nonlinear effect, are…

Statistical Mechanics · Physics 2011-11-09 Jian-Sheng Wang , Nan Zeng , Jian Wang , Chee Kwan Gan

Engineering phonon transport in physical systems is a subject of interest in the study of materials and plays a crucial role in controlling energy and heat transfer. Of particular interest are non-reciprocal phononic systems, which in…

Mesoscale and Nanoscale Physics · Physics 2018-03-28 Alireza Seif , Wade DeGottardi , Keivan Esfarjani , Mohammad Hafezi

In the last twenty years there has been significant progress in our understanding of quantum transport far from equilibrium and a conceptual framework has emerged through a combination of the Landauer approach with the non-equilibrium Green…

Mesoscale and Nanoscale Physics · Physics 2008-03-01 Supriyo Datta

Using the atomistic nonequilibrium Green's function, we find that thermal conductance of carbon nanotubes with presence of topological lattice imperfects is remarkably reduced, due to the strong Rayleigh scattering of high-frequency…

Mesoscale and Nanoscale Physics · Physics 2012-03-14 Jian Wang , Liang Li , Jian-Sheng Wang

Due to their aspect ratio and wide range of thermal conductivities, nanotubes hold significant promise as heat-management nanocomponents. Their practical use is, however, often limited by thermal resistance introduced by structural defects…

Materials Science · Physics 2025-10-20 Yu-Jie Cen , Sandro Wieser , Georg K. H. Madsen , Jesús Carrete