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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 present a theoretical analysis of heat transport through a single-molecule junction with two possible transport channels for electrons where interactions between electrons on the molecule and phonons in the nuclear environment is strong…

Mesoscale and Nanoscale Physics · Physics 2023-07-13 Natalya A. Zimbovskaya

We propose a hydrodynamic model to study the thermotransport properties of semiconductor electrons. From the semiclassical Boltzmann equation a set of balance equations is built for the relevant fields. The electron density, the electron…

Statistical Mechanics · Physics 2009-07-13 A. Rangel-Huerta , M. A. Rodriguez-Meza

Periodically driven systems are a common topic in modern physics. In optical lattices specifically, driving is at the origin of many interesting phenomena. However, energy is not conserved in driven systems, and under periodic driving,…

Statistical Mechanics · Physics 2017-11-27 Anton Quelle , Cristiane Morais Smith

The role of noise in the transport properties of quantum excitations is a topic of great importance in many fields, from organic semiconductors for technological applications to light-harvesting complexes in photosynthesis. In this paper we…

Quantum Physics · Physics 2016-11-22 Stefano Iubini , Octavi Boada , Yasser Omar , Francesco Piazza

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

We consider resonant transport through a molecular quantum dot coupled to a local vibration mode. Applying the non-equilibrium Green function technique in the polaron representation, we develop a non-perturbative scheme to calculate the…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 Alex Zazunov , Thierry Martin

Nanostructuring on length scales corresponding to phonon mean free paths provides control over heat flow in semiconductors and makes it possible to engineer their thermal properties. However, the influence of boundaries limits the validity…

We study heat transport for solids in the presence of arbitrary time-dependent force. Using nonequilibrium Green's function (NEGF) approach we present an exact analytical expression of current for the linear system. We found that the heat…

Statistical Mechanics · Physics 2011-11-29 Bijay Kumar Agarwalla , Jian-Sheng Wang , Baowen Li

Transient heat dissipation in close-packed quasi-2D nanoline and 3D nanocuboid hotspot systems is studied based on phonon Boltzmann transport equation. It is found that, counter-intuitively, the heat dissipation efficiency is not a…

Mesoscale and Nanoscale Physics · Physics 2022-07-20 Chuang Zhang , Lei Wu

Within the framework of nonequilibrium Green's functions, we investigate the thermoelectric transport in a single molecular junction with electron-phonon and electron-electron interactions. By transforming into a displaced phonon basis, we…

Mesoscale and Nanoscale Physics · Physics 2012-04-26 Jie Ren , Jian-Xin Zhu , James E. Gubernatis , Chen Wang , Baowen Li

We show, using a tight-binding model and time-dependent density-functional theory, that a quasi-steady state current can be established dynamically in a finite nanoscale junction without any inelastic effects. This is simply due to the…

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

We present an exact solution for the heat conductance along a harmonic chain connecting two reservoirs at different temperatures. In this model, the end points correspond to Brownian particles with different damping coefficients. Such…

Statistical Mechanics · Physics 2020-09-09 G. A. Weiderpass , Gustavo M. Monteiro , A. O. Caldeira

Quantum heat transfer through a generic superconducting set-up consisting of a tunable transmon qubit placed between resonators that are termined by thermal reservoirs is explored. Two types of architectures are considered, a sequential and…

Quantum Physics · Physics 2021-03-24 Meng Xu , J. T. Stockburger , J. Ankerhold

Thermal transport in crystals is influenced by chemistry, boundaries, and nanostructure. The anharmonic phonon band structure extracted from molecular-dynamics simulations provides an illuminating view of both the type and extent of…

Mesoscale and Nanoscale Physics · Physics 2025-07-15 Albert Beardo , Prajit Rawte , Chia-Nien Tsai , Mahmoud I. Hussein

We consider thermal conduction across a general nonlinear phononic junction. Based on two-time observation protocol and the field theoretical/algebraic method, the cumulants of the heat transferred in both transient and steady-state regimes…

Statistical Mechanics · Physics 2016-09-09 Huanan Li , Bijay Kumar Agarwalla , Baowen Li , Jian-Sheng Wang

We study ballistic interfacial thermal transport across atomic junctions. Exact expressions for phonon transmission coefficients are derived for thermal transport in one-junction and two-junction chains, and verified by numerical…

Materials Science · Physics 2011-03-02 Lifa Zhang , Pawel Keblinski , Jian-Sheng Wang , Baowen Li

Electronic transport in a model molecular device coupled to local phonon modes is theoretically analyzed. The method allows for obtaining an accurate approximation of the system's quantum state irrespective of the electron and phonon energy…

Mesoscale and Nanoscale Physics · Physics 2007-10-10 Antonino La Magna , Ioannis Deretzis

The world communicates to our senses of vision, hearing and touch in the language of waves, as the light, sound, and even heat essentially consist of microscopic vibrations of different media. The wave nature of light and sound has been…

Mesoscale and Nanoscale Physics · Physics 2018-02-06 Jeremie Maire , Roman Anufriev , Ryoto Yanagisawa , Aymeric Ramiere , Sebastian Volz , Masahiro Nomura

We study nondiffusive thermal transport by phonons at small distances within the framework of the Boltzmann transport equation (BTE) and demonstrate that the transport is significantly affected by the distribution of phonons emitted by the…

Mesoscale and Nanoscale Physics · Physics 2017-10-05 Vazrik Chiloyan , Samuel Huberman , Alexei A. Maznev , Keith A. Nelson , Gang Chen