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We present a model for electron-ion transport in Warm Dense Matter that incorporates Coulomb coupling effects into the quantum Boltzmann equation of Uehling and Uhlenbeck through the use of a statistical potential of mean force. Although…

Plasma Physics · Physics 2021-06-23 Shane Rightley , S. D. Baalrud

We calculate conductance through a quantum dot weakly coupled to metallic contacts by means of Keldysh out of equilibrium formalism. We model the quantum dot with the SU(2) Anderson model and consider the limit of infinite Coulomb…

Strongly Correlated Electrons · Physics 2015-03-19 Leandro Tosi , Pablo Roura-Bas , Ana María Llois , Armando A. Aligia

The thermal resistance associated with the interface between a solid and a liquid is analyzed from an atomistic point of view. Partial evaluation of the associated Green-Kubo integral elucidates the various factors governing heat transport…

Statistical Mechanics · Physics 2022-01-26 Nicolas G. Hadjiconstantinou , Mathew M. Swisher

The quantum-mechanical and thermodynamic properties of a 3-level molecular cooling cycle are derived. An inadequacy of earlier models is rectified in accounting for the spontaneous emission and absorption associated with the coupling to the…

Quantum Physics · Physics 2009-11-07 Jose P. Palao , Ronnie Kosloff , Jeffrey M. Gordon

We present a fully nonequilibrium calculation of the low temperature transport properties of a quantum dot in the Kondo regime when an AC potential is applied to the gate voltage. We solve a time dependent Anderson model with finite on-site…

Strongly Correlated Electrons · Physics 2009-10-31 Rosa Lopez , Ramon Aguado , Gloria Platero , Carlos Tejedor

A generalized Langevin equation with quantum baths (QMD) for thermal transport is derived with the help of nonequilibrium Green's function (NEGF) formulation. The exact relationship of the quasi-classical approximation to NEGF is…

Mesoscale and Nanoscale Physics · Physics 2009-12-23 Jian-Sheng Wang , Xiaoxi Ni , Jin-Wu Jiang

A single mechanism, endemic to the standard model of physics, is proposed to explain wavefunction collapse, classical motion, dissipation, equilibration, and the transition from pure quantum mechanics through open system decoherence to the…

General Physics · Physics 2024-09-23 J. H. Brownell

We propose a way to properly interpret the apparent thermal conductivity obtained for finite systems using equilibrium molecular dynamics simulations (EMD) with fixed or open boundary conditions in the transport direction. In such systems…

Statistical Mechanics · Physics 2021-01-27 Haikuan Dong , Shiyun Xiong , Zheyong Fan , Ping Qian , Yanjing Su , Tapio Ala-Nissila

Understanding the electrical conductivity of warm dense hydrogen is critical for both fundamental physics and applications in planetary science and inertial confinement fusion. We demonstrate how to calculate the electrical conductivity…

Materials Science · Physics 2025-02-14 Kushal Ramakrishna , Mani Lokamani , Attila Cangi

One-dimensional systems, such as nanowires or electrons moving along strong magnetic field lines, have peculiar thermalization physics. The binary collision of point-like particles, typically the dominant process for reaching thermal…

Atomic Physics · Physics 2024-07-10 M. Eltohfa , Xinghan Wang , Colton M. Griffin , F. Robicheaux

This article proposes a Variational Quantum Algorithm to solve linear and nonlinear thermofluid dynamic transport equations. The hybrid classical-quantum framework is applied to problems governed by the heat, wave, and Burgers' equation in…

Quantum Physics · Physics 2025-11-06 Sergio Bengoechea , Paul Over , Dieter Jaksch , Thomas Rung

In this work, we investigated tensile and compression forces effect on the thermal conductivity of silicon. We used equilibrium molecular dynamics approach for the evaluation of thermal conductivity considering different interatomic…

Materials Science · Physics 2019-08-05 Vasyl Kuryliuk , Oleksii Nepochatyi , Patrice Chantrenne , David Lacroix , Mykola Isaiev

Thermostats are dynamical equations used to model thermodynamic variables such as temperature and pressure in molecular simulations. For computationally intensive problems such as the simulation of biomolecules, we propose to average over…

Computational Physics · Physics 2011-05-13 A. A. Samoletov , C. P. Dettmann , M. A. J. Chaplain

Nature of energy transport around a critical point is studied in the Creutz cellular automaton. Fourier heat law is confirmed to hold in this model by a direct measurement of heat flow under a temperature gradient. The thermal conductivity…

Statistical Mechanics · Physics 2009-10-31 K. Saito , S. Takesue , S. Miyashita

We present molecular dynamics calculations of the thermal conductivity and viscosities of a model colloidal suspension with colloidal particles roughly one order of magnitude larger than the suspending liquid molecules. The results are…

Statistical Mechanics · Physics 2007-05-23 Sorin Bastea

We present a new dynamical approach for measuring the temperature of a Hamiltonian dynamical system in the micro canonical ensemble of thermodynamics. We show that under the hypothesis of ergodicity the temperature can be computed as a…

chao-dyn · Physics 2009-10-30 Hans Henrik Rugh

We investigate the thermodynamics of integrable classical field theories under the effect of a random initial configuration, motivated by the nonequilibrium evolution of quantum field theories. The approach to thermal equilibrium is…

Statistical Mechanics · Physics 2016-10-05 P. E. G. Assis

One considers the motion of a test particle in an homogeneous fluid in equilibrium at temperature $T$, undergoing dissipative collisions with the fluid particles. It is shown that the corresponding linear Boltzmann equation still posseses a…

Statistical Mechanics · Physics 2007-05-23 Ph. A. Martin , J. Piasecki

Significant differences exist among literature for thermal conductivity of various systems computed using molecular dynamics simulation. In some cases, unphysical results, for example, negative thermal conductivity, have been found. Using…

Materials Science · Physics 2012-06-26 X. W. Zhou , S. Aubry , R. E. Jones , A. Greenstein , P. K. Schelling

The method of moments is used to calculate the dynamic conductivity of strongly coupled fully ionized hydrogen plasmas. The electron density $n_{e}$ and temperature $T$ vary in the domains $ 10^{21} < n_{e} < 10^{24} {\rm cm}^{-3}$, $10^{4}…

Plasma Physics · Physics 2013-03-05 V. M. Adamyan , A. A. Mihajlov , N. M. Sakan , V. A. Sreckovic , I. M. Tkachenko