Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation

The study of strongly out-of-equilibrium states and their time evolution towards thermalization is critical to the understanding of an ever widening range of physical processes. We present a numerical method that for the first time allows for the numerical solution of the most difficult part of t...

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Main Authors: Wais, M., Held, Karsten, Battiato, Marco
Other Authors: School of Physical and Mathematical Sciences
Format: Article
Language:English
Published: 2022
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Online Access:https://hdl.handle.net/10356/159452
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Institution: Nanyang Technological University
Language: English
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spelling sg-ntu-dr.10356-1594522022-06-21T05:35:24Z Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation Wais, M. Held, Karsten Battiato, Marco School of Physical and Mathematical Sciences Science::Physics Boltzmann Collision Operator Non-equilibrium Dynamics The study of strongly out-of-equilibrium states and their time evolution towards thermalization is critical to the understanding of an ever widening range of physical processes. We present a numerical method that for the first time allows for the numerical solution of the most difficult part of the time-dependent Boltzmann equation: the full scattering term. Any number of bands (and quasiparticles) with arbitrary dispersion, any number of high order scattering channels (we show here four legs scatterings: electron-electron scattering) can be treated far from equilibrium. No assumptions are done on the population and all the Pauli-blocking factors are included in the phase-space term of the scattering. The method can be straightforwardly interfaced to a deterministic solver for the transport. Finally and most critically, the method conserves to machine precision the particle number, momentum and energy for any resolution, making the computation of the time evolution till complete thermalization possible. We apply this approach to two examples, a metal and a semiconductor, undergoing thermalization from a strongly out-of-equilibrium laser excitation. These two cases, which are in literature treated hitherto under a number of approximations, can be addressed free from those approximations and straightforwardly within the same numerical method. Nanyang Technological University M.W. and M.B. acknowledge Nanyang Technological University, Singapore, NAP-SUG; M.W. acknowledges FWF for funding through Doctoral School W1243 Solids4Fun (Building Solids for Function), Austria; and K.H. the FWF for support through project P30997. 2022-06-21T05:35:24Z 2022-06-21T05:35:24Z 2021 Journal Article Wais, M., Held, K. & Battiato, M. (2021). Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation. Computer Physics Communications, 264, 107877-. https://dx.doi.org/10.1016/j.cpc.2021.107877 0010-4655 https://hdl.handle.net/10356/159452 10.1016/j.cpc.2021.107877 2-s2.0-85102617072 264 107877 en NAP-SUG Computer Physics Communications © 2021 Published by Elsevier B.V. All rights reserved.
institution Nanyang Technological University
building NTU Library
continent Asia
country Singapore
Singapore
content_provider NTU Library
collection DR-NTU
language English
topic Science::Physics
Boltzmann Collision Operator
Non-equilibrium Dynamics
spellingShingle Science::Physics
Boltzmann Collision Operator
Non-equilibrium Dynamics
Wais, M.
Held, Karsten
Battiato, Marco
Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
description The study of strongly out-of-equilibrium states and their time evolution towards thermalization is critical to the understanding of an ever widening range of physical processes. We present a numerical method that for the first time allows for the numerical solution of the most difficult part of the time-dependent Boltzmann equation: the full scattering term. Any number of bands (and quasiparticles) with arbitrary dispersion, any number of high order scattering channels (we show here four legs scatterings: electron-electron scattering) can be treated far from equilibrium. No assumptions are done on the population and all the Pauli-blocking factors are included in the phase-space term of the scattering. The method can be straightforwardly interfaced to a deterministic solver for the transport. Finally and most critically, the method conserves to machine precision the particle number, momentum and energy for any resolution, making the computation of the time evolution till complete thermalization possible. We apply this approach to two examples, a metal and a semiconductor, undergoing thermalization from a strongly out-of-equilibrium laser excitation. These two cases, which are in literature treated hitherto under a number of approximations, can be addressed free from those approximations and straightforwardly within the same numerical method.
author2 School of Physical and Mathematical Sciences
author_facet School of Physical and Mathematical Sciences
Wais, M.
Held, Karsten
Battiato, Marco
format Article
author Wais, M.
Held, Karsten
Battiato, Marco
author_sort Wais, M.
title Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
title_short Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
title_full Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
title_fullStr Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
title_full_unstemmed Numerical solver for the time-dependent far-from-equilibrium Boltzmann equation
title_sort numerical solver for the time-dependent far-from-equilibrium boltzmann equation
publishDate 2022
url https://hdl.handle.net/10356/159452
_version_ 1736856394481532928