Simulation of Stochastic Non-Equilibrium Thermal Effects of Particle Inclusions within Fluid Interfaces and Membranes

Fuente: arXiv
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Main Authors: Jasuja, Dev, Atzberger, Paul J.
Format: Preprint
Published: 2024
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author Jasuja, Dev
Atzberger, Paul J.
author_facet Jasuja, Dev
Atzberger, Paul J.
contents We formulate theoretical modeling approaches and develop practical computational simulation methods for investigating the non-equilibrium statistical mechanics of fluid interfaces with passive and active immersed particles. Our approaches capture phenomena taking into account thermal and dissipative energy exchanges, hydrodynamic coupling, and correlated spontaneous fluctuations. Our methods allow for modeling non-uniform time-varying temperature fields, fluid momentum fields, and their impacts on particle drift-diffusion dynamics. We show how practical stochastic numerical methods can be developed for these systems by performing analysis to factor operators analytically to obtain efficient algorithms for generating the fluctuating fields. We demonstrate our methods in a few simulation studies showing how they can be used to capture particle heating of the interface and the roles of thermal gradients on hydrodynamic fluctuations. The methods developed provide modeling and simulation approaches that can be used for further investigations of non-equilibrium phenomena in active soft materials, complex fluids, and biophysical systems.
format Preprint
id arxiv_https___arxiv_org_abs_2410_01165
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Simulation of Stochastic Non-Equilibrium Thermal Effects of Particle Inclusions within Fluid Interfaces and Membranes
Jasuja, Dev
Atzberger, Paul J.
Soft Condensed Matter
Materials Science
Biological Physics
Computational Physics
Subcellular Processes
We formulate theoretical modeling approaches and develop practical computational simulation methods for investigating the non-equilibrium statistical mechanics of fluid interfaces with passive and active immersed particles. Our approaches capture phenomena taking into account thermal and dissipative energy exchanges, hydrodynamic coupling, and correlated spontaneous fluctuations. Our methods allow for modeling non-uniform time-varying temperature fields, fluid momentum fields, and their impacts on particle drift-diffusion dynamics. We show how practical stochastic numerical methods can be developed for these systems by performing analysis to factor operators analytically to obtain efficient algorithms for generating the fluctuating fields. We demonstrate our methods in a few simulation studies showing how they can be used to capture particle heating of the interface and the roles of thermal gradients on hydrodynamic fluctuations. The methods developed provide modeling and simulation approaches that can be used for further investigations of non-equilibrium phenomena in active soft materials, complex fluids, and biophysical systems.
title Simulation of Stochastic Non-Equilibrium Thermal Effects of Particle Inclusions within Fluid Interfaces and Membranes
topic Soft Condensed Matter
Materials Science
Biological Physics
Computational Physics
Subcellular Processes
url https://arxiv.org/abs/2410.01165