A scalable method to model large suspensions of colloidal phoretic particles with arbitrary shapes

Fuente: arXiv
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Autores principales: Delmotte, Blaise, Usabiaga, Florencio Balboa
Formato: Preprint
Publicado: 2024
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author Delmotte, Blaise
Usabiaga, Florencio Balboa
author_facet Delmotte, Blaise
Usabiaga, Florencio Balboa
contents Phoretic colloids self-propel thanks to surface flows generated in response to surface gradients (thermal, electrical, or chemical), that are self-induced and/or generated by other particles. Here we present a scalable and versatile framework to model chemical and hydrodynamic interactions in large suspensions of arbitrarily shaped phoretic particles, accounting for thermal fluctuations at all Damkholer numbers. Our approach, inspired by the Boundary Element Method (BEM), employs second-layer formulations, regularised kernels and a grid optimisation strategy to solve the coupled Laplace-Stokes equations with reasonable accuracy at a fraction of the computational cost associated with BEM. As demonstrated by our large-scale simulations, the capabilities of our method enable the exploration of new physical phenomena that, to our knowledge, have not been previously addressed by numerical simulations.
format Preprint
id arxiv_https___arxiv_org_abs_2403_05337
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle A scalable method to model large suspensions of colloidal phoretic particles with arbitrary shapes
Delmotte, Blaise
Usabiaga, Florencio Balboa
Soft Condensed Matter
Computational Physics
Fluid Dynamics
Phoretic colloids self-propel thanks to surface flows generated in response to surface gradients (thermal, electrical, or chemical), that are self-induced and/or generated by other particles. Here we present a scalable and versatile framework to model chemical and hydrodynamic interactions in large suspensions of arbitrarily shaped phoretic particles, accounting for thermal fluctuations at all Damkholer numbers. Our approach, inspired by the Boundary Element Method (BEM), employs second-layer formulations, regularised kernels and a grid optimisation strategy to solve the coupled Laplace-Stokes equations with reasonable accuracy at a fraction of the computational cost associated with BEM. As demonstrated by our large-scale simulations, the capabilities of our method enable the exploration of new physical phenomena that, to our knowledge, have not been previously addressed by numerical simulations.
title A scalable method to model large suspensions of colloidal phoretic particles with arbitrary shapes
topic Soft Condensed Matter
Computational Physics
Fluid Dynamics
url https://arxiv.org/abs/2403.05337