Literature DB >> 24527936

Efficient and accurate simulation of dynamic dielectric objects.

Kipton Barros1, Daniel Sinkovits1, Erik Luijten1.   

Abstract

Electrostatic interactions between dielectric objects are complex and of a many-body nature, owing to induced surface bound charge. We present a collection of techniques to simulate dynamical dielectric objects. We calculate the surface bound charge from a matrix equation using the Generalized Minimal Residue method (GMRES). Empirically, we find that GMRES converges very quickly. Indeed, our detailed analysis suggests that the relevant matrix has a very compact spectrum for all non-degenerate dielectric geometries. Each GMRES iteration can be evaluated using a fast Ewald solver with cost that scales linearly or near-linearly in the number of surface charge elements. We analyze several previously proposed methods for calculating the bound charge, and show that our approach compares favorably.

Mesh:

Year:  2014        PMID: 24527936     DOI: 10.1063/1.4863451

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  5 in total

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Authors:  Aayush A Shah; Benjamin Schultz; Wenjia Zhang; Sharon C Glotzer; Michael J Solomon
Journal:  Nat Mater       Date:  2014-11-10       Impact factor: 43.841

2.  Dielectric virial expansion of polarizable dipolar spheres.

Authors:  Huada Lian; Jian Qin; Karl F Freed
Journal:  J Chem Phys       Date:  2018-10-28       Impact factor: 3.488

3.  Dynamic simulations of many-body electrostatic self-assembly.

Authors:  Eric B Lindgren; Benjamin Stamm; Yvon Maday; Elena Besley; A J Stace
Journal:  Philos Trans A Math Phys Eng Sci       Date:  2018-03-13       Impact factor: 4.226

4.  Rigorous treatment of pairwise and many-body electrostatic interactions among dielectric spheres at the Debye-Hückel level.

Authors:  O I Obolensky; T P Doerr; Yi-Kuo Yu
Journal:  Eur Phys J E Soft Matter       Date:  2021-10-18       Impact factor: 1.890

5.  Manipulating Interactions between Dielectric Particles with Electric Fields: A General Electrostatic Many-Body Framework.

Authors:  Muhammad Hassan; Connor Williamson; Joshua Baptiste; Stefanie Braun; Anthony J Stace; Elena Besley; Benjamin Stamm
Journal:  J Chem Theory Comput       Date:  2022-09-08       Impact factor: 6.578

  5 in total

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