Efficient algorithms for electrostatic interactions including dielectric contrasts

DOI10.3390/E15114569zbMATH Open1355.78041DBLPjournals/entropy/ArnoldBFKLH13OpenAlexW1977703420WikidataQ59901406 ScholiaQ59901406MaRDI QIDQ280666FDOQ280666

Authors: Axel Arnold, Konrad Breitsprecher, Florian Fahrenberger, Stefan Kesselheim, Olaf Lenz, Christian Holm 

Publication date: 10 May 2016

Published in: Entropy (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.3390/e15114569

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zbMATH Keywords

periodic boundary conditionsPoisson equationelectrostaticsMaxwell equationsboundary element methodcomputer simulationdielectric contrastmolecular dynamics

Mathematics Subject Classification ID

Probabilistic methods, particle methods, etc. for boundary value problems involving PDEs (65N75) Boundary element methods for boundary value problems involving PDEs (65N38) Boundary element methods applied to problems in optics and electromagnetic theory (78M15)

Cites Work

• Title not available (Why is that?)
• A comparison of Ewald summation techniques for planar surfaces
• Title not available (Why is that?)
• Applying \(\text{ICC}^{\star}\) to DNA translocation: Effect of dielectric boundaries

Cited In (3)

• Fast evaluation of electro-static interactions in multi-phase dielectric media
• HSMA: an \(O(N)\) electrostatics package implemented in LAMMPS
• Incorporating surface polarization effects into large-scale coarse-grained molecular dynamics simulation

Uses Software

• DUNE
• PDELab
• ESPResSo
• MMM2D

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