New versions of image approximations to the ionic solvent induced reaction field

DOI10.1016/j.cpc.2007.08.015zbMath1196.78012OpenAlexW2073976880WikidataQ34382906 ScholiaQ34382906MaRDI QIDQ710313

Shaozhong Deng, Changfeng Xue

Publication date: 18 October 2010

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: http://europepmc.org/articles/pmc2997574

zbMATH Keywords

method of imagesionic solventreaction fieldhybrid solvent model

Mathematics Subject Classification ID

Electro- and magnetostatics (78A30)

Uses Software

• ORTHPOL

Cites Work

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• Extending the fast multipole method to charges inside or outside a dielectric sphere
• A new version of the fast multipole method for screened Coulomb interactions in three dimensions
• The electric potential of a macromolecule in a solvent: A fundamental approach
• A fast adaptive multipole algorithm in three dimensions
• Extending the fast multipole method for charges inside a dielectric sphere in an ionic solvent: high-order image approximations for reaction fields
• A Fast Adaptive Multipole Algorithm for Particle Simulations
• Algorithm 726: ORTHPOL–a package of routines for generating orthogonal polynomials and Gauss-type quadrature rules
• A fast algorithm for particle simulations

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