A multilevel-skin neighbor list algorithm for molecular dynamics simulation

DOI10.1016/J.CPC.2017.09.017MaRDI QIDQ6155728zbMATH OpenOpenAlexFDO

Authors Chenglong Zhang, Mingcan Zhao, Chaofeng Hou, Wei Ge

Publication date 7 June 2023

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

Full work available at URL https://doi.org/10.1016/j.cpc.2017.09.017

zbMATH Keywords

high-performance computingsearching efficiencymolecular dynamics simulationneighbor-list-based algorithm

Mathematics Subject Classification ID

Statistical mechanics, structure of matter (82-XX) Numerical analysis (65-XX)

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Cites work

• scientific article; zbMATH DE number 41859 (Why is no real title available?)
• scientific article; zbMATH DE number 1082719 (Why is no real title available?)
• scientific article; zbMATH DE number 921897 (Why is no real title available?)
• Efficiency of linked cell algorithms
• Faster neighbour list generation using a novel lattice vector representation
• General purpose molecular dynamics simulations fully implemented on graphics processing units
• The Art of Molecular Dynamics Simulation

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