A multilevel-skin neighbor list algorithm for molecular dynamics simulation

DOI10.1016/J.CPC.2017.09.017OpenAlexW2764023231MaRDI QIDQ6155728FDOQ6155728

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

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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)

Cites Work

• Title not available (Why is that?)
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• The Art of Molecular Dynamics Simulation
• General purpose molecular dynamics simulations fully implemented on graphics processing units
• Efficiency of linked cell algorithms
• Title not available (Why is that?)
• Faster neighbour list generation using a novel lattice vector representation

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