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GPU-Accelerated Algorithm Optimization for Molecular Dynamics Simulation of Crystalline Silicon

Molecular Dynamics(MD) is one of the main methods used to study the thermodynamic properties of silicon nano-films;however, these studies have problems such as processing massive amounts of data, computational intensity, and complex interatomic interaction, which limit the comprehensive application...

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Autor principal: LIN Lin, ZHU Aiqi, ZHAO Mingcan, ZHANG Shuai, YE Yanhao, XU Ji, HAN Lin, ZHAO Rongcai, HOU Chaofeng
Formato: Artigo
Idioma:Inglês
Publicado em: Editorial Office of Computer Engineering 2023-04-01
coleção:Jisuanji gongcheng
Assuntos:
molecular dynamics(md)|graphics processor unit(gpu)|coalesced access|loop unrolling|atomic operation|performance optimization
Acesso em linha:https://www.ecice06.com/fileup/1000-3428/PDF/20230421.pdf
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