Molecular dynamics beyonds the limits: Massive scaling on 72 racks of a BlueGene/P and supercooled glass dynamics of a 1 billion particles system
DOI10.1016/J.JCP.2012.01.019zbMath1245.82001arXiv1105.5613OpenAlexW2094677304MaRDI QIDQ417877
Andrea Fratalocchi, Nicholas Allsopp, Giancarlo Ruocco
Publication date: 14 May 2012
Published in: Journal of Computational Physics (Search for Journal in Brave)
Full work available at URL: https://arxiv.org/abs/1105.5613
molecular dynamicsbillions-body molecular dynamics (BBMD) packagelarge scale parallel computingsupercooled liquidsthermodynamics of glasses
Phase transitions (general) in equilibrium statistical mechanics (82B26) Dynamic continuum models (systems of particles, etc.) in time-dependent statistical mechanics (82C21) Parallel numerical computation (65Y05) Continuum models (systems of particles, etc.) arising in equilibrium statistical mechanics (82B21) Statistical thermodynamics (82B30)
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