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Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package
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Analyzing Melts and Fluids from Ab Initio Molecular Dynamics Simulations with the UMD Package

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Mathematical analysis of coupled parallel simulations

M R Shirts1, V S Pande

  • 1Department of Chemistry, Stanford University, Stanford, California 94305-5080, USA.

Physical Review Letters
|June 1, 2001
PubMed

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