The computation of averages from equilibrium and nonequilibrium Langevin molecular dynamics (Q2794697)
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scientific article; zbMATH DE number 6554284
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| English | The computation of averages from equilibrium and nonequilibrium Langevin molecular dynamics |
scientific article; zbMATH DE number 6554284 |
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The computation of averages from equilibrium and nonequilibrium Langevin molecular dynamics (English)
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11 March 2016
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Langevin dynamics
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stochastic differential equations
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numerical discretization
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canonical sampling
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molecular dynamics
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Talay-Tubaro expansion
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nonequilibium
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thermodynamic sampling
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Gibbs-Boltzmann distribution
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Brownian dynamics
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numerical experiments
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0.7790155410766602
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0.7453387379646301
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0.738955020904541
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0.7297441959381104
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0.7265294194221497
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