An introductory overview of action-derived molecular dynamics for multiple time-scale simulations

DOI10.1016/J.CMA.2003.12.043MaRDI QIDQ704526zbMATH OpenOpenAlexFDO

Authors Sung Youb Kim, Sukky Jun, In-Ho Lee

Publication date 13 January 2005

Published in Computer Methods in Applied Mechanics and Engineering (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1016/j.cma.2003.12.043

zbMATH Keywords

Action-derived molecular dynamicsActivation energyInfrequent eventLeast action principles

Mathematics Subject Classification ID

Molecular, statistical, and kinetic theories in solid mechanics (74A25) Research exposition (monographs, survey articles) pertaining to mechanics of deformable solids (74-02)

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Cites work

• An introduction to computational nanomechanics and materials
• Coupling of atomistic and continuum simulations using a bridging scale decomposition.
• Fluctuations and Irreversible Processes
• Nonequilibrium statistical mechanics

Cited in

(1)

• scientific article; zbMATH DE number 2175055 (Why is no real title available?)

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