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Implementing peridynamics within a molecular dynamics code

delete2008-12-01
delete251
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M
Michael L. Parks *
R
Richard B. Lehoucq
S
Steven J. Plimpton
S
Stewart Silling
DOI:10.1016/j.cpc.2008.06.011delete
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摘要

摘要

En 中文
Peridynamics (PD) is a continuum theory that employs a nonlocal model to describe material properties.]it this context, nonlocal means that continuum points separated by a finite distance may exert force upon each other A meshless method results when PD is discretized with material behavior approximated as a collection of interacting particles. This paper describes how PD can be implemented within a molecular dynamics (MD) framework, and provides details of an efficient implementation. This adds a computational mechanics capability to in MD code, enabling simulations at mesoscopic or even macroscopic length and time scales. (C) 2008 Elsevier B.V. All rights reserved.
Keyword:
Multiscale
Molecular dynamics
Peridynamics
Continuum mechanics
Parallel computing
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期刊

Computer Physics Communications 封面图
Computer Physics Communications
IF:
3.4
论文数:
1.2W
被引数:
3.7W

机构

U
united states department of energy (doe)
学者数:
11.3W
论文数: 9.6W
被引数: 246
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