Towards sharp error analysis of extended Lagrangian molecular dynamics

DOI10.1016/j.jcp.2022.111403OpenAlexW3093137313MaRDI QIDQ2157128

Lin Lin, Michael Lindsey, Dong An

Publication date: 21 July 2022

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://arxiv.org/abs/2010.07508

zbMATH Keywords

molecular dynamicssingularly perturbed systemextended Lagrangianpolarizable force field

Mathematics Subject Classification ID

Numerical methods for ordinary differential equations (65Lxx) Ordinary differential equations (34-XX) General theory for ordinary differential equations (34Axx)

Cites Work

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• Multiscale Methods
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