Automatic adaptivity in the fully nonlocal quasicontinuum method for coarse-grained atomistic simulations

DOI10.1002/nme.5438zbMath1548.65154MaRDI QIDQ6556880

Dennis M. Kochmann, Lukas Munk, I. Tembhekar, J. S. Amelang

Publication date: 17 June 2024

Published in: International Journal for Numerical Methods in Engineering (Search for Journal in Brave)

zbMATH Keywords

adaptivitymolecular mechanicsparticle methodsmultiscale modeling

Mathematics Subject Classification ID

Interacting particle systems in time-dependent statistical mechanics (82C22) Numerical methods for initial value problems involving ordinary differential equations (65L05) Probabilistic methods, particle methods, etc. for initial value and initial-boundary value problems involving PDEs (65M75)

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