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Sparsification of long range force networks for molecular dynamics simulations

Atomic interactions in solid materials are described using network theory. The tools of network theory focus on understanding the properties of a system based upon the underlying interactions which govern their dynamics. While the full atomistic network is dense, we apply a spectral sparsification t...

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Detalles Bibliográficos
Autores principales: Woerner, Peter, Nair, Aditya G., Taira, Kunihiko, Oates, William S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Public Library of Science 2019
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6461233/
https://www.ncbi.nlm.nih.gov/pubmed/30978200
http://dx.doi.org/10.1371/journal.pone.0213262