A Comparison of Classical Force-Fields for Molecular Dynamics Simulations of Lubricants

For the successful development and application of lubricants, a full understanding of their complex nanoscale behavior under a wide range of external conditions is required, but this is difficult to obtain experimentally. Nonequilibrium molecular dynamics (NEMD) simulations can be used to yield uniq...

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Detalles Bibliográficos
Autores principales: Ewen, James P., Gattinoni, Chiara, Thakkar, Foram M., Morgan, Neal, Spikes, Hugh A., Dini, Daniele
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2016
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5509262/
https://www.ncbi.nlm.nih.gov/pubmed/28773773
http://dx.doi.org/10.3390/ma9080651

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5509262/
https://www.ncbi.nlm.nih.gov/pubmed/28773773
http://dx.doi.org/10.3390/ma9080651

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