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Interfacial thermodynamics of confined water near molecularly rough surfaces

We study the effects of nanoscopic roughness on the interfacial free energy of water confined between solid surfaces. SPC/E water is simulated in confinement between two infinite planar surfaces that differ in their physical topology: one is smooth and the other one is physically rough on a nanomete...

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Detalhes bibliográficos
Main Authors: Mittal, Jeetain, Hummer, Gerhard
Formato: Artigo
Idioma:Inglês
Publicado em: 2010
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC3470880/
https://ncbi.nlm.nih.gov/pubmed/21043431
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