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Molecular Dynamics Simulation of Distribution and Diffusion Behaviour of Oil–Water Interfaces

The distribution and diffusion behaviors of microscopic particles at fluorobenzene–water and pentanol–water interfaces are investigated using molecular dynamics simulation. The influences of Na(+)/Cl(−) ions and the steric effects of organic molecules are examined. The concentration distributions of...

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Detalhes bibliográficos
Publicado no:Molecules
Main Authors: Zhang, Chengbin, Dai, Hanhui, Lu, Pengfei, Wu, Liangyu, Zhou, Bo, Yu, Cheng
Formato: Artigo
Idioma:Inglês
Publicado em: MDPI 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6572532/
https://ncbi.nlm.nih.gov/pubmed/31108938
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/molecules24101905
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