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Position-dependent dynamics explain pore-averaged diffusion in strongly attractive adsorptive systems

Using molecular simulations, we investigate the relationship between pore-averaged and position-dependent self-diffusivity of a fluid adsorbed in a strongly attractive pore as a function of loading. Previous work [Krekelberg et al., Langmuir 2013, 29, 14527] established that pore averaged self-diffu...

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Detalhes bibliográficos
Publicado no:Langmuir
Main Authors: Krekelberg, William P., Siderius, Daniel W., Shen, Vincent K., Truskett, Thomas M., Errington, Jeffrey R.
Formato: Artigo
Idioma:Inglês
Publicado em: 2017
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Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5853136/
https://ncbi.nlm.nih.gov/pubmed/29125303
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.langmuir.7b03401
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