Computer simulations of the dynamic properties of methane in a model silica gel

Molecular dynamics (MD) simulations are reported for a Lennard-Jones fluid adsorbed into a model silica gel to study the dynamic properties of the adsorbed methane molecules. The mean-square displacement and velocity autocorrelation function of the adsorbed molecules are calculated for a set of...

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Bibliographic Details
Date:2003
Main Authors: Patsahan, T., Trokhymchuk, A., Holovko, M.
Format: Article
Language:English
Published: Інститут фізики конденсованих систем НАН України 2003
Series:Condensed Matter Physics
Online Access:http://dspace.nbuv.gov.ua/handle/123456789/120691
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Journal Title:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Cite this:Computer simulations of the dynamic properties of methane in a model silica gel / T. Patsahan, A. Trokhymchuk, M. Holovko // Condensed Matter Physics. — 2003. — Т. 6, № 1(33). — С. 3-21. — Бібліогр.: 21 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine