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Adsorption Studies of Methane, Ethane, and Argon in the Zeolite Mordenite: Molecular Simulations and Experiments

✍ Scribed by Macedonia, Michael D.; Moore, Darrin D.; Maginn, Edward J.; Olken, Michael M.

Book ID
125473409
Publisher
American Chemical Society
Year
2000
Tongue
English
Weight
190 KB
Volume
16
Category
Article
ISSN
0743-7463

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## Abstract Molecular Dynamic (MD) simulations were carried out to determine the Maxwell‐Stefan (M‐S) diffusivities, Đ~i~, and self‐diffusivities, __D__~i,self~, of methane (C1), ethane (C2), and propane (C3) for a variety of molecular loadings, __q__~i~, in three classes of zeolite topologies: (1)