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Investigation of the Self-Diffusion of Small Molecules in a High-Molecular Environment

✍ Scribed by Doz. Dr. Robert Kosfeld

Publisher
John Wiley and Sons
Year
1971
Tongue
English
Weight
200 KB
Volume
10
Category
Article
ISSN
0044-8249

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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)