DOI: 10.1063/1.474779. Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5

Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5

10.1063/1.474779

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

We have used molecular simulations to examine the diffusion of Ne, Ar, Kr, Xe, CH4, CF4, CCl4, SF6, SnCl4, and SnBr4 in the molecular sieve AlPO4-5, both as single species and as coadsorbed mixtures. Single adsorbed species exhibit a transition from normal to single-file diffusion as a function of increasing adsorbate size. In addition to normal and single-file diffusion, coadsorbed mixtures exhibit a qualitatively new diffusion mode in which one species performs normal diffusion while the other undergoes single-file diffusion. We discuss the prospects for experimental verification of this phenomenon, and present measurements of the loading dependence of diffusion rates during the dual-mode diffusion of Ne/CF4 mixtures.

Bibliography

Sholl, D. S., & Fichthorn, K. A. (1997). Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5. The Journal of Chemical Physics, 107(11), 4384â4389.

Authors 2

David S. Sholl (first)
Kristen A. Fichthorn (additional)

References 31 Referenced 85

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Dates

Type	When
Created	23 years, 1 month ago (July 26, 2002, 8:25 a.m.)
Deposited	1 year, 6 months ago (Feb. 7, 2024, 6:28 a.m.)
Indexed	1 month ago (July 28, 2025, 5:43 p.m.)
Issued	27 years, 11 months ago (Sept. 15, 1997)
Published	27 years, 11 months ago (Sept. 15, 1997)
Published Print	27 years, 11 months ago (Sept. 15, 1997)

Funders 0

None

BibTeX

@article{Sholl_1997, title={Normal, single-file, and dual-mode diffusion of binary adsorbate mixtures in AlPO4-5}, volume={107}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.474779}, DOI={10.1063/1.474779}, number={11}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Sholl, David S. and Fichthorn, Kristen A.}, year={1997}, month=sep, pages={4384–4389} }

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