Published 1996 | Version v1
Book

Computer simulation of Xe adsorption in zeolite Y

  • 1. Univ. of Minnesota, Minneapolis, MN (United States). Dept. of Chemical Engineering and Materials Science

Description

Computer modeling of fluids in zeolites can provide a detailed molecular level understanding of the process of adsorption and diffusion under the influence of the 3-D potential field and the confinement offered by the crystal structure. The authors have shown that there is a strong link between the location, geometry and energetics of sites and the observed thermodynamics and spectroscopy of the adsorbates. Here they report on the modeling of Xe in zeolite Y, which is of interest both because it is commercially important and because it offers two distinct adsorption sites

Additional details

Publishing Information

Publisher
Materials Research Society.
Imprint Place
Pittsburgh, PA (United States)
ISBN
1-55899-334-7
Imprint Title
Microporous and macroporous materials
Imprint Pagination
566 p.
Series
Materials Research Society symposium proceedings, Volume 431.
Journal Page Range
p. 147-151.

Conference

Title
Spring meeting of the Materials Research Society (MRS).
Dates
8-12 Apr 1996.
Place
San Francisco, CA (United States).

Optional Information

Secondary number(s)
CONF-960401--.