Disorder-induced time-dependent diffusion in zeolites

Citation
Lg. Chen et al., Disorder-induced time-dependent diffusion in zeolites, J PHYS CH B, 104(25), 2000, pp. 6033-6039
Citations number
27
Categorie Soggetti
Physical Chemistry/Chemical Physics
Journal title
JOURNAL OF PHYSICAL CHEMISTRY B
ISSN journal
15206106 → ACNP
Volume
104
Issue
25
Year of publication
2000
Pages
6033 - 6039
Database
ISI
SICI code
1520-6106(20000629)104:25<6033:DTDIZ>2.0.ZU;2-W
Abstract
We suggest that disordered framework aluminums and nonframework cations can create a disordered electrostatic potential in zeolites that can lead to a discrepancy between diffusivities measured by microscopic and macroscopic experimental techniques. We calculate the value of the discrepancy and the characteristic time scale at which it occurs for several ionic and polariza ble species diffusing in zeolites. For ionic species, a discrepancy is almo st inevitable. For polarizable species, a significant discrepancy may occur in some zeolites only for long alkanes or large species such as benzene.