DIFFUSION ON SIMPLE HETEROGENOUS SURFACES

Authors
Citation
F. Nieto et C. Uebing, DIFFUSION ON SIMPLE HETEROGENOUS SURFACES, Berichte der Bunsengesellschaft fur Physikalische Chemie, 102(2), 1998, pp. 156-163
Citations number
30
Categorie Soggetti
Chemistry Physical
Journal title
Berichte der Bunsengesellschaft fur Physikalische Chemie
ISSN journal
00059021 → ACNP
Volume
102
Issue
2
Year of publication
1998
Pages
156 - 163
Database
ISI
SICI code
0005-9021(1998)102:2<156:DOSHS>2.0.ZU;2-U
Abstract
In this work we use the well-known bivariate trap model with random to pography in order to study the effects of surface heterogeneities on s urface diffusion. Utilizing Monte Carlo simulations we characterize ho w the tracer, jump and chemical diffusion coefficients depend on tempe rature and concentration of deep traps, Theta. In order to calculate t he chemical diffusion coefficient we apply the fluctuation and the Kub o-Green methods. Both methods are in good agreement at large values of Theta only. The discrepancies are discussed and explained. The effect s of heterogeneities are largely pronounced at low total coverage and low temperatures, where most of the adatoms are trapped by the deep tr aps. At high coverages the mobility of adatoms adsorbed on shallow tra ps dominate the diffusion behavior.