A MONTE-CARLO SIMULATION FOR THE CATALYTIC-OXIDATION OF CO ON DLA CLUSTERS

Citation
J. Mai et al., A MONTE-CARLO SIMULATION FOR THE CATALYTIC-OXIDATION OF CO ON DLA CLUSTERS, Chemical physics letters, 211(2-3), 1993, pp. 197-202
Citations number
21
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
ISSN journal
00092614
Volume
211
Issue
2-3
Year of publication
1993
Pages
197 - 202
Database
ISI
SICI code
0009-2614(1993)211:2-3<197:AMSFTC>2.0.ZU;2-M
Abstract
A Monte Carlo simulation for the heterogeneously catalyzed oxidation o f CO on diffusion limited aggregation clusters is introduced. Kinetic phase transition points which appear in this reaction system are studi ed as a function of the system parameters. Both the 0 poisoning transi tion at y1 and the CO poisoning transition at y2 are found al very low values and they are second-order transitions. This holds even in the presence of CO diffusion. The results will be compared with simulation s which were performed on regular and other fractal surfaces. The stro ng influence of the lattice structure is discussed in detail.