MESOSCOPIC MODELING IN THE KINETIC-THEORY OF ADSORBATES

Citation
M. Hildebrand et As. Mikhailov, MESOSCOPIC MODELING IN THE KINETIC-THEORY OF ADSORBATES, Journal of physical chemistry, 100(49), 1996, pp. 19089-19101
Citations number
34
Categorie Soggetti
Chemistry Physical
ISSN journal
00223654
Volume
100
Issue
49
Year of publication
1996
Pages
19089 - 19101
Database
ISI
SICI code
0022-3654(1996)100:49<19089:MMITKO>2.0.ZU;2-3
Abstract
A mesoscopic description of surface chemical reactions, aimed to provi de a Link between microscopic lattice models and reaction-diffusion eq uations, is formulated. Such a description is needed when large popula tions of nanoscale structures are considered or patterns characterized by a combination of macroscopic and microscopic lengths are investiga ted. By using the example of an adsorbate with attractive lateral inte ractions between molecules, the mesoscopic evolution equation for fluc tuating coverages is derived from the microscopic master equation of t he respective kinetic lattice model. This stochastic equation is appli ed to study phenomena of pattern formation related to adsorbate phase transitions.