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Self-organized nanostructures in surface chemical reactions: Mechanisms and mesoscopic modeling
Nanoscale patterns can form in reactive adsorbates on catalytic surfaces as a result of attractive lateral interactions. These structures can be described within a mesoscopic theory that is derived by...

From atomistic lattice-gas models for surface reactions to hydrodynamic reaction-diffusion equations

Chaos 12, 131 (2002); doi:10.1063/1.1450566

Published 21 February 2002

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J. W. Evans
Ames Laboratory (USDOE) and Department of Mathematics, Iowa State University, Ames, Iowa 50011

Da-Jiang Liu
Ames Laboratory (USDOE), Iowa State University, Ames, Iowa 50011

M. Tammaro
Department of Physics, University of Rhode Island, Kingston, Rhode Island 02881
Atomistic lattice-gas models for surface reactions can accurately describe spatial correlations and ordering in chemisorbed layers due to adspecies interactions or due to limited mobility of some adspecies. The primary challenge in such modeling is to describe spatiotemporal behavior in the physically relevant "hydrodynamic" regime of rapid diffusion of (at least some) reactant adspecies. For such models, we discuss the development of exact reaction-diffusion equations (RDEs) describing mesoscale spatial pattern formation in surface reactions. Formulation and implementation of these RDEs requires detailed analysis of chemical diffusion in mixed reactant adlayers, as well as development of novel hybrid and parallel simulation techniques. ©2002 American Institute of Physics.
History: Received 18 July 2001; accepted 20 December 2001; published 21 February 2002
Permalink: http://link.aip.org/link/?CHAOEH/12/131/1
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KEYWORDS and PACS

Keywords
PACS
  • 82.65.+r
    Physical chemistry and chemical physics Surface and interface chemistry; heterogeneous catalysis at surfaces (for temporal and spatial patterns in surface reactions, see 82.40.Np)
  • 05.50.+q
    Statistical physics, thermodynamics, and nonlinear dynamical systems Lattice theory and statistics (Ising, Potts, etc.)
  • 82.20.-w
    Physical chemistry and chemical physics Chemical kinetics and dynamics
  • YEAR: 2002

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ISSN:
1054-1500 (print)   1089-7682 (online)
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