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Surface Restructuring, Kinetic Oscillations, and Chaos in Heterogeneous Catalytic Reactions

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Abstract

Kinetic oscillations in catalytic reactions on single-crystal surfaces often result from the interplay of the purely chemical reaction steps and adsorbate-induced surface restructuring. A classical example is CO oxidation on Pt(100). We survey evolution of the models used to simulate this reaction and show how it can be described self-consistently by employing Monte Carlo simulations combined with the lattice-gas model, taking into account substrate-substrate, substrate-adsorbate and adsorbate-adsorbate lateral interactions. Under the reactive conditions, this approach predicts formation of mesoscopic restructured well ordered islands with atomically sharp boundaries.

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Authors and Affiliations

  1. Department of Applied Physics, Chalmers University of Technology, S-412 96, Göteborg, Sweden

    V. P. Zhdanov & B. Kasemo

  2. Boreskov Institute of Catalysis, Russian Academy of Sciences, Novosibirsk, 630090, Russia

    V. P. Zhdanov

Authors
  1. V. P. Zhdanov
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  2. B. Kasemo
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Zhdanov, V.P., Kasemo, B. Surface Restructuring, Kinetic Oscillations, and Chaos in Heterogeneous Catalytic Reactions. Journal of Statistical Physics 101, 631–647 (2000). https://doi.org/10.1023/A:1026470307071

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