• DocumentCode
    1499850
  • Title

    Monte Carlo-Based Approach for Simulating Nanostructured Catalytic and Electrocatalytic Systems

  • Author

    Viswanathan, Venkatasubramanian ; Wang, Frank ; Pitsch, Heinz

  • Volume
    14
  • Issue
    2
  • fYear
    2012
  • Firstpage
    60
  • Lastpage
    69
  • Abstract
    This geometry-generation method within a Monte Carlo-based approach enables the simulation of kinetics on nanostructured catalytic and electrocatalytic systems relevant for industrial applications. The method is applicable to realistic catalyst geometries, and an industrially relevant system-fuel cell is studied as an example.
  • Keywords
    Monte Carlo methods; catalysis; catalysts; electrochemistry; nanostructured materials; Monte Carlo-based approach; catalyst geometry; fuel cell; geometry-generation method; nanostructured catalytic system; nanostructured electrocatalytic system; Chemicals; Equations; Geometry; Heuristic algorithms; Mathematical model; Monte Carlo methods; Nanoparticles; Monte Carlo; catalysis; electrochemistry; nanoparticles; scientific computing;
  • fLanguage
    English
  • Journal_Title
    Computing in Science & Engineering
  • Publisher
    ieee
  • ISSN
    1521-9615
  • Type

    jour

  • DOI
    10.1109/MCSE.2011.40
  • Filename
    5753873
    • Link To Document
    https://search.isc.ac/dl/search/defaultta.aspx?DTC=49&DC=1499850