Kinetic Monte Carlo Simulation of Statistical Mechanical Models and Coarse-Grained Mesoscale Descriptions of Catalytic Reaction-Diffusion Processes: 1D Nanoporous and 2D Surface Systems

Chemical Reviews

Volumn 115, Issue 12, 2015, Pages 5979-6050

  Liu, Da Jiang ^a   Garcia, Andres ^a,b   Wang, Jing ^a,b   Ackerman, David M ^a   Wang, Chi Jen ^a,b,c   Evans, James W ^a,b  

^a IOWA STATE UNIVERSITY   (United States)

^b IOWA STATE UNIVERSITY   (United States)

^c GEORGIA INSTITUTE OF TECHNOLOGY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYSIS; DIFFUSION IN LIQUIDS; PHASE SEPARATION; SILICA; ZEOLITES;

CATALYTIC REACTIONS; CRYSTALLINE SURFACES; KINETIC MONTE CARLO SIMULATION; LATERAL INTERACTIONS; MEAN-FIELD TREATMENTS; SPATIAL CORRELATIONS; SUPERLATTICE ORDERING; TRANSPORT LIMITATIONS;

MONTE CARLO METHODS;

EID: 84932619277     PISSN: 00092665     EISSN: 15206890     Source Type: Journal    
DOI: 10.1021/cr500453t     Document Type: Review

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