Generation of atomistic models of periodic mesoporous silica by kinetic Monte Carlo simulation of the synthesis of the material

Journal of Physical Chemistry B

Volumn 110, Issue 1, 2006, Pages 319-333

  Schumacher, Christian ^a   Gonzalez, Jorge ^b   Wright, Paul A ^b   Seaton, Nigel A ^a  

^a UNIVERSITY OF EDINBURGH   (United Kingdom)

^b UNIVERSITY OF ST ANDREWS   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CALCINATION; COMPUTER SIMULATION; HYDROTHERMAL SYNTHESIS; MICELLES; MONOMERS; MONTE CARLO METHODS; SILICA;

ATOMISTIC MODELS; GRAND CANONICAL MONTE CARLO SIMULATION; KINETIC MONTE CARLO SIMULATION; TEMPLATING MICELLES;

MESOPOROUS MATERIALS;

EID: 31144433093     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0551871     Document Type: Article

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