Adsorption and diffusion of benzene in the nanoporous catalysts FAU, ZSM-5 and MCM-22: A molecular dynamics study

Journal of Molecular Graphics and Modelling

Volumn 24, Issue 5, 2006, Pages 373-382

  Rungsirisakun, Ratana ^a   Nanok, Tanin ^a   Probst, Michael ^b   Limtrakul, Jumras ^a  

^a KASETSART UNIVERSITY   (Thailand)

^b UNIVERSITY OF INNSBRUCK   (Austria)

Author keywords

Adsorption; Benzene; Diffusion; FAU; MCM 22; Molecular dynamics; ZSM 5

Indexed keywords

ADSORPTION; CATALYSTS; DIFFUSION; MOLECULAR DYNAMICS; NANOSTRUCTURED MATERIALS; POTENTIAL ENERGY;

FAU; MCM-22; POTENTIAL ENERGY FUNCTIONS; ZSM-5;

BENZENE;

BENZENE; ZEOLITE;

ADSORPTION KINETICS; ARTICLE; CATALYSIS; CATALYST; CHEMICAL STRUCTURE; COMPLEX FORMATION; CONFORMATION; DIFFUSION COEFFICIENT; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; MOLECULAR MODEL; PHYSICAL CHEMISTRY; PHYSICAL PHASE; POROSITY; PRIORITY JOURNAL; SIMULATION;

ADSORPTION; BENZENE; CATALYSIS; COMPUTER SIMULATION; DIFFUSION; MODELS, MOLECULAR; MOLECULAR CONFORMATION; NANOSTRUCTURES; POROSITY; ZEOLITES;

EID: 33644627945     PISSN: 10933263     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.jmgm.2005.10.003     Document Type: Article

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