Grand Canonical Monte Carlo simulations for energy gases on PIM-1 polymer and silicalite-1

Chemical Engineering Science

Volumn 68, Issue 1, 2012, Pages 101-107

  Zhao, Liang ^a   Zhai, Dong ^a   Liu, Bei ^a   Liu, Zhichang ^a   Xu, Chumming ^a   Wei, Wei ^a   Chen, Yu ^a   Gao, Jinsen ^a  

^a CHINA UNIVERSITY OF PETROLEUM   (China)

Author keywords

Adsorption; Gas storage; Grand Canonical Monte Carlo; Polymer; Simulation; Zeolite

Indexed keywords

ADSORPTION BEHAVIOR; ADSORPTION SITE; EXPERIMENTAL DATA; FORCE FIELDS; GAS STORAGE; GRAND CANONICAL MONTE CARLO; GRAND CANONICAL MONTE CARLO SIMULATION; HEAT OF ABSORPTIONS; MICRO-POROUS STRUCTURE; MICROPORES; POLYMERS OF INTRINSIC MICROPOROSITIES; SILICALITE-1; SIMULATION; SMALL MOLECULES;

BEHAVIORAL RESEARCH; COMPUTER SIMULATION; HYDROGEN; HYDROGEN STORAGE; MICROPOROSITY; MONTE CARLO METHODS; POLYMERS; SILICATE MINERALS; ZEOLITES;

ADSORPTION;

EID: 81055140242     PISSN: 00092509     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.ces.2011.09.017     Document Type: Article

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