Molecular dynamics simulations of the diffusion of small chain hydrocarbons in 8-ring zeolites

Journal of Physical Chemistry C

Volumn 115, Issue 4, 2011, Pages 875-884

  Combariza, Aldo F ^a   Sastre, German ^a   Corma, Avelino ^a  

^a CSIC   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

ANOMALOUS DIFFUSION; DIFFUSION PATHS; EXPERIMENTAL MEASUREMENTS; GUEST MOLECULES; HIGHER TEMPERATURES; HOST-GUESTS; LENGTH SCALE; LEVITATION EFFECTS; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR SIEVING PROPERTIES; PURE SILICA ZEOLITES; SELF-DIFFUSION COEFFICIENTS; TEMPERATURE RANGE; TOPOLOGICAL FEATURES; TRANSLATIONAL MOTIONS; WINDOW SIZE;

COMPUTER SIMULATION; DYNAMICS; ETHANE; METHANE; MOLECULAR DYNAMICS; PROPANE; PROPYLENE; SILICA; SILICATE MINERALS; SILICON; ZEOLITES;

DIFFUSION;

EID: 79952716099     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp102262n     Document Type: Article

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