Physisorption and chemisorption of linear alkenes in zeolites: A combined QM-Pot(MP2//B3LYP:GULP)-statistical thermodynamics study

Journal of Physical Chemistry C

Volumn 115, Issue 48, 2011, Pages 23831-23847

  Nguyen, Cuong M ^a   De Moor, Bart A ^a   Reyniers, Marie Françoise ^a   Marin, Guy B ^a  

^a GHENT UNIVERSITY   (Belgium)

Author keywords

[No Author keywords available]

Indexed keywords

1-ALKENES; ALKOXIDES; C-C DOUBLE BONDS; CARBON NUMBER; ENTROPY LOSS; GASPHASE; H-ZSM-5; INTRINSIC STABILITY; LINEAR ALKENES; LINEAR VARIATION; PHYSISORBED; SORPTION ENTHALPY; SORPTION THERMODYNAMICS; ZEOLITE TOPOLOGY;

CHEMISORPTION; ENTROPY; OLEFINS; PHYSISORPTION; QUANTUM THEORY; SILICATE MINERALS; STATISTICAL MECHANICS;

THERMODYNAMICS;

EID: 82555183988     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp2067606     Document Type: Article

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