Physisorption and chemisorption of hydrocarbons in H-FAU using QM-Pot(MP2//B3LYP) calculations

Journal of Physical Chemistry C

Volumn 112, Issue 31, 2008, Pages 11796-11812

  De Moor, Bart A ^a   Reyniers, Marie Françoise ^a   Sierka, Marek ^b   Sauer, Joachim ^b   Marin, Guy B ^a  

^a GHENT UNIVERSITY   (Belgium)

^b HUMBOLDT UNIVERSITY   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

BUTENES; CHEMISORPTION; ETHYLENE; HYDROCARBONS; HYDROGEN; NONMETALS; ORGANIC COMPOUNDS; PHYSISORPTION;

1-BUTENE; 1-OCTENE; 1-PENTENE; FORCE FIELD; QUANTUM-MECHANICAL;

CARBON;

EID: 49649126607     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp711109m     Document Type: Article

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