Theoretical study of the dehydrogenation reaction of ethane catalyzed by zeolites containing non-framework gallium species: The 3-step mechanism × the 1-step concerted mechanism

Chemical Physics Letters

Volumn 406, Issue 4-6, 2005, Pages 446-451

  Pereira, Marcio Soares ^a   Nascimento, Marco Antonio Chaer ^a  

^a FEDERAL UNIVERSITY OF RIO DE JANEIRO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYSIS; DEHYDROGENATION; DIMERIZATION; ETHANE; GALLIUM COMPOUNDS; PROBABILITY DENSITY FUNCTION; ZEOLITES;

DEHYDRIDE GALLIUM; DENSITY FUNCTIONAL THEORY (DFT); MOLECULAR HYDROGEN; REACTION COORDINATES;

REACTION KINETICS;

EID: 16644379715     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2005.02.108     Document Type: Article

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