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Journal of Chemical Physics

Volumn 116, Issue 10, 2002, Pages 4281-4285

The possibility of single C-H bond activation in CH4 on a MoO3-supported Pt catalyst: A density functional theory study

(2) Zhang, C J a Hu, P a

a QUEEN'S UNIVERSITY BELFAST (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; ATOMS; CATALYSIS; CATALYST SUPPORTS; CHEMICAL BONDS; DEHYDROGENATION; FERMI SURFACE; METHANE; MOLYBDENUM COMPOUNDS; PLATINUM; PROBABILITY DENSITY FUNCTION; SURFACES;

DENSITY FUNCTIONAL THEORY; GENERALIZED GRADIENT APPROXIMATION; METHANE ACTIVATION; METHYL;

CHEMICAL ACTIVATION;

EID: 0037040810 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1449942 Document Type: Article

Times cited : (31)

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