Density functional study of carbon dioxide hydrogenation on molybdenum carbide and metal

Applied Catalysis A: General

Volumn 282, Issue 1-2, 2005, Pages 5-13

  Tominaga, Hiroyuki ^a   Nagai, Masatoshi ^a  

^a TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY   (Japan)

Author keywords

CO2; DFT; Hydrogenation; Mo carbide; Mo metal

Indexed keywords

ACTIVATION ENERGY; ADSORPTION; CATALYST ACTIVITY; ELECTRONIC STRUCTURE; HYDROGEN; HYDROGENATION; MOLYBDENUM COMPOUNDS; PROBABILITY DENSITY FUNCTION; WATER;

CARBON DIOXIDE HYDROGENATION; DENSITY FUNCTIONAL THEORY; MOLECULAR ORBITS; MOLYBDENUM CARBIDE;

CARBON DIOXIDE;

EID: 14544271150     PISSN: 0926860X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.apcata.2004.09.041     Document Type: Article

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