First-principles study of NO reduction by CO on transition metal atoms-doped CeO2(111)

Chinese Journal of Catalysis

Volumn 35, Issue 12, 2014, Pages 1937-1943

  Ding, Wuchen ^a   Li, Weixue ^a  

^a DALIAN INSTITUTE OF CHEMICAL PHYSICS   (China)

Author keywords

Cleavage; Density functional theory plus U; Nitrogen oxide reduction; Single atom; Single transition metal atom ceria

Indexed keywords

ATOMS; BOND STRENGTH (CHEMICAL); CATALYSIS; CERIUM OXIDE; DENSITY FUNCTIONAL THEORY; DOPING (ADDITIVES); NITROGEN OXIDES; TRANSITION METAL COMPOUNDS; TRANSITION METALS;

CATALYTIC CENTER; CLEAVAGE; FIRST-PRINCIPLES STUDY; NITROGEN OXIDE REDUCTION; NO REDUCTION BY CO; NO REDUCTION WITH CO; SINGLE ATOMS; TRANSITION METAL ATOMS;

REDUCTION;

EID: 84916594307     PISSN: 18722067     EISSN: None     Source Type: Journal    
DOI: 10.1016/S1872-2067(14)60169-8     Document Type: Article

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