Tungsten oxide in catalysis and photocatalysis: Hints from DFT

Topics in Catalysis

Volumn 56, Issue 15-17, 2013, Pages 1404-1419

  Di Valentin, Cristiana ^a   Wang, Fenggong ^a   Pacchioni, Gianfranco ^a  

^a UNIVERSITY OF MILANO BICOCCA   (Italy)

Author keywords

Defects; DFT; Dopants; Electronic structure; Semiconducting oxides

Indexed keywords

DEFECTS; DOPING (ADDITIVES); ELECTRONIC STRUCTURE; ENERGY GAP; OXIDE MINERALS; PHOTOCATALYSIS; TITANIUM DIOXIDE; TUNGSTEN COMPOUNDS;

CRYSTALLOGRAPHIC DIRECTIONS; DFT; FIRST-PRINCIPLE DENSITY-FUNCTIONAL THEORIES; FUNDAMENTAL PROPERTIES; HETEROGENEOUS CATALYST; HYBRID FUNCTIONAL; SEMICONDUCTING OXIDE; SUBSTITUTIONAL ATOMS;

CATALYST ACTIVITY;

EID: 84889835815     PISSN: 10225528     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11244-013-0147-6     Document Type: Article

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