Band gap engineering of compensated (N, H) and (C, 2H) codoped anatase TiO 2: A first-principles calculation

Chemical Physics Letters

Volumn 539-540, Issue , 2012, Pages 175-179

  Li, Min ^a   Zhang, Junying ^a   Guo, Dong ^b   Zhang, Yue ^a  

^a BEIHANG UNIVERSITY   (China)

^b INSTITUTE OF ACOUSTICS   (China)

Author keywords

[No Author keywords available]

Indexed keywords

ANATASE TIO; BAND GAP ENGINEERING; BAND GAP NARROWING; CO-DOPED; FIRST-PRINCIPLES CALCULATION; LOCAL STATE; N-DOPED TIO; SPIN-POLARIZED DENSITY FUNCTIONAL THEORY; TIO; VISIBLE-LIGHT IRRADIATION; VISIBLE-LIGHT PHOTOCATALYSTS;

CALCULATIONS; DENSITY FUNCTIONAL THEORY; DOPING (ADDITIVES); ELECTRONIC STRUCTURE; ENERGY GAP; OPTICAL PROPERTIES;

TITANIUM DIOXIDE;

EID: 84862695885     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2012.04.057     Document Type: Article

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