Open AccessDensity functional theory study of atomic and electronic properties of defects in reduced anatase TiO2 nanocrystals
Author(s) -
Kazuki Morita,
Kenji Yasuoka
Publication year - 2018
Publication title -
aip advances
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.421
H-Index - 58
ISSN - 2158-3226
DOI - 10.1063/1.5021024
Subject(s) - anatase , nanocrystal , density functional theory , materials science , band gap , photovoltaics , nanotechnology , valence (chemistry) , chemical physics , electronic structure , titanium , photocatalysis , optoelectronics , chemistry , computational chemistry , metallurgy , catalysis , photovoltaic system , ecology , biochemistry , organic chemistry , biology
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