A theoretical study of water adsorption and decomposition on low-index spinel ZnGa2O4 surfaces : correlation between surface structure and photocatalytic properties

Water adsorption and decomposition on stoichiometrically perfect and oxygen vacancy containing ZnGa2O4 (100), (110), and (111) surfaces were investigated through periodic density functional theory (DFT) calculations. The results demonstrated that water adsorption and decomposition are surface-struct...

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Publié dans:Langmuir : the ACS journal of surfaces and colloids. - 1985. - 29(2013), 23 vom: 11. Juni, Seite 7025-37
Auteur principal: Jia, Chuanyi (Auteur)
Autres auteurs: Fan, Weiliu, Yang, Fei, Zhao, Xian, Sun, Honggang, Li, Pan, Liu, Li
Format: Article en ligne
Langue:English
Publié: 2013
Accès à la collection:Langmuir : the ACS journal of surfaces and colloids
Sujets:Journal Article