2018
DOI: 10.1016/j.mssp.2018.05.001
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Effects of Ni-doping on the photo-catalytic activity of TiO2 anatase and rutile: Simulation and experiment

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Cited by 34 publications
(11 citation statements)
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“…The reason for this enhancement has been tentatively ascribed to the suppression of electron-hole pair recombination on the surface of the TiO 2 catalyst by low valence Ni 2+ ions [34]. This upgraded activity was recognized as the enhanced separation of photo-generated electron-hole pairs due to the presence of Ni 2+ ions in TiO 2 [35]. Sulfur was selected as a nonmetal dopant because it has long been investigated as an effective nonmetal dopant for the improvement of the visible light response of TiO 2 .…”
Section: Introductionmentioning
confidence: 99%
“…The reason for this enhancement has been tentatively ascribed to the suppression of electron-hole pair recombination on the surface of the TiO 2 catalyst by low valence Ni 2+ ions [34]. This upgraded activity was recognized as the enhanced separation of photo-generated electron-hole pairs due to the presence of Ni 2+ ions in TiO 2 [35]. Sulfur was selected as a nonmetal dopant because it has long been investigated as an effective nonmetal dopant for the improvement of the visible light response of TiO 2 .…”
Section: Introductionmentioning
confidence: 99%
“…DFT methods, using projector-augmented waves (PAWs), have been successfully used in predicting the physical properties of solid materials [41][42][43][44][45]. Herein, a periodic slab model of 2 × 5 surface unit cells of Al (100) with five layers of 10 atoms, for a total of 50 atoms, was considered, and the vacuum was set to 30 Å.…”
Section: Computational Detailsmentioning
confidence: 99%
“…Thus, the rate of photocatalytic activity of TiO 2 is limited to the recombination rate of photoproduced electron-hole. To enhance the utilization of solar light for photocatalytic and to reduce electron-hole recombination, TiO 2 is modified by various metallic species and coupling with other semi-conductors [12,13] Many photocatalys is studies have been published using TiO 2 and doped TiO 2 as heterogeneous catalysts for the degradation of various organic pollutants [14,15,23].…”
Section: Introductionmentioning
confidence: 99%