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Title: DFT studies on anionic hetero atom (N or/and S) substitution in TiO₂
Authors: Sathish, M
Sankaran, M
Viswanathan, B
Viswanath, R P
Issue Date: Jun-2007
Publisher: CSIR
Abstract: The variation in the band structure, band gap and stability of the hetero atom substituted TiO₂ have been studied. Study shows that S doping has considerable role in the reduction of the band gap, Eg. In addition, it has been shown that sulphur doping at the oxide ion position is preferred.
Page(s): 895-898
ISSN: 0376-4710
Appears in Collections:IJC-A Vol.46A(06) [June 2007]

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