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26 April 2024
 
  » arxiv » 0911.3455

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Oxygen vacancies in N doped TiO2: Experiment and first principle calculations
Abdul K. Rumaiz ; J. C. Woicik ; E. Cockayne ; H. Y. Lin ; G. Hassnain Jaffari ; S. Ismat Shah ;
Date 18 Nov 2009
AbstractWe have determined the electronic and atomic structure of N doped TiO2 using a combination of hard x-ray photoelectron spectroscopy (HAXPES) and first principles density functional theory calculations. Our results reveal that N doping of TiO2 leads to the formation of oxygen vacancies and the combination of both N impurity and oxygen vacancies accounts for the observed visible light catalytic behavior of N doped TiO2.
Source arXiv, 0911.3455
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