Modification on TiO2-a Photosensitive Material

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Abstract:

TiO2, as photosensitive materials, has attracted much attention owing to its potential application in the solution of environmental pollution during the past decades. Four doped TiO2 systems were constructed and studied by using the first principle based Density Functional Theory .The results indicate that P-doped and N-doped TiO2 all have better light absorption in the visible light area than pristine TiO2 although the band gap of N-doped system reduced less. However, the band gap of F-doped and Cl-doped TiO2 increase a little, which causing the absorption to decrease. We suggest from the results that the P atom and N atom are valuable in the modification of TiO2.

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Key Engineering Materials (Volumes 579-580)

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148-152

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September 2013

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© 2014 Trans Tech Publications Ltd. All Rights Reserved

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