Theoretical Investigation for Neon Doping Effect on the Electronic Structure and Optical Properties of Rutile TiO2 for Photocatalytic Applications by Ab Initio Calculations 英文论文文献.docVIP

Journal of Physical Science, Vol. 23(2), 85–90, 2012 Theoretical Investigation for Neon Doping Effect on the Electronic Structure and Optical Properties of Rutile TiO2 for Photocatalytic Applications by Ab Initio Calculations Aqeel Mohsin Ali Molecular Physics Group, Department of Physics, College of Science, University of Basrah, Basrah, Iraq E-mail: aqeel.ali@uobasrah.edu.iq Abstract: The non-metals doping as an anion to alternate the electronic structure and optical absorption property of TiO 2, and ultimately, to induce the visible light activity for it have been the purpose of th