First Principles Study of the Effect of Oxygen Vacancy and Mechanical Strain on the Photocatalytic Activity of Anatase TiO2
碩士 === 國立臺灣大學 === 材料科學與工程學研究所 === 98 === This study tried to use First Principles to study the effects of induced oxygen vacancies and mechanical strain on formation energy of oxygen vacancies, electronic density of states, band structure and optic absorption coefficient. Our results showed that in...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2010
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| Online Access: | http://ndltd.ncl.edu.tw/handle/95510636079016948999 |