Effect of Al-Ga codoped on electric and optical properties of ZnO from first principles calculations
碩士 === 明志科技大學 === 材料工程系碩士班 === 103 === This study adopted density functional theory and the Hubbard U (DFT + U) method based on CASTEP 5.5 mod to investigate the formation energies, electronic structures, and optical properties of Al/Ga-co-doped ZnO. 3 × 3 × 2 72-atom ZnO supercell model consid...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2015
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| Online Access: | http://ndltd.ncl.edu.tw/handle/csb36j |