Proceedings of the Korean Institute of Electrical and Electronic Material Engineers Conference (한국전기전자재료학회:학술대회논문집)
- 2005.07a
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- Pages.172-173
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- 2005
Calculation on Electronic State of Y-doped ZnO
Y이 도핑된 ZnO의 전자상태 계산
- Lee, Dong-Yoon (Korea Electrotechnology Research Institute) ;
- Lee, Won-Jae (Korea Electrotechnology Research Institute) ;
- Song, Jae-Sung (Korea Electrotechnology Research Institute) ;
- Koo, Bo-Kun (Korea Electrotechnology Research Institute) ;
- Kim, Hyun-Ju (Korea Electrotechnology Research Institute)
- 이동윤 (한국전기연구원 전자기소자연구그룹) ;
- 이원재 (한국전기연구원 전자기소자연구그룹) ;
- 송재성 (한국전기연구원 전자기소자연구그룹) ;
- 구보근 (한국전기연구원 전자기소자연구그룹) ;
- 김현주 (한국전기연구원 전자기소자연구그룹)
- Published : 2005.07.07
Abstract
The electronic state of ZnO doped with Y was calculated using the density functional theory. In this study, the program used for the calculation on theoretical structures of ZnO and doped ZnO was Vienna Ab-initio Simulation Package (VASP), which is a sort of pseudo potential method. The detail of electronic structure was obtained by the descrite variational