The LDA+U Method for Studying Non-linear Optical Properties of Transition Metal Oxides
碩士 === 淡江大學 === 物理學系碩士班 === 95 === Methodology : The DFT bases code CASTEP was used in our group for many successful studies of materials properties of various system. However for transition metal Oxides there localized d-electron cause the calculate SHG coefficient to be not accurate . We used LDA+...
| Main Authors: | , |
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| Other Authors: | |
| Format: | Others |
| Language: | zh-TW |
| Published: |
2007
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| Online Access: | http://ndltd.ncl.edu.tw/handle/90343604106420456471 |