First-principles study of optical absorption properties of perovskite PbZrxTi1-xO3

Xinghui Wu,Sisi Liu,Wenning Zhao,Tangyou Sun,Zhimou Xu,Zhichao Ma,Zhiqiang Yu

International Photonics and OptoElectronics Meetings (2014), paper JF2A.30（2014）

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摘要

The energetic stability, the structural and the electronic properties of perovskite PbZrxTi1-xO3 are systematically investigated by the first-principles. when the x=0.5, the light absorption properties of PZT in non Zirconium-Rich area is the hightest.

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关键词

Perovskite Structure,Piezoelectric Properties,Perovskite Oxides,Perovskites

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