期刊
CERAMICS INTERNATIONAL
卷 44, 期 13, 页码 16069-16075出版社
ELSEVIER SCI LTD
DOI: 10.1016/j.ceramint.2018.05.174
关键词
Bandgap; Ferroelectricity; KNN; Vacancies; First principle calculations
资金
- National Natural Science Foundation of China [11074059, 51502054]
- Postdoctoral Science Foundation of China [2014M551236]
- Postdoctoral Science Foundation of Heilongjiang Province [LBH-Z14083]
- Fundamental Research Funds for the Central Universities [HIT.MKSTISP.2016 11]
- Program for Innovation Research of Science of Harbin Institute of Technology [201622]
- Open Foundation of State Key Laboratory of Electronic Thin Films and Integrated Devices [KFJJ201701]
Perovskite materials possess promising application prospects in photovoltaics and are most likely to replace the dominance of silicon-based solar photovoltaic materials. (K0.5Na0.5)NbO3-xFe(2)O(3) perovskite ferroelectric ceramics (x = 0, 0.01, and 0.05) were prepared using a conventional solid-state reaction method. We systematically analyzed the structural, morphological, electric, magnetic, and optical properties. Structural and morphological features of the as-prepared ceramics show that the phases of the materials all are orthorhombic. The appropriate amount of Fe2O3 introduced will improve the electrical properties. Magnetic switching corresponding to a diamagnetic-ferromagnetic transformation was observed. Bandgap (E-g) modulation was achieved in the Fe2O3-doped KNN ceramics, with the E-g exhibiting a drastic decrease as the doping content increased in experiment where the E-g = 2.886, 2.232, and 2.061 eV when x = 0, 0.01, and 0.05, and the CASTEP calculation shows a similar trend, indicating that the materials exhibit a higher performance with the absorption in visible light.
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