First-Principle Study on Correlate Structural, Electronic and Optical Properties of Ce-Doped BaTiO[sub.3]

The structural, electronic, and optical properties of pure and Ce-doped BaTiO[sub.3] were investigated based on first-principle calculation. Here, we concentrate on understanding the effect of the substitution of Ce for Ba and Ti sites in the equilibrium lattice parameters, DOS, electronic band stru...

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Veröffentlicht in:	Crystals (Basel) 2023-02, Vol.13 (2)
Hauptverfasser:	Yue, Haojie, Fang, Kailing, Chen, Tiantian, Jing, Qinfang, Guo, Kun, Liu, Zhiyong, Xie, Bing, Mao, Pu, Lu, Jinshan, Tay, Francis Eng Hock, Tan, Ivan, Yao, Kui
Format:	Artikel
Sprache:	eng
Schlagworte:	Ceramic materials Ceramics Optical properties
Online-Zugang:	Volltext
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