The Microstructure and Electronic Properties of Yttrium Oxide Doped With Cerium: A Theoretical Insight.

Ju, Meng; Wang, Jingjing; Huang, Jing; Zhang, Chuanzhao; Jin, Yuanyuan; Sun, Weiguo; Li, Shichang; Chen, Yunhong

Ju, Meng; Wang, Jingjing; Huang, Jing; Zhang, Chuanzhao; Jin, Yuanyuan; Sun, Weiguo; Li, Shichang; Chen, Yunhong.

Afiliação

Ju M; School of Physical Science and Technology, Southwest University, Chongqing, China.
Wang J; College of Computer and Information Engineering, Hubei Normal University, Huangshi, China.
Huang J; College of Computer and Information Engineering, Hubei Normal University, Huangshi, China.
Zhang C; School of Physical Science and Technology, Southwest University, Chongqing, China.
Jin Y; Department of Physics and Optoelectronic Engineering, Yangtze University, Jingzhou, China.
Sun W; Department of Physics and Optoelectronic Engineering, Yangtze University, Jingzhou, China.
Li S; Centre for Science at Extreme Conditions and School of Physics and Astronomy, Scottish Universities Physics Alliance (SUPA), University of Edinburgh, Edinburgh, United Kingdom.
Chen Y; School of Science, Chongqing University of Posts and Telecommunications, Chongqing, China.

Front Chem ; 8: 338, 2020.

Article em En | MEDLINE | ID: mdl-32411670

Palavras-chave

crystal structure prediction (CSP); electronic propercies; rare earth element; structural evolution; theoretical calculation DFT

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Revista: Front Chem Ano de publicação: 2020 Tipo de documento: Article País de afiliação: China

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