First-Principles Calculations of the Electronic Structure and Optical Properties of Yttrium-Doped ZnO Monolayer with Vacancy

The electronic structures and optical characteristics of yttrium (Y)-doped ZnO monolayers (MLs) with vacancy (zinc vacancy, oxygen vacancy) were investigated by the first-principles density functional theory. Calculations were performed with the GGA+U (generalized gradient approximation plus U) appr...

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Detalles Bibliográficos
Autores principales: Wu, Qian, Wang, Ping, Liu, Yan, Yang, Han, Cheng, Jingsi, Guo, Lixin, Yang, Yintang, Zhang, Zhiyong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7040613/
https://www.ncbi.nlm.nih.gov/pubmed/32033442
http://dx.doi.org/10.3390/ma13030724

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7040613/
https://www.ncbi.nlm.nih.gov/pubmed/32033442
http://dx.doi.org/10.3390/ma13030724

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