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First–Principles Investigation of the Structural, Elastic, Electronic, and Optical Properties of α– and β–SrZrS(3): Implications for Photovoltaic Applications
Transition metal perovskite chalcogenides are attractive solar absorber materials for renewable energy applications. Herein, we present the first–principles screened hybrid density functional theory analyses of the structural, elastic, electronic and optical properties of the two structure modificat...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2020
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7079647/ https://www.ncbi.nlm.nih.gov/pubmed/32098231 http://dx.doi.org/10.3390/ma13040978 |