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Electronic Band Structure Variations in the Ceria Doped Zirconia: A First Principles Study
Using first principle calculations, the effect of Ce with different doping concentrations in the network of Zirconium dioxide (ZrO(2)) is studied. The ZrO(2) cell volume linearly increases with the increasing Ce doping concentration. The intrinsic band gap of ZrO(2) of 5.70 eV reduces to 4.67 eV wit...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2018
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6073694/ https://www.ncbi.nlm.nih.gov/pubmed/30029462 http://dx.doi.org/10.3390/ma11071238 |