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Study of the Structure, Electronic and Optical Properties of BiOI/Rutile-TiO(2) Heterojunction by the First-Principle Calculation
Using the first-principle calculation that is based on the density functional theory (DFT), our group gains some insights of the structural, electronic and optical properties of two brand new types of BiOI/TiO(2) heterojunctions: 1I-terminated BiOI {001} surface/TiO(2) (1I-BiOI/TiO(2)) and BiO-termi...
| 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/PMC7014688/ https://www.ncbi.nlm.nih.gov/pubmed/31936752 http://dx.doi.org/10.3390/ma13020323 |