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Insights into the Fracture Nature of Hematite from First Principles DFT Calculations
[Image: see text] Hematite, as an important iron source, usually crystallizes in the structure of rhombohedral R3̅c in nature. To date, reports on the major exposed surface of hematite are still inconclusive. Herein, the fracture nature of hematite is studied by the density functional theory (DFT) m...
| Autores principales: | , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2023
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9996782/ https://www.ncbi.nlm.nih.gov/pubmed/36910958 http://dx.doi.org/10.1021/acsomega.2c06101 |