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Prediction of Stable Surfaces of Metal Oxides through the Unsaturated Coordination Index
[Image: see text] This study proposes the unsaturated coordination index, σ, as a potential descriptor of the stability of metal-oxide surfaces cleaved from bulk. The value of σ, the number of missing bonds per unit area, can be obtained very quickly using only crystallographic data, namely, the bul...
| 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/PMC10433516/ https://www.ncbi.nlm.nih.gov/pubmed/37599947 http://dx.doi.org/10.1021/acsomega.3c04253 |