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...

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Detalles Bibliográficos
Autores principales: Yasumura, Shunsaku, Kamachi, Takashi, Toyao, Takashi, Shimizu, Ken-ichi, Hinuma, Yoyo
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
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

Internet

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

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