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Oxygen adsorption on (100) surfaces in Fe–Cr alloys

The adsorption of oxygen on bcc Fe–Cr(100) surfaces with two different alloy concentrations is studied using ab initio density functional calculations. Atomic-scale analysis of oxygen–surface interactions is indispensable for obtaining a comprehensive understanding of macroscopic surface oxidation p...

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Detalles Bibliográficos
Autores principales:	Ropo, Matti, Punkkinen, Marko, Kuopanportti, Pekko, Yasir, Muhammad, Granroth, Sari, Kuronen, Antti, Kokko, Kalevi
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Nature Publishing Group UK 2021
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7961028/ https://www.ncbi.nlm.nih.gov/pubmed/33723296 http://dx.doi.org/10.1038/s41598-021-85243-0

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