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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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Publicat a:Sci Rep
Autors principals: Ropo, Matti, Punkkinen, Marko, Kuopanportti, Pekko, Yasir, Muhammad, Granroth, Sari, Kuronen, Antti, Kokko, Kalevi
Format: Artigo
Idioma:Inglês
Publicat: Nature Publishing Group UK 2021
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Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC7961028/
https://ncbi.nlm.nih.gov/pubmed/33723296
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-021-85243-0
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