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

Abstract 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 ox...

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Autores principales: Matti Ropo, Marko Punkkinen, Pekko Kuopanportti, Muhammad Yasir, Sari Granroth, Antti Kuronen, Kalevi Kokko
Formato: article
Lenguaje:EN
Publicado: Nature Portfolio 2021
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Acceso en línea:https://doaj.org/article/c4f3113c77244c379bee7eef50bdb835
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