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An Ab Initio Study of Magnetism in Disordered Fe-Al Alloys with Thermal Antiphase Boundaries

We have performed a quantum-mechanical study of a B2 phase of Fe [Formula: see text] Al [Formula: see text] alloy with and without antiphase boundaries (APBs) with the {001} crystallographic orientation of APB interfaces. We used a supercell approach with the atoms distributed according to the speci...

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Publicado en:Nanomaterials (Basel)
Autores principales: Friák, Martin, Golian, Miroslav, Holec, David, Koutná, Nikola, Šob, Mojmír
Formato: Artigo
Lenguaje:Inglês
Publicado: MDPI 2019
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Acceso en línea:https://ncbi.nlm.nih.gov/pmc/articles/PMC7022334/
https://ncbi.nlm.nih.gov/pubmed/31878105
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.3390/nano10010044
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