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First-Principles Study on the Stability, Site Preference, Electronic Structure and Magnetism of Alloyed Fe(3)B with Ni(3)P-Type Structure
First-principles calculations were performed to investigate the site preference of alloying elements, and the effect of alloying elements on stability, electronic structure and magnetism of Ni(3)P-type Fe(3)B. The calculated energies suggested that all studied compounds are thermodynamically stable...
Autores principales: | , , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9457263/ https://www.ncbi.nlm.nih.gov/pubmed/36079371 http://dx.doi.org/10.3390/ma15175990 |