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Data on the comprehensive first-principles diffusion study of the aluminum-magnesium system

First-principles calculation of diffusion coefficients between Mg and Al is investigated comprehensively using density functional theory (DFT). The effect of different uncertainty sources arising from first principles calculations has been investigated systematically. These sources include the diffu...

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Detalles Bibliográficos
Autores principales: Hooshmand, M.S., Zhong, W., Zhao, J.C., Windl, W., Ghazisaeidi, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7096754/
https://www.ncbi.nlm.nih.gov/pubmed/32258269
http://dx.doi.org/10.1016/j.dib.2020.105381