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First-principles study of structural, electronic and elastic properties of Nb4AlC3

Using First-principles calculations, we have studied the structural, electronic and elastic properties of Nb4AlC3, a new compound belonging to the MAX phases. Geometrical optimization of the unit cell is in good agreement with the experimental data. The effect of high pressures, up to 20 GPa, on the...

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Publikašuvnnas:Brazilian Journal of Physics
Váldodahkki: A. Bouhemadou
Materiálatiipa: Artigo
Giella:Inglês
Almmustuhtton: Sociedade Brasileira de Física 2010
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Liŋkkat:https://www.redalyc.org/articulo.oa?id=46413563009
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