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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| Vydáno v: | Brazilian Journal of Physics |
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| Hlavní autor: | |
| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
Sociedade Brasileira de Física
2010
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| Témata: | |
| On-line přístup: | https://www.redalyc.org/articulo.oa?id=46413563009 |
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