Electronic and Mechanical Properties of Tetragonal Nb2Al Under High Pressure: First-Principles Calculations
We have investigated the structure, density of states, mechanical stability, elastic properties, and Debye temperature of tetragonal Nb2Al under high pressure using the generalized gradient approximation WC (GGA-WC) functional within density functional theory (DFT). Our obtained lattice constants we...
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| Yayımlandı: | Brazilian Journal of Physics |
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| Asıl Yazarlar: | , , , , , , |
| Materyal Türü: | Artigo |
| Dil: | Inglês |
| Baskı/Yayın Bilgisi: |
Sociedade Brasileira de Física
2016
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| Konular: | |
| Online Erişim: | https://www.redalyc.org/articulo.oa?id=46444888012 |
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