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Nonmetallization and band inversion in beryllium dicarbide at high pressure
Carbides have attracted much attention owing to their interesting physical and chemical properties. Here, we systematically investigated global energetically stable structures of BeC(2) in the pressure range of 0–100 GPa using a first-principles structural search. A transition from the ambient-press...
| Autores principales: | , , , , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Nature Publishing Group
2016
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4873822/ https://www.ncbi.nlm.nih.gov/pubmed/27198492 http://dx.doi.org/10.1038/srep26398 |