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Rich stoichiometries of stable Ca-Bi system: Structure prediction and superconductivity

Using a variable-composition ab initio evolutionary algorithm implemented in the USPEX code, we have performed a systematic search for stable compounds in the Ca-Bi system at different pressures. In addition to the well-known tI12-Ca(2)Bi and oS12-CaBi(2), a few more structures were found by our cal...

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Detalles Bibliográficos
Autores principales: Dong, Xu, Fan, Changzeng
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4366814/
https://www.ncbi.nlm.nih.gov/pubmed/25790859
http://dx.doi.org/10.1038/srep09326