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Nitrogen concentration driving the hardness of rhenium nitrides

The structures and properties of rhenium nitrides are studied with density function based first principle method. New candidate ground states or high-pressure phases at Re:N ratios of 3:2, 1:3, and 1:4 are identified via a series of evolutionary structure searches. We find that the 3D polyhedral sta...

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Detalles Bibliográficos
Autores principales: Zhao, Zhonglong, Bao, Kuo, Li, Da, Duan, Defang, Tian, Fubo, Jin, Xilian, Chen, Changbo, Huang, Xiaoli, Liu, Bingbing, Cui, Tian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2014
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3999448/
https://www.ncbi.nlm.nih.gov/pubmed/24762713
http://dx.doi.org/10.1038/srep04797