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First-principles investigation on elastic and thermodynamic properties of Pnnm-CN under high pressure

The elastic anisotropy and thermodynamic properties of the recently synthesized Pnnm-CN have been investigated using first-principles calculations under high temperature and high pressure. The calculated equilibrium crystal parameters and normalized volume dependence of the resulting pressure agree...

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Detalles Bibliográficos
Autores principales: Ya-Ru, Zhao, Hai-Rong, Zhang, Gang-Tai, Zhang, Qun, Wei, Yu-Quan, Yuan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: AIP Publishing LLC 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5193123/
https://www.ncbi.nlm.nih.gov/pubmed/28090376
http://dx.doi.org/10.1063/1.4972775