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Electronic bonding analyses and mechanical strengths of incompressible tetragonal transition metal dinitrides TMN(2) (TM = Ti, Zr, and Hf)

Motivated by recent successful synthesis of transition metal dinitride TiN(2), the electronic structure and mechanical properties of the discovered TiN(2) and other two family members (ZrN(2) and HfN(2)) have been thus fully investigated by using first-principles calculations to explore the possibil...

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Detalles Bibliográficos
Autores principales: Zhang, Meiguang, Cheng, Ke, Yan, Haiyan, Wei, Qun, Zheng, Baobing
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5103277/
https://www.ncbi.nlm.nih.gov/pubmed/27830728
http://dx.doi.org/10.1038/srep36911