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Elastic Properties and Electronic Properties of M(x)N(y) (M = Ti, Zr) from First Principles Calculations
The elastic properties and electronic properties of M(x)N(y) (M = Ti, Zr) TiN, Ti(2)N, Zr(3)N(4), ZrN with different structures have been investigated using density functional theory. Through the calculation of the elastic constants, it was found that all of these structures meet the mechanical stab...
Autores principales: | , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2018
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6165207/ https://www.ncbi.nlm.nih.gov/pubmed/30205423 http://dx.doi.org/10.3390/ma11091640 |