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Structural, Mechanical, Anisotropic, and Thermal Properties of AlAs in oC12 and hP6 Phases under Pressure
The structural, mechanical, anisotropic, and thermal properties of oC12-AlAs and hP6-AlAs under pressure have been investigated by employing first-principles calculations based on density functional theory. The elastic constants, bulk modulus, shear modulus, Young’s modulus, B/G ratio, and Poisson’s...
Autores principales: | Zhang, Wei, Chai, Changchun, Song, Yanxing, Fan, Qingyang, Yang, Yintang |
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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/PMC5978117/ https://www.ncbi.nlm.nih.gov/pubmed/29735901 http://dx.doi.org/10.3390/ma11050740 |
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