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Bulk modulus for polar covalent crystals

A microscopic empirical model of bulk modulus based on atomic-scale parameters is proposed. These parameters include the bond length, the effective bonded valence electron (EBVE) number, and the coordination number product of two bonded atoms, etc. The estimated bulk moduli from our model are in goo...

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Detalles Bibliográficos
Autores principales: Xu, Bo, Wang, Qianqian, Tian, Yongjun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3810668/
https://www.ncbi.nlm.nih.gov/pubmed/24166098
http://dx.doi.org/10.1038/srep03068