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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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Bibliografiske detaljer
Main Authors: Xu, Bo, Wang, Qianqian, Tian, Yongjun
Format: Artigo
Sprog:Inglês
Udgivet: Nature Publishing Group 2013
Fag:
Online adgang:https://ncbi.nlm.nih.gov/pmc/articles/PMC3810668/
https://ncbi.nlm.nih.gov/pubmed/24166098
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/srep03068
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