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First-principles calculations of structural, elastic and el..:

Nong, Zhi-sheng ; Wang, Hao-yu ; Zhu, Jing-chuan
International Journal of Minerals, Metallurgy and Materials.  27 (2020)  10 - p. 1405-1414 , 2020
Link: https://doi.org/10.1007/s12613-020-2095-z