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New Insight into Elastic Mechanical Properties and Anisotropies of Crystal Defect α-Quartz from DFT Calculation

[Image: see text] To reveal the cleavage mechanism of α-quartz in the grinding process of nonferrous metal ores, mechanical and charge properties of α-quartz crystals are investigated using the density functional theory. Based on the elastic constant matrix, the bulk and shear moduli were calculated...

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Detalles Bibliográficos
Autores principales: Zhang, Lin, Jiao, Fen, Qin, Wenqing, Wei, Qian
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10666211/
https://www.ncbi.nlm.nih.gov/pubmed/38027338
http://dx.doi.org/10.1021/acsomega.3c05173