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Effects of boron doping on structural, electronic, elastic, and optical properties of energetic crystal 2,6-diamino-3,5-dinitropyrazine-1-oxide: a theoretical study using the first principles calculation and Hirshfeld surface analysis

Effects of boron doping on structural, electronic, elastic, and optical properties of energetic crystal 2,6-diamino-3,5-dinitropyrazine-1-oxide: a theoretical study using the first principles calculation and Hirshfeld surface analysis

Wu, Qiong; Li, Mingqun; Hu, Qinnan; Zhang, Zewu; Zhu, Weihua

期刊名称Journal of Molecular Modeling
作者Wu, Qiong; Li, Mingqun; Hu, Qinnan; Zhang, Zewu; Zhu, Weihua
卷第26卷
期第3期
印刷ISSN1610-2940
电子ISSN0948-5023
文件大小1926.23KB
发表时间2020-3
DOI10.1007/s00894-020-4310-2

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