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Journal of Molecular Modeling|April 1, 2025
Structure and properties of pentazole ionic saltsYang Zhu, Peng Zhang, YuQin Chu, et al.
Journal of Molecular Modeling|February 25, 2025
First-principles study on energetic cocrystals of CL-20/4,5-MDNI with two different stoichiometric ratios under high pressureZikai Gao, Zhihui Gu, Mengjie Bao, et al.
Journal of Molecular Modeling|February 25, 2024
The regulation of high-energy insensitive compound 2,6-diamino-3,5-dinitropyrazine-1-oxide by external electric fieldJun Chen, Jiani Xu, Tingting Xiao, et al.
Journal of Molecular Modeling|April 5, 2024
Periodic DFT study of structural transformations of cocrystal CL-20/MMI under high pressureJiani Xu, Tingting Xiao, Jun Chen, et al.
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