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Molecular Simulation Volume 46, 2020 - Issue 2
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Articles

Theoretical investigation on the interaction mechanism of FOX-7/AP mixed crystals

Jun TaoXi’an Modern Chemistry Research Institute, Xi’an, People’s Republic of ChinaCorrespondence[email protected]
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Xiaofeng WangXi’an Modern Chemistry Research Institute, Xi’an, People’s Republic of ChinaView further author information
Pages 155-161 | Received 16 May 2019, Accepted 14 Oct 2019, Published online: 31 Oct 2019

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Jiake Fan, Baoyun Ye, Chongwei An & Jingyu Wang. (2023) Theoretical calculation on the interaction mechanism between 2,6‐diamino‐3,5‐dinitropyrazine‐1‐oxide and ammonium perchlorate. Journal of Energetic Materials 41:2, pages 236-252.
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Articles from other publishers (4)

Bi-Bo Li, Shu-Hai Zhang, Rui-Jun Gou, Shuang-Fei Zhu, Yang Liu, Shang-biao Feng, Qian-Jin Guo & Bao-Sen Zhang. (2023) DFT study on the intermolecular interaction between two energetic ionic salts: a case of TKX-50 and ADN. Chemical Papers 77:12, pages 7515-7526.
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Nassima Bachir, Samir Kenouche & Jorge I. Martínez-Araya. (2023) The effect of interactions on the sensitivity of C NO trigger bonds in FOX-7: Approach based on the QTAIM/EDA-NOCV analysis . Journal of Molecular Graphics and Modelling, pages 108645.
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Chenze Chai, Qinghai Shu, Qiang Su, Jian Wang, Xijuan Lv, Dongxu Wang & Lixiang Zhong. (2023) Theoretical investigation on intermolecular interactions, co-crystal structure, thermal decomposition mechanism, and shock properties of 3-nitro-1,2,4-triazol-5-one (NTO) and ammonium perchlorate. CrystEngComm 25:4, pages 671-682.
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Ping Ye, Pengfei Xu, Hao Guo, Bing Gao, Guangcheng Yang, Bing Huang & Changping Guo. (2020) Construction of environment-friendly core-shell ammonium perchlorate@1,3,5-triamino-2,4,6-trinitrobenzene composites with high safety and excellent thermal decomposition properties. Materials & Design 191, pages 108666.
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