Literature DB >> 21901797

Improved stability and smart-material functionality realized in an energetic cocrystal.

Onas Bolton1, Adam J Matzger.   

Abstract

Year:  2011        PMID： 21901797     DOI： 10.1002/anie.201104164

Source DB:  PubMed          Journal:  Angew Chem Int Ed Engl        ISSN： 1433-7851            Impact factor:   15.336


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  41 in total

1.  Theoretical insights into the structures and mechanical properties of HMX/NQ cocrystal explosives and their complexes, and the influence of molecular ratios on their bonding energies.

Authors:  Yong-Xiang Li; Shu-Sen Chen; Fu-de Ren
Journal:  J Mol Model       Date:  2015-08-29       Impact factor: 1.810

2.  Growth morphology of CL-20/HMX cocrystal explosive: insights from solvent behavior under different temperatures.

Authors:  Gang Han; Qi-Fa Li; Rui-Jun Gou; Shu-Hai Zhang; Fu-de Ren; Li Wang; Rong Guan
Journal:  J Mol Model       Date:  2017-11-28       Impact factor: 1.810

3.  Theoretical insight into the binding energy and detonation performance of ε-, γ-, β-CL-20 cocrystals with β-HMX, FOX-7, and DMF in different molar ratios, as well as electrostatic potential.

Authors:  Rui-Zhi Feng; Shu-Hai Zhang; Fu-de Ren; Rui-Jun Gou; Li Gao
Journal:  J Mol Model       Date:  2016-05-11       Impact factor: 1.810

4.  Some molecular/crystalline factors that affect the sensitivities of energetic materials: molecular surface electrostatic potentials, lattice free space and maximum heat of detonation per unit volume.

Authors:  Peter Politzer; Jane S Murray
Journal:  J Mol Model       Date:  2015-01-29       Impact factor: 1.810

5.  Theoretical investigations on the structures and properties of CL-20/TNT cocrystal and its defective models by molecular dynamics simulation.

Authors:  Gui-Yun Hang; Wen-Li Yu; Tao Wang; Jin-Tao Wang
Journal:  J Mol Model       Date:  2018-06-09       Impact factor: 1.810

6.  Theoretical investigation of the effects of the molar ratio and solvent on the formation of the pyrazole-nitroamine cocrystal explosive 3,4-dinitropyrazole (DNP)/2,4,6,8,10,12-hexanitrohexaazaisowurtzitane (CL-20).

Authors:  Shuang-Fei Zhu; Shu-Hai Zhang; Rui-Jun Gou; Gang Han; Chun-Lei Wu; Fu-de Ren
Journal:  J Mol Model       Date:  2017-11-24       Impact factor: 1.810

7.  Theoretical insights into the stabilities, detonation performance, and electrostatic potentials of cocrystals containing α- or β-HMX and TATB, FOX-7, NTO, or DMF in various molar ratios.

Authors:  Ken-Peng Song; Fu-de Ren; Shu-Hai Zhang; Wen-Jing Shi
Journal:  J Mol Model       Date:  2016-09-29       Impact factor: 1.810

8.  Theoretical calculation into the effect of molar ratio on the structures, stability, mechanical properties and detonation performance of 1,3,5,7-tetranitro-1,3,5,7-tetrazocane/ 1,3,5-trinitro-1,3,5-triazacyco-hexane cocrystal.

Authors:  Ye-Bai Shi; Liang-Fei Bai; Jia-Hui Li; Guang-Ai Sun; Jian Gong; Xin Ju
Journal:  J Mol Model       Date:  2019-09-03       Impact factor: 1.810

9.  Easy methods to study the smart energetic TNT/CL-20 co-crystal.

Authors:  Huarong Li; Yuanjie Shu; Shijie Gao; Ling Chen; Qing Ma; Xuehai Ju
Journal:  J Mol Model       Date:  2013-09-17       Impact factor: 1.810

10.  Theoretical insight into the sensitive mechanism of multilayer-shaped cocrystal explosives: compression and slide.

Authors:  Hong-fei Gao; Shu-hai Zhang; Fu-de Ren; Rui-jun Gou; Gang Han; Jing-bo Wu; Xiong Ding; Wen-hu Zhao
Journal:  J Mol Model       Date:  2016-04-19       Impact factor: 1.810
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