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TATB/聚三氟氯乙烯复合材料力学性能的MD模拟 被引量:11
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作者 马秀芳 肖继军 +1 位作者 殷开梁 肖鹤鸣 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 北大核心 2005年第1期55-58,共4页
用分子动力学(MD)方法,对聚三氟氯乙烯(PCTFE)在1,3,5 三氨基 2,4,6 三硝基苯(TATB)晶体表 面的行为进行模拟计算,求得结合能和静态力学性能(弹性系数、模量和泊松比).发现以氢键为主的分子间相互 作用相当强.TATB基氟聚合物粘结... 用分子动力学(MD)方法,对聚三氟氯乙烯(PCTFE)在1,3,5 三氨基 2,4,6 三硝基苯(TATB)晶体表 面的行为进行模拟计算,求得结合能和静态力学性能(弹性系数、模量和泊松比).发现以氢键为主的分子间相互 作用相当强.TATB基氟聚合物粘结炸药(PolymerBondedExplosive,PBX)较TATB单体炸药的力学性能改变很 大,拉伸模量、体积模量和剪切模量均减小,表明刚性减弱,弹性增强,力学性能显著改善. 展开更多
关键词 1 3 5-triamino-2 4 6-trinitrobenzene 聚三氟氯乙烯 高聚物粘结炸药 分子动力学 力学性能
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Preparation of Ultrafine TATB and the Technology for Crystal Morphology Control 被引量:9
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作者 Yang,Li Ren,Xiaoting +2 位作者 Li,Tiecheng Wang,Shiwei Zhang,Tonglai 《Chinese Journal of Chemistry》 SCIE CAS CSCD 2012年第2期293-298,共6页
The ultrafine 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) has been prepared by using solvent and non-solvent method, and the influencing factors in close relationship with the grain size and crystal morphology contr... The ultrafine 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) has been prepared by using solvent and non-solvent method, and the influencing factors in close relationship with the grain size and crystal morphology control such as categories and dosage of surfactants, volume ratio of solvent to non-solvent have also been considered in this paper. It showed that these factors had remarkable effect on the crystal morphology, particle size and agglomeration during the crystallization process. By using 0.095% (mass percentage) ionic surfactant (S) as the additive and using spray-drops feeding device as the dropping equipment, 1.06 g TATB raw materials have been refined into free-running ellipsoid and spherical TATB grains with the grain size from 30 to 50 nm. By using 0.014% (mass percentage) non-ionic surfactant (P) as the additive, spherical TATB grains with the particle diameter of 50 nm and with narrow particle-size distribution have also been obtained. It was shown by the characterizations that the ultrafine particle of TATB had better heat resisting evenness and its 5 seconds ignition point is advanced by 7.5 K. 展开更多
关键词 1 3 5-triamino-2 4 6-trinitrobenzene solvent and non-solvent method ULTRAFINE crystal morphology crystal growth SURFACTANTS
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