[1]杨巍璐,宋秀铎,陈旭,等.SEBS与常用单质炸药的相容性研究[J].爆破器材,2024,53(04):28-36.[doi:10.3969/j.issn.1001-8352.2024.04.005]
 YANG Weilu,SONG Xiuduo,CHEN Xu,et al.Compatibility between SEBS and Commonly Used Single Compound Explosives[J].EXPLOSIVE MATERIALS,2024,53(04):28-36.[doi:10.3969/j.issn.1001-8352.2024.04.005]
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SEBS与常用单质炸药的相容性研究()
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《爆破器材》[ISSN:1001-8352/CN:32-1163/TJ]

卷:
53
期数:
2024年04
页码:
28-36
栏目:
爆炸材料
出版日期:
2024-07-18

文章信息/Info

Title:
Compatibility between SEBS and Commonly Used Single Compound Explosives
文章编号:
5904
作者:
杨巍璐宋秀铎 陈旭付康袁志锋裴江峰
西安近代化学研究所(陕西西安,710065)
Author(s):
YANG Weilu SONG Xiuduo CHEN Xu FU Kang YUAN Zhifeng PEI Jiangfeng
Xi’an Modern Chemistry Research Institute (Shaanxi Xi’an, 710065)
关键词:
分子动力学模拟氢化苯乙烯-丁二烯-苯乙烯嵌段共聚物单质炸药固体推进剂相容性
Keywords:
molecular dynamics simulation SEBS single-compound explosive solid propellant compatibility
分类号:
TQ560.1;O642.1; O622.6
DOI:
10.3969/j.issn.1001-8352.2024.04.005
文献标志码:
A
摘要:
将分子动力学(MD)模拟方法中理论键长变化趋势与差示扫描量热法(DSC)测得的分解温度变化情况相结合,分析了热塑性弹性体氢化苯乙烯-丁二烯-苯乙烯嵌段共聚物(SEBS)与推进剂中常用的单质炸药黑索今(RDX)、奥克托今(HMX)、六硝基六氮杂异伍兹烷(CL-20)之间的相容性。MD模拟结果表明:RDX、HMX、CL-20与SEBS共混体系的引发键最大键长随温度的升高而增加,与单质炸药单组分体系相比均没有明显的变化,推测SEBS与RDX、HMX、CL-20共混后稳定性较好,不易发生引发键的断裂。DSC结果中,RDX、HMX、CL-20与SEBS共混后,热分解温度变化均在3 ℃以内,表明SEBS与RDX、HMX和CL-20之间相容性好。进一步,选择相容性差的二号中定剂(C2)和3,4-二硝基呋咱基氧化呋咱(DNTF)作为对照体系,进行MD模拟和DSC分析发现,引发键最大键长明显增加,DSC热分解温度提前了70 ℃以上,验证了引发键键长预测相容性优劣的可行性。
Abstract:
The compatibility between thermoplastic elastomer hydrogenated styrene-butadiene-styrene block copolymers (SEBS) and single-compound explosives hexogen (RDX), octogen (HMX) and hexanitrohexaazaisowurtzitane (CL-20) commonly used in solid propellants was studied by using theoretical trigger bond length trends in molecular dynamics (MD) simulation and decomposition temperature changes in differential scanning calorimetry (DSC) measurements. The results of MD simulation show that the maximum trigger bond length of RDX, HMX and CL-20 in explosive/SEBS blend systems increases with temperature. Compared to the singlecomponent explosive systems, the maximum trigger bond length changes little after blending with SEBS. It is speculated that RDX, HMX, and CL-20 all have good stability after blending with SEBS and is less prone to cause trigger bond fracture. In DSC results, after blending with SEBS, the thermal decomposition temperature changes of RDX, HMX and CL-20 are less than 3 ℃, indicating that the compatibility of SEBS with RDX, HMX and CL-20 is good. Furthermore, a system of 1, 3-dimethyl-1, 3-diphenylurea (C2) and 3, 4-dinitrofurazanfuroxan (DNTF) with poor compatibility was chosen as the control system for MD simulation and DSC analysis. The maximum trigger bond length significantly increases, and the decomposition temperature in DSC decreases by more than 70 ℃, which verifies the feasibility of predicting the compatibility by using trigger bond length.

参考文献/References:

[1]刘轩, 庞爱民, 洪昕林, 等. 惰性热塑性弹性体在复合固体推进剂中的应用研究进展[J]. 固体火箭技术, 2018, 41(2): 190-196, 202.
LIU X, PANG A M, HONG X L, et al. Research progress on application of inert thermoplastic elastomers in composite solid propellants [J]. Journal of Solid Rocket Technology, 2018, 41(2): 190-196, 202.
[2]李伟, 顾健, 宋琴, 等. 国外热塑性弹性体推进剂研究进展[J]. 化学推进剂与高分子材料, 2015, 13(6): 8-13.
LI W, GU J, SONG Q, et al. Research progress of thermoplastic elastomer propellant abroad [J]. Chemical Propellants & Polymeric Materials, 2015, 13(6): 8-13.
[3]宋秀铎, 曹鹏, 郑伟, 等. BAMO-AMMO黏合剂相对分子质量对推进剂力学性能的影响[J]. 中国胶粘剂, 2017, 26(8): 1-3, 28.
SONG X D, CAO P, ZHENG W, et al. Influences of relative molecular mass of BAMO-AMMO adhesive on mechanical properties of propellants [J]. China Adhesives, 2017, 26(8): 1-3, 28.
[4]唐刚, 罗运军, 李霄羽, 等. 热熔胶基推进剂的流变性能[J]. 火炸药学报, 2022, 45(2): 264-270.
TANG G, LUO Y J, LI X Y, et al. Rheological properties of hot-melt adhesive-based propellant[J]. Chinese Journal of Explosives & Propellants, 2022, 45(2): 264-270.
[5]WILKINSON P J, WEAVER M C, KISTER G, et al. Styrene-ethylene/butylene-styrene (SEBS) block copolymer binder for solid propellants [J]. Propellants, Explosives, Pyrotechnics, 2022, 47(1): 202100142.
[6]周海波, 贾景霞, 汤明珮, 等. 新型热塑性弹性体SEBS[J].辽宁化工, 2016, 45(10): 1327-1330.
ZHOU H B, JIA J X, TANG M P, et al. A new thermoplastic elastomer [J]. Liaoning Chemical Industry, 2016, 45(10): 1327-1330.
[7]SINGH A, RADHAKRISHNAN S, VIJAYALAKSHMI R, et al. Screening of polymer-plasticizer systems for propellant binder applications: an experimental and simulation approach [J]. Journal of Energetic Materials, 2019, 37: 365-377.
[8]YU Z F, WANG W Z, YAO W S, et al. Simulation for the migration of nitrate ester plasticizers in different liners contacting with propellant by molecular dynamics[J]. Journal of Energetic Materials, 2021, 39: 74-84.
[9]王泽清, 余咸旱, 刘威, 等. 聚醋酸乙烯酯与黑索今体系的分子动力学模拟[J]. 爆破器材, 2019, 48(5): 6-11.
WANG Z Q, YU X H, LIU W, et al. Molecular dynamics simulation of PVAc and RDX [J]. Explosive Materials, 2019, 48(5): 6-11.
[10]屈蓓, 唐秋凡, 李吉祯, 等. 分子动力学及热分析方法研究CL-20与推进剂主要组分的相互作用[J]. 固体火箭技术, 2017, 40(4): 476-483.
QU B, TANG Q F, LI J Z, et al. Interaction of CL-20 with solid propellant components by molecular dynamics simulation and thermal analysis method [J]. Journal of Solid Rocket Technology, 2017, 40(4): 476-483.
[11]BERENDSEN H J C, POSTMA J P M, VAN GUNSTEREN W F, et al. Molecular dynamics with coupling to an external bath [J]. Journal of Chemical Physics, 1984, 81(8): 3684-3690.
[12]ANDERSEN H C. Molecular dynamics simulations at constant pressure and/or temperature [J]. The Journal of Chemistry Physics, 1980, 72(4): 2384-2393.
[13]KARASAWA N, GODDARD W A. Force fields, structures, and properties of poly(vinylidene fluoride) crystals [J]. Macromolecules, 1992, 25(26): 7268-7281.
[14]EWALD P P. Die berechnung optischer und elektrostatischer gitterpotentiale [J]. Annalen der Physik, 1921, 369(3): 253-287.
[15]SIMPSON R L, URTIEW P A, ORNELLAS D L, et al. CL-20 performance exceeds that of HMX and its sensitivity is moderate [J]. Propellants, Explosives, Pyrotechnics, 2010, 22(5): 249-255.

备注/Memo

备注/Memo:
收稿日期:2023-11-21
第一作者:杨巍璐(1995—),女,博士,工程师,主要从事固体推进剂的技术研究。E-mail: 942033159@qq.com
通信作者:宋秀铎(1978—),男,博士,研究员,主要从事固体推进剂的技术研究。E-mail: song_xd@126.com
更新日期/Last Update: 2024-07-16