[1] BOLTON O, SIMKE L R, PAGORIA P F, et al. High power explosive with good sensitivity: a 2∶1 cocrystal of CL-20:HMX[J]. Crystal Growth & Design, 2012, 12(9): 4311-4314. [2] LIU K, ZHANG G, LUAN J Y, et al. Crystal structure, spectrum character and explosive property of a new cocrystal CL-20/DNT[J]. Journal of Molecular Structure, 2016, 1110: 91-96. [3] 侯聪花, 刘志强, 张园萍, 等. TATB/HMX共晶炸药的制备及性能研究[J]. 火炸药学报, 2017, 40(4): 44-49. HOU C H, LIU Z Q, ZHANG Y P, et al. Study on preparation and properties of TATB/HMX cocrystal explosive[J]. Chinese Journal of Explosives & Propellants, 2017, 40(4): 44-49. (in Chinese) [4] GAO H, DU P, KE X, et al. A novel method to prepare nano-sized CL-20/NQ cocrystal: vacuum freeze drying[J]. Propellants, Explosives, Pyrotechnics, 2017, 42(8): 889-895. [5] LIN H, ZHU S G, ZHANG L, et al. Intermolecular interactions, thermodynamic properties, crystal structure, and detonation performance of HMX/NTO cocrystal explosive[J]. International Journal of Quantum Chemistry, 2013, 113(10): 1591-1599. [6] ZHOU T T, HUANG F L. Effects of defects on thermal decomposition of HMX via ReaxFF molecular dynamics si- mulations [J]. The Journal of Physical Chemistry B, 2011, 115(2): 278-287. [7] 陈科全, 蓝林钢, 路中华, 等. 含预制缺陷PBX炸药裂纹扩展过程的试验研究[J]. 兵器装备工程学报, 2017, 38(1): 134-136. CHEN K Q, LAN L G, LU Z H, et al. Experimental study on the crack growth of polymer bonded explosives with prefabricated defects[J]. Journal of Ordnance Equipment Engineering, 2017, 38(1): 134-136. (in Chinese) [8] 王洪波, 王旗华, 卢永刚, 等. PBX炸药细观孔洞缺陷对其冲击点火特性的影响[J]. 火炸药学报, 2015, 38(5): 31-36. WANG H B, WANG Q H, LU Y G, et al. Effect of meso-defect holes on the shock-to-ignition characteristics of PBX explosives[J]. Chinese Journal of Explosives & Propellants, 2015, 38(5): 31-36. (in Chinese) [9] XUE X G, WEN Y S, LONG X P, et al. Influence of dislocations on the shock sensitivity of RDX: molecular dynamics simulations by reactive force field[J]. The Journal of Physical Chemistry C, 2015, 119(24): 13735-13742.
[10] 吕鹏博, 王伟力, 刘晓夏, 等. 含装药缺陷的侵爆战斗部穿甲过程装药安定性的数值模拟[J]. 海军航空工程学院学报, 2017, 32(4): 389-394. LYU P B, WANG W L, LIU X X, et al. Numerical simulation of the stability of the charge of invasion of explosive warheads containing defects in armor-piercing process[J]. Journal of Naval Aeronautical and Astronautical University, 2017, 32(4): 389-394. (in Chinese) [11] SUN H, REN P, FRIED J R. The COMPASS force field: para- meterization and validation for polyphosphazenes[J]. Computational and Theoretical Polymer Science, 1998, 8(1/2): 229-246. [12] SUN H. COMPASS: an ab initio force-field optimized for condensed-phase applications-overview with details on alkane and benzene compound[J]. The Journal of Physical Chemistry B, 1998, 102(38): 7338-7364. [13] ANDERSEN H C. Molecular dynamics simulations at constant pressure and/or temperature[J]. Journal of Chemical Physics, 1980, 72(4): 2384-2393. [14] PARRINELLO M, RAHMAN A. Polymorphic transitions in single crystals: a new molecular dynamics method[J]. Journal of Applied Physics, 1981, 52(12): 7182-7190. [15] BOWDEN F P, YOFFE A D. Initiation and growth of explosion in liquids and solids[M]. Cambridge, UK: Cambridge University Press, 1952. [16] KAMLET M J, ADOIPH H G. The relationship of impact sensitivity with structure of organic high explosives[J]. Propellants, Explosives, Pyrotechnics, 1979, 4(2): 30-34. [17] 朱伟, 刘冬梅, 肖继军, 等. 多组分高能复合体系的感度判别、热膨胀和力学性能的MD研究[J]. 含能材料, 2014, 22(5): 582-587. ZHU W, LIU D M, XIAO J J, et al. Molecular dynamics study on sensitivity criterion, thermal expansion and mechanical properties of multi-component high energy system[J]. Chinese Journal of Energetic Materials, 2014, 22(5): 582-587. (in Chinese) [18] 刘强, 肖继军, 张将, 等. CL-20/TNT共晶炸药的分子动力学研究[J]. 高等学校化学学报, 2016, 37(3): 559-566. LIU Q, XIAO J J, ZHANG J, et al. Molecular dynamics simulation on CL-20/TNT cocrystal explosive[J]. Chemical Journal of Chinese Universities, 2016, 37(3): 559-566. (in Chinese) [19] SUN T, XIAO J J, LIU Q, et al. Comparative study on structure, energetic and mechanical properties of a ε-CL-20/HMX cocrystal and its composite with molecular dynamics simulation[J]. Journal of Materials Chemistry A, 2014, 2(34): 13898-13904. [20] XIAO J J, ZHAO L, ZHU W, et al. Molecular dynamics study on the relationships of modeling, structural and energy properties with sensitivity for RDX-based PBXs[J]. Science China Chemistry, 2012, 55(12): 2587-2594. [21] ZHU W, WANG X J, XIAO J J, et al. Molecular dynamics si-mulations of AP/HMX composite with a modified force field[J]. Journal of Hazardous Materials, 2009, 167(1): 810-816. [22] MULLAY J. Relationship between impact sensitivity and molecular electronic structure[J]. Propellants, Explosives, Pyrotechnics, 1987, 12(4): 121-124. [23] BRILL B T, JAMES J K. Kinetics and mechanisms of thermal decomposition of nitroaromatic explosives[J]. Chemical Reviews, 1993, 93(8): 2667-2692. [24] 彭亚晶, 蒋艳雪. 分子空位缺陷对环三亚甲基三硝胺含能材料几何结构、电子结构及振动特性的影响[J]. 物理学报, 2015, 64(24): 243102-1-243102-9. PENG Y J, JIANG Y X. Analyses of the influences of molecular vacancy defect on the geometrical structure, electronic structure, and vibration characteristics of hexogeon energetic material[J]. Acta Physica Sinica, 2015, 64(24): 243102-1-243102-9. (in Chinese) [25] DUAN X H, LI W P, PEI C H, et al. Molecular dynamics simulations of void defects in the energetic material HMX[J]. Journal of Molecular Modeling, 2013, 19(9): 3893-3899. [26] 国迂贤, 张厚生. 炸药爆轰性质计算的氮当量公式及修正氮当量公式:炸药爆速的计算[J]. 爆炸与冲击, 1983, 3(3): 56-66. GUO Y X, ZHANG H S. Nitrogen equivalent (NE) and modified nitrogen equivalent (MNE) equations for predicting detonation parameters of explosives- prediction of detonation velocity of explosives[J]. Explosion and Shock Waves, 1983, 3(3): 56-66. (in Chinese) [27] 吴家龙. 弹性力学[M]. 上海:同济大学出版社, 1993. WU J L. Mechanics of elasticity[M]. Shanghai: Tongji University Press, 1993. (in Chinese) [28] WEINER J H. Statistical mechanics of elasticity[M]. New York, NY, US: John Wiley & Sons, 1983.
第40卷第1期 2019 年1月兵工学报ACTA ARMAMENTARIIVol.40No.1Jan.2019
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