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从气体产物的角度研究 TKX-50 和 HMX 特定动能差异的理解。

A study on the comprehension of differences in specific kinetic energy of TKX-50 and HMX from the perspective of gas products.

机构信息

Institute of Chemical Materials, China Academy of Engineering Physics (CAEP), P. O. Box 919-327, Mianyang, Sichuan 621900, People's Republic of China.

出版信息

Phys Chem Chem Phys. 2019 Mar 28;21(12):6600-6605. doi: 10.1039/c8cp07487a. Epub 2019 Mar 11.

Abstract

5,5'-Bitetrazole-1,1'-dioxydihydroxylamine salt (TKX-50), a high-energy energetic material, possesses good safety and energy properties. The energy characteristic data of TKX-50 are commonly generated via theoretical simulation and experimental measurements. Interestingly, the detonation velocity of TKX-50 is higher than HMX, but the specific kinetic energy of TKX-50 is the opposite. Thus, a systematic study on the decomposition mechanism of TKX-50 is important to establish the reasons for this variation in specific kinetic energy. Although the thermal decomposition mechanism of TKX-50 has been reported, the specific compositional changes of its gas products under different heating conditions remain unknown, hindering a comprehensive understanding of the mechanism from the perspective of gas products. Herein, the gas products of TKX-50 and HMX in thermal decomposition and thermal explosion are investigated and compared. It was found that more TKX-50 is converted to ABTOX for further decomposition when the heating rate increases. ABTOX can decompose to CN, which is prone to polymerization, generating a solid residue under high temperature and pressure. Although polymerized CN decomposes and burns during the explosion, it delays the time of TKX-50 reaching its maximum amount of outgassing, thereby affecting its specific kinetic energy. Furthermore, in the thermal explosion, compared with HMX, TKX-50 generates less H and CO. Since the combustion heat of hydrogen is much higher than that of carbon, the more hydrogen generated, the higher the detonation heat obtained. Therefore, TKX-50 has a lower detonation heat, which also affects its specific kinetic energy.

摘要

5,5'-双四唑-1,1'-二氧化物羟胺盐(TKX-50)是一种高能含能材料,具有良好的安全性和能量特性。TKX-50 的能量特性数据通常通过理论模拟和实验测量得到。有趣的是,TKX-50 的爆速高于 HMX,但 TKX-50 的比动能却相反。因此,对 TKX-50 的分解机制进行系统研究对于确定比动能变化的原因非常重要。尽管已经报道了 TKX-50 的热分解机制,但在不同加热条件下其气体产物的具体组成变化仍不清楚,这阻碍了从气体产物的角度对其机制进行全面理解。在此,研究并比较了 TKX-50 和 HMX 在热分解和热爆炸中的气体产物。结果发现,随着加热速率的增加,更多的 TKX-50 转化为 ABTOX 以进一步分解。ABTOX 可以分解为 CN,CN 容易聚合,在高温高压下生成固体残留物。虽然聚合的 CN 在爆炸过程中分解和燃烧,但它延迟了 TKX-50 达到最大出气量的时间,从而影响了其比动能。此外,在热爆炸中,与 HMX 相比,TKX-50 生成的 H 和 CO 较少。由于氢的燃烧热远高于碳,生成的氢越多,获得的爆轰热就越高。因此,TKX-50 的爆轰热较低,这也影响了其比动能。

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