High-Pressure Vibrational Spectroscopy of Hexahydro-1,3,5-Trinitro-1,3,5-Triazine (RDX)

被引:8
|
作者
Zheng, Xianxu [1 ]
Zhao, Jun [1 ]
Tan, Duowang [1 ]
Liu, Cangli [1 ]
Song, Yunfei [2 ]
Yang, Yanqiang [2 ]
机构
[1] China Acad Engn Phys, Natl Key Lab Shock Wave & Detonat Phys, Inst Fluid Phys, Mianyang 621900, Sichuan, Peoples R China
[2] Harbin Inst Technol, Ctr Condensed Matter Sci & Technol, Dept Phys, Harbin 150001, Peoples R China
基金
美国国家科学基金会;
关键词
Condensed Matter; High Pressure; Raman Spectra; WAVE INDUCED DECOMPOSITION; ENERGETIC MATERIALS; RAMAN-SPECTROSCOPY; SINGLE-CRYSTALS; AB-INITIO; THERMAL-DECOMPOSITION; PHASE; PENTAERYTHRITOL; TIME; HMX;
D O I
10.1002/prep.200900081
中图分类号
O69 [应用化学];
学科分类号
081704 ;
摘要
The molecular-level response of RDX to hydrostatic compression was examined in a diamond anvil cell using Raman spectroscopy. The pressure-induced alterations in spectral profiles of the C-N stretching mode (886 cm(-1)) were studied up to 8.3 GPa. At pressures near 4.4 GPa, several changes of the C-N stretching mode become immediately apparent in Raman spectrum, such as large frequency shifts, line broadening, mode splitting, and intensity changes, which are associated with the alpha-gamma phase transition and rearrangement between the RDX molecules. The high pressure Raman spectra changes of the C-N stretching mode are indicative of an alpha-gamma phase transition, and also suggest the lowering of molecular symmetry and crystal symmetry, which are expected to provide some insight into RDX molecular stability and decomposition.
引用
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页码:22 / 27
页数:6
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