Xu Yuxuan, Chen Guo, Du Fei, Li Ming, Wu Liangfei, Yao Deyuan, Liu Xiaodong, Ding Junfeng, Zeng Zhi, Liu Ruibin, Lin Haiqing, Wang Xianlong
Key Laboratory of Materials Physics, Institute of Solid State Physics, HFIPS, Chinese Academy of Sciences, Hefei 230031, China.
University of Science and Technology of China, Hefei 230026, China.
Sci Adv. 2024 Sep 27;10(39):eadq5299. doi: 10.1126/sciadv.adq5299.
Cubic gauche nitrogen (cg-N) has received wide attention for its exceptionally high energy density and environmental friendliness. However, traditional synthesis methods for cg-N predominantly rely on high-pressure techniques or the utilization of nanoconfined effects using highly toxic and sensitive sodium azide as precursor, which substantially restrict its practical application. On the basis of the first-principles simulations, we found that adsorption of potassium on the cg-N surface exhibits superior stabilization compared to sodium. Then, we chose safer potassium azide as precursor for synthesizing cg-N. Through plasma-enhanced chemical vapor deposition treatment, the free-standing cg-N was successfully synthesized without the need for high-pressure and nanoconfined effects. It demonstrated excellent thermal stability up to 760 K, and then rapid and intense thermal decomposition occurred, exhibiting typical thermal decomposition behaviors of high-energy-density materials. The explosion parameters were also measured using laser-induced plasma spectroscopy. Our work has substantially promoted the practical application of cg-N as HEDMs.
立方 gauche 氮(cg-N)因其极高的能量密度和环境友好性而受到广泛关注。然而,传统的 cg-N 合成方法主要依赖高压技术或使用剧毒且敏感的叠氮化钠作为前驱体利用纳米限域效应,这极大地限制了其实际应用。基于第一性原理模拟,我们发现钾在 cg-N 表面的吸附相比于钠表现出更好的稳定性。然后,我们选择更安全的叠氮化钾作为合成 cg-N 的前驱体。通过等离子体增强化学气相沉积处理,成功合成了无需高压和纳米限域效应的独立式 cg-N。它在高达 760 K 时表现出优异的热稳定性,然后迅速发生剧烈的热分解,呈现出高能密度材料典型的热分解行为。还使用激光诱导等离子体光谱法测量了爆炸参数。我们的工作极大地推动了 cg-N 作为高能密度材料的实际应用。