Stability of high-energy N14H4(2+) ion and the effects of carbon and halogen substitution.
Stability of high-energy N14H4(2+) ion and the effects of carbon and halogen substitution.
复制标题
高能N14H4(2)离子的稳定性以及碳和卤素取代的影响。
DOI：
10.1021/jp0620318
复制
发表时间：
2006
期刊：
影响因子：
--
通讯作者：
Strout,DouglasL
中科院分区：
文献类型：
--
作者：
Cottrell,Roshawnda;Jones,Jacqueline;Gilchrist,Ami;Shields,Danielle;Strout,DouglasL
Previous studies of oxygen addition into an N12cage framework revealed the possibility of stable high-energy density materials (HEDM) resulting from such additions. In the current study, nitrogen addition into N12is studied as a means of generating stable HEDM. Nitrogen addition into N12is shown to yield an N14H42+ion, which is examined by theoretical calculations to determine its stability with respect to dissociation. Other variations on this ion are generated by substituting carbon for nitrogen and/or halogens for hydrogen. The cage structures will be compared with respect to stability, and factors that enhance stability will be discussed.
