Stabilization of small nitrogen clusters via spatial constraint

被引:3
|
作者
Gimaldinova, M. A. [1 ,2 ]
Zemenkov, L., I [1 ]
Merinov, V. A. [1 ]
机构
[1] Natl Res Nucl Univ MEPhI, Moscow Engn Phys Inst, Kashirskoe Shosse 31, Moscow 115409, Russia
[2] Res Inst Dev Sci & Educ Potential Youth, Aviatorov Str 14-55, Moscow 119620, Russia
关键词
THERMAL-STABILITY; HIGH-ENERGY; SIMULATION; STATE; N-10;
D O I
10.1088/1742-6596/1435/1/012062
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
We apply density functional theory to calculate activation barriers for dissociations of small all-nitrogen clusters N-4 and N-6. The effect of external spatial constraint was also considered. We found that spatial constraint results in significant stabilization of both regarded clusters. So, the spatial constraint can be considered as an efficient method for stabilization of high-energy nitrogen structures.
引用
收藏
页数:4
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