引用本文:
谢洪平, 蒋刚, 张静, 吕利刚, 朱正和. H+CN体系中平行络合反应的动力学[J]. 物理化学学报,
1999, 15(06): 573-576.
doi:
10.3866/PKU.WHXB19990618
Citation: Xie Hong-Ping, Jiang Gang, Zhang Jing, Lv Li-Gang, Zhu Zheng-He. Molecular Reaction Dynamics for Parallel Complex Reactions in H+CN System[J]. Acta Physico-Chimica Sinica, 1999, 15(06): 573-576. doi: 10.3866/PKU.WHXB19990618
Citation: Xie Hong-Ping, Jiang Gang, Zhang Jing, Lv Li-Gang, Zhu Zheng-He. Molecular Reaction Dynamics for Parallel Complex Reactions in H+CN System[J]. Acta Physico-Chimica Sinica, 1999, 15(06): 573-576. doi: 10.3866/PKU.WHXB19990618
English
Molecular Reaction Dynamics for Parallel Complex Reactions in H+CN System
Abstract:
The parallel complex reactions of H(2Sg) + CN(X2Σ+; V=0, 1; J=0)→HCN (X1 ∑+) and HNC(X1∑+ ) have been studied by using classical trajectory method. The results show that the two reactions all have not threshold energies. When the vibration state V= 0 for CN (X2∑+ ), there is not main superior product in HCN and HNC. When V=1 for CN(X2 ∑+),HCN is the more superior product. However, it has been discovered that Herschbach rule and the angular momentum rule can been all used in the reaction system, but their using ranges change with initially relative translational energies and vibration states for the reactant CN(X2 ∑+).
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Key words:
-
Molecular renction dynamics
- / Parallel complex reaction
- / Classical trajectory method
- / HCN
- / HNC
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