Nuclear-Spin Selection Rules in the Chemistry of Interstellar Nitrogen Hydrides

被引:16
|
作者
Rist, Claire [1 ]
Faure, Alexandre [1 ]
Hily-Blant, Pierre [1 ]
Le Gal, Romane [1 ]
机构
[1] Univ Grenoble 1, Observ Grenoble, CNRS, IPAG,UMR5571, F-38041 Grenoble 09, France
来源
JOURNAL OF PHYSICAL CHEMISTRY A | 2013年 / 117卷 / 39期
关键词
POLYATOMIC-MOLECULES; CROSSED-BEAM; CYCLIC C3H2; RATIO; IONS; D-2;
D O I
10.1021/jp312640a
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Nitrogen hydrides are at the root of the nitrogen chemistry in interstellar space. The detailed modeling of their gas phase formation, however, requires the knowledge of nuclear spin branching ratios for chemical reactions involving multiprotonated species. We investigate in this work the nuclear spin selection rules in both exothermic and near thermoneutral ion-molecule reactions involved in the synthesis of ammonia, assuming full scrambling of protons in the reaction complexes. The formalism of Oka [J. Mol. Spectrosc. 2004, 228, 635] is employed for highly exothermic ion molecule and dissociative recombination reactions. For thermoneutral reaction, a simple state-to-state statistical approach is suggested, which is in qualitative agreement with both quantum scattering and microcanonical statistical:: calculations. This model is applied to the seven atom reaction NH4+ + H-2, of Possible importance in the nuclear spin thermalization of ammonia.
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页码:9800 / 9806
页数:7
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