Time-dependent study of collinear H-+H2(v) collisions

被引:15
作者
Aguillon, F [1 ]
Belyaev, AK [1 ]
Sidis, V [1 ]
Sizun, M [1 ]
机构
[1] Univ Paris 11, Collis Atom & Mol Lab, UMR 8625, Bat 351, F-91405 Orsay, France
关键词
D O I
10.1039/b003275l
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
It has recently been shown [A. K. Belyaev and A. S. Tiukanov, Chem. Phys. Lett., 1999, 302, 65] that the electron detachment process occurring during the reactive or inelastic H-+H-2 encounter preferentially takes place from the first excited state of H-3(-). The present paper investigates the possibility of this process occurring at a relatively low collision energy (E-coll< 2.5 eV) by tunnelling through that first excited electronic state. We use a two-state coupled wavepacket approach restricted to the collinear geometry, where the detachment probability is accounted for by a negative imaginary potential. The calculation is carried out using both the adiabatic representation and a diabatic representation. It is shown that the tunnelling effects efficiently populate the electron detachment channel even in energy domains where the first excited H-3(-) state is energetically closed.
引用
收藏
页码:3577 / 3582
页数:6
相关论文
共 18 条