The case for a reactive resonance in F+H2

被引:49
作者
Chao, SD [1 ]
Skodje, RT [1 ]
机构
[1] Univ Colorado, Dept Chem, Boulder, CO 80309 USA
关键词
D O I
10.1063/1.1289526
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
We have investigated the F+H-2 reaction on the Stark-Werner potential energy surface using quantum scattering theory, adiabatic theory, and spectral quantization. Clear evidence is found for a transition state resonance on this potential surface. Comparison to experimental results suggests that a resonance is also present in the true reaction. (C) 2000 American Institute of Physics. [S0021-9606(00)01633-0].
引用
收藏
页码:3487 / 3491
页数:5
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