Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
7605478 | International Journal of Mass Spectrometry | 2013 | 8 Pages |
Abstract
- Accurate coupled-cluster energies are reported for the title reaction.
- The crossing point between quartet and sextet surfaces is located.
- Non-adiabatic statistical rate theory calculations are performed.
- The HH bond splitting transition state is predicted to be rate-limiting.
Related Topics
Physical Sciences and Engineering
Chemistry
Analytical Chemistry
Authors
Jeremy N. Harvey, David P. Tew,