The QCT calculation of the rate constants for the N(4S)+O2(X3Σg−) →NO(X2
✍ Scribed by Jianfeng He; Jing Li
- Publisher
- Springer
- Year
- 2007
- Tongue
- English
- Weight
- 235 KB
- Volume
- 43
- Category
- Article
- ISSN
- 0259-9791
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📜 SIMILAR VOLUMES
Rate constants for the reaction O(3p)+ O3 (IAI) --, 202 (X 32g ) are reported using variational transition state theory. A semi-empirical potential energy surface based on a double many-body expansion method due to Varandas and Pais is used to obtain transition state information. The computed rate c
Previous work by Manaa and Yarkony has characterized the doublet-quartet crossing region for the title reaction. In the present work, the minimum energy pathways for addition of CH(%) to Nz on the doublet surface and for dissociation of HCNN to HCN+N(S) on the quartet surface are characterized using