Quantum state to state reactive probabilities: The H(D) + Cl2(v) → H(D)Cl(v′) + Cl reactions
✍ Scribed by J.M. Alvariño; A. Lagana′
- Book ID
- 119115930
- Publisher
- Elsevier Science
- Year
- 1983
- Tongue
- English
- Weight
- 178 KB
- Volume
- 93
- Category
- Article
- ISSN
- 0166-1280
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📜 SIMILAR VOLUMES
The state-to-state cross sections for D+ H2( u= j= I ) -HD( u' + 1, j' = 0-13 ) +H at total energy I .8 164 eV have been calculated by accurate quantum dynamics, using larger basis sets and more stringent convergence criteria than in previous work. The cross sections differ from previous calculation
Moments of the classicaliy computed distrïbution of products vibrational energy are employed to generate a discrete vibrational state distrlbution. The built-in convergente criterion of the method isdiscussed and demonstrated. Comparison is made with the quantal results for the collinear H + Cl2 rea