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Quantal transition probabilities from classical trajectories: Application to the collinear reactive H + Cl2 system

✍ Scribed by U. Halavee; R.D. Levine


Publisher
Elsevier Science
Year
1977
Tongue
English
Weight
626 KB
Volume
46
Category
Article
ISSN
0009-2614

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✦ Synopsis


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 reaction and with the experimental recults for the H i-F2 reaction.