Abstract
The quasiclassical trajectory method with Monte Carlo and importance sampling and with the Tolman interpretation of the activation energy has been used to calculate the activation energy for a bimolecular reaction at three temperatures in the range 444-2400 K. The activation energy is found to increase by 6 kcal/mol over this range.
| Original language | English (US) |
|---|---|
| Pages (from-to) | 1094-1096 |
| Number of pages | 3 |
| Journal | Journal of physical chemistry |
| Volume | 85 |
| Issue number | 9 |
| DOIs | |
| State | Published - 1981 |
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