Quantum-mechanical calculations on termolecular association reactions XY+Z+M -> XYZ+M: Application to ozone formation
Quantum mechanical (QM) treatment of three-body association reactions XY+Z+M→XYZ+M, which involved the formation of a long-lived complex was presented. The method was implemented to assess quantum isotopic effects on ozone formation through the deactivation scheme, and performed rate constant calcul...
| Principais autores: | , |
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| Formato: | Journal article |
| Idioma: | English |
| Publicado em: |
2002
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