Quantum scattering study of the abstraction reactions of H atoms from CH3NH2
The abstraction reactions of H atoms from methylamine present two channels. In this work we report quantum chemistry and reduced dimensionality quantum dynamical calculations of the rate constants and the branching ratios (Brs). The calculations give barrier heights of 0.41 (0.38) eV and the reactio...
| Hauptverfasser: | , |
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| Format: | Journal article |
| Sprache: | English |
| Veröffentlicht: |
2007
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