Tunneling in Isotopic Collinear H+H2 Reactions
- 1 June 1971
- journal article
- research article
- Published by AIP Publishing in The Journal of Chemical Physics
- Vol. 54 (11) , 4881-4890
- https://doi.org/10.1063/1.1674766
Abstract
Quantum calculations of the collinear isotopic H+H2 systems are presented. The use of reaction coordinates allows the specific two‐dimensional effects of reaction path curvature and vibrational force constant to be studied. It is shown that both of these effects must be included in order to obtain accurate transmission coefficients at low energies.Keywords
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