Quantum chemical calculation of the barrier for tunneling of hydrogen in hydrogen abstraction from methane by methyl
- 20 January 1992
- journal article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 41 (2) , 371-379
- https://doi.org/10.1002/qua.560410211
Abstract
No abstract availableKeywords
This publication has 36 references indexed in Scilit:
- Activation barriers in the .alpha.-cleavage processes of acetaldehydeThe Journal of Physical Chemistry, 1987
- Hydrogen transfer in double minimum potential: Kinetic properties derived from quantum dynamicsThe Journal of Chemical Physics, 1987
- Theoretical analysis of kinetic isotope effects. Deuterium isotope effects in the reaction of methyl with methaneThe Journal of Physical Chemistry, 1984
- Hydrogen abstraction by methyl radicals in glassesFaraday Discussions of the Chemical Society, 1984
- Tunneling and the temperature dependence of hydrogen transfer reactionsThe Journal of Physical Chemistry, 1983
- Novel radical anions and hydrogen atom tunneling in the solid stateAccounts of Chemical Research, 1982
- Activation energies from bond energies. A modificationJournal of the American Chemical Society, 1977
- Symmetry and tunneling in proton transfer reactions. Proton exchange between methyloxonium ion and methyl alcohol, methyl alcohol and methoxide ion, hydronium ion and water, and water and hydroxyl ionJournal of the American Chemical Society, 1977
- Ground states of .sigma.-bonded molecules. IX. MINDO [modified intermediate neglect of differential overlap]/2 methodJournal of the American Chemical Society, 1970
- Permeability of one-dimensional potential barriersTransactions of the Faraday Society, 1970