Four-dimensional quantum scattering calculations on the H+CH4→H2+CH3 reaction
Author:
Publisher
AIP Publishing
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Link
http://aip.scitation.org/doi/pdf/10.1063/1.479634
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1. Semi‐empirical extrapolation and estimation of rate constants for abstraction of H from methane by H, O, HO, and O2
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2. Ten-dimensional quantum dynamics study of H+CH3D → H2+CH2D reaction;Chinese Journal of Chemical Physics;2022-02
3. Initial state-selected scattering for the reactions H + CH4/CHD3 and F + CHD3 employing ring polymer molecular dynamics;The Journal of Chemical Physics;2022-01-28
4. Beyond the normal mode picture: the importance of the reactant’s intramolecular mode coupling in quasiclassical trajectory simulations;Molecular Physics;2021-06-15
5. Full-dimensional quantum mechanical calculations of the reaction probability of the H + CH4 reaction based on a mixed Jacobi and Radau description;The Journal of Chemical Physics;2020-05-29
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