Dynamics of the simplest chlorine atom reaction: An experimental and theoretical study

M Alagia, N Balucani, L Cartechini, P Casavecchia… - Science, 1996 - science.org
M Alagia, N Balucani, L Cartechini, P Casavecchia, EH Van Kleef, GG Volpi, FJ Aoiz
Science, 1996science.org
Angular distributions and time-of-flight spectra for the reaction Cl+ H2→ HCl+ H obtained
from a high-resolution, crossed-molecular beam experiment were compared to differential
cross sections calculated by both converged quantum mechanical scattering and quasi-
classical trajectory methods. Good agreement was found between the experimental results
and each theoretical prediction. The results demonstrate that excellent agreement can be
obtained between state-of-the-art simulations and experiments for the detailed dynamical …
Angular distributions and time-of-flight spectra for the reaction Cl + H2 → HCl + H obtained from a high-resolution, crossed-molecular beam experiment were compared to differential cross sections calculated by both converged quantum mechanical scattering and quasi-classical trajectory methods. Good agreement was found between the experimental results and each theoretical prediction. The results demonstrate that excellent agreement can be obtained between state-of-the-art simulations and experiments for the detailed dynamical properties of this prototype chlorine atom reaction.
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