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Model calculation of local versus hyperspherical mode selective dissociation of H2O
Institution:1. College of Physics and Material Science, Henan Normal University, Xinxiang 453007, China;2. College of Physics and Electronic Engineering, Xinyang Normal University, Xinyang 464000, China;1. Department of Chemistry, University of the Free State, PO BOX 339, Bloemfontein, 9300, South Africa;2. Department of Physics, Faculty of Science, University of Maroua, PO BOX 46, Maroua, Cameroon
Abstract:Hyperspherical H2O* resonances excited to energies ?1 eV above the electronic ground state H2O* → H + OH dissociation threshold have lifetimes ≈ 45 ps, at least ten times longer than near-degenerate local H2O* resonances. The results are evaluated and analysed using fast-Fourier-transform (FFT) propagation of quantum wavefunctions representing H2O stretching vibrations modeled by coupled Morse oscillators.
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