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- W2088895789 abstract "Abstract Monte Carlo quasiclassical trajectory calculations have been carried out for the reaction Cl + Hl → HCl + I for 300, 1000, and 2000 K. A semi-empirical potential-energy surface (London equation) was obtained by “transfering” parameters from surfaces computed for other reaction systems. The computed results are in general accord with experimental measurements. Thermal rate coefficients, differential scattering cross sections, and product vibrational and rotational distributions were computed for the three temperatures. Angular scattering distributions are in agreement with experiment only at elevated temperatures." @default.
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- W2088895789 date "1976-12-01" @default.
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- W2088895789 title "Quasiclassical trajectory study of the Cl + Hl → HCl + I reaction" @default.
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- W2088895789 doi "https://doi.org/10.1016/0009-2614(76)80703-8" @default.
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