The Journal of Chemical Physics · 1986 · 21 citations · 20 references
Natural SciencesChemistryPhysicsComputational ChemistryMolecular PhysicsTheoretical ChemistryMolecular MechanicsMolecular Quantum MechanicsMolecular VibrationVibrational SpectroscopyBendingClose-coupling CalculationsVibrational Modes
We apply in this paper a model related to the ‘‘infinite order sudden approximation’’ to treat the vibrational predissociation of the HeI2 van der Waals molecule. For each configuration, the stretching motions within the complex are exactly solved in the close-coupling formalism. The bending motion is then considered in an approximate way and averaged predissociation rates are obtained. Our results are compared with the experiment and also with previous models.
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The binding energy of iodine–rare gas van der Waals molecules
Joseph A. Blazy, Benjamin M. DeKoven, Timothy D. Russell et al. · The Journal of Chemical Physics · 1980 · 181 citations