Journal of the Chemical Society Faraday Transactions · 1994 · 30 citations · 15 references
Natural SciencesPhysicsMolecular PhysicsNuclear PhysicsTheoretical ChemistryAtomic CollisionsInteratomic PotentialsIntermolecular ForcesIntermolecular InteractionsMolecular CollisionsScattering ProcessesAtom-atom CollisionsInelastic CollisionsInelastic ScatteringIntegral Cross SectionInteratomic Potential ModelsMolecular Collision DynamicsMolecular Potential ModelsMolecule-atom Collisions
A multiple hard-ellipsoid model is developed to describe atom–diatom rotationally inelastic collisons. The model is designed to be used for ‘soft’ and anisotropic repulsive intermolecular potentials for which single hard-shape models fail to reproduce the integral cross-sections. It is shown for the Na2–He system that a small number of ellipsoids representing different regions of the repulsive intermolecular potential can be used within a classically impulsive approximation to reproduce the intergral J= 0 →J′ cross-sections. The model facilitates investigation of how different regions of the intermolecular potential contribute to rotationally inelastic scattering processes.
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Rotational transfer, an angular momentum model
Anthony J. McCaffery, Zeyad T. Alwahabi, Mark A. Osborne et al. · The Journal of Chemical Physics · 1993 · 104 citations
Natural Sciences, Chemistry, Physics +12