Abstract

Various quantum mechanical scattering methods for performing calculations on the vibrational and rotational energy transfer in three dimensional collisions involving polyatomic molecules are described. Furthermore, calculations of the lifetimes for the vibrational and rotational predissociation in van der Waals molecules are also discussed. Examples of computations include rotational excitation in Ne+HF and He+CH3CN, vibrational excitation in collisions of rare gases with N2, CO2, C2O2H2 and para-difluorobenzene(pDFB), rotational predissociation and bound states in Ne-HF and Ne-HCl and vibrational predissociation in rare gas-C2H4, [ C2H4]2 and Ar-pDFB complexes.

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