Repositorio de Universidad Autónoma de Chile.
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Quantum and quasiclassical trajectory studies of rotational relaxation in Ar-N2 + collisions
The collision of N2 + with Ar is studied using quantum and classical methods. The dynamics was followed on a new potential energy surface based on ab initio energies computed at the UCCSD(T)-F12a/aug-cc-pVTZ level, using the correct analytical long range behaviour and a reproducing kernel representa
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