Tully’s Surface hopping (SH) method has become very popular for the study of non-adiabatic dynamics in the excited states.In this talk, I will showcase several applications of SH in the area of photochemistry considering two mechanisms in the excited states: photo-dissociation and proton transfer. Practical aspects of these simulations and their implementation in the Newton-X platform will be discussed with particular focus on the appropriate selection of the electronic structure method.
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