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Supplementary Material

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posted on 2024-07-10, 12:08 authored by Patricia Vindel-Zandbergen, Jesus Gonzalez-Vazquez
The supplementary material for this work includes a pdf file containing the active space and molecular orbitals used in our state-average CASSCF calculations, the average kinetic energy and for individual trajectories, the average total energy deviation and for individual trajectories and time dependent ΔI/I signals for the ensamble of trajectories and the different photoproducts.

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    Journal of Chemical Physics

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