Converged quantum dynamics of the cis-PSB3 model reveals coherent oscillations in ground-state cis/trans populations that were missed by earlier, less converged calculations.
S _1 -S _2 conical intersection and ultrafast S _1 S _2 internal conversion in pyrazine
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Quantum Dynamics Predicts Coherent Oscillatory Behavior in the Early-times of a Photoisomerization Reaction
Converged quantum dynamics of the cis-PSB3 model reveals coherent oscillations in ground-state cis/trans populations that were missed by earlier, less converged calculations.