A crossing seam blocks the singlet fission channel in H4 due to electronic quantum geometry, as shown by exact nonadiabatic quantum dynamics simulations.
Making Peace with Random Phases: Ab Initio Conical Intersection Quantum Dynamics in Random Gauges.The Journal of Physical Chemistry Letters2024,15, 8487–8493
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Crossing Seam Blockade
A crossing seam blocks the singlet fission channel in H4 due to electronic quantum geometry, as shown by exact nonadiabatic quantum dynamics simulations.