most citedA coupled-trajectory approach for decoherence, frustrated hops and internal consistency in surface hopping

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physics.chem-ph2024★ 2 cited

A coupled-trajectory approach for decoherence, frustrated hops and internal consistency in surface hopping

Lea M. Ibele, Eduarda Sangiogo Gil, Peter Schürger +2

We address the issues of decoherence, frustrated hops and internal consistency in surface hopping. We demonstrate that moving away from an independent-trajectory picture is the str…