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Nonadiabatic Dynamics Algorithms with Only Potential Energies and Gradients: Curvature-Driven Coherent Switching with Decay of Mixing and Curvature-Driven Trajectory Surface Hopping

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Description scientific article published on 01 February 2022
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author: Yinan Shu  Linyao Zhang  Donald Truhlar  Shaozeng Sun 

Publication date February 1, 2022
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