most citedPropagation of sound in a Bose Einstein condensate in an optical lattice

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physics.chem-ph2022

Charge Transfer Simulations using Hamiltonian Elements and Forces from Neural Networks

Philipp M. Dohmen, Mila Krämer, Patrick Reiser +3

The trajectory surface hopping method has been widely used in the simulation of charge transport in organic semiconductors. In the present study, we employ the machine learning (ML…