Minimal-basis Hamiltonian for benzene (IMAGE)

National Centre of Competence in Research (NCCR) MARVEL

Minimal-basis Hamiltonian for benzene

Caption

A minimal-basis Hamiltonian for benzene filled with random numbers (left) and predicted by a symmetry-adapted model after learning on the random target (right). The first two eigenstates of the predicted Hamiltonians in boxes to the right.

Credit

@EPFL, MIchele Ceriotti

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