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Excitation Energies in a Polarizable Environment: A Comparison of State-Averaged and Linear-Response CASSCF/AMOEBA Formulations

Tommaso Nottoli, Lorenzo Lapi, Giacomo Londi, Filippo Lipparini, Benedetta Mennucci

2026, 2(1): 10. doi: 10.53941/ps.2026.100010

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