Molecular cluster models with periodic boundary conditions (periodic cluster models) are shown to be able to explain the electronic and vibronic excitations of the optical spectra of half-filled charge transfer crystals also as a function of their dimerization.
Periodic Cluster-models As A Tool To Understand the Optical-properties of Half-filled Charge-transfer Crystals
MENEGHETTI, MORENO;PECILE, CESARE
1991
Abstract
Molecular cluster models with periodic boundary conditions (periodic cluster models) are shown to be able to explain the electronic and vibronic excitations of the optical spectra of half-filled charge transfer crystals also as a function of their dimerization.
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