Localization-Delocalization in Bridged Mixed-Valence Metal Clusters: Vibronic PKS Model Revisited.

@article{Palii2015LocalizationDelocalizationIB,
  title={Localization-Delocalization in Bridged Mixed-Valence Metal Clusters: Vibronic PKS Model Revisited.},
  author={Andrew V. Palii and Boris Tsukerblat and Juan Modesto Clemente-Juan and Sergey M Aldoshin},
  journal={The journal of physical chemistry. A},
  year={2015},
  volume={119 38},
  pages={9844-56}
}
Here we describe a new vibronic model of mixed valence (MV) dimer inspired by the conventional Piepho, Krausz, and Schatz (PKS) approach. We attempted to partially lift the main restriction of the PKS model dealing with the vibronically independent moieties of a MV molecule. The refined version of the PKS model in which the bridging ligands are included… CONTINUE READING