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C.I. Calculations on the lower transitions in the terphenyl and quaterphenyl di-valent ions
Authors:Irene P Cook  G Jan Hoytink
Institution:1. Department of Chemistry, The University, Sheffield, England
Abstract:Energies and transition dipole moments for the lower electronic transitions in the terphenyl and quaterphenyl di-valent ions have been calculated starting from the Pople SCF MO's for the ground state ions. The configuration interaction included about one-hundred singly and doubly excited configurations. The results of the calculations for the lower allowed electronic transitions are in very satisfactory agreement with the experimental spectra.
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