Lattice dynamic investigation of the Raman and infrared wavenumbers of orthorhombic R2BaNiO5 (R = Y,Gd) oxides in Immm structure

A short‐range force constant model has been applied to investigate the Raman and the infrared wavenumbers in R₂BaNiO₅ (R = Y, Gd) in their orthorhombic phase of space group Immm. Calculations of zone‐center phonons are made with seven stretching and four bending force constants. The force constants are evaluated by fitting nine Raman and two infrared modes. Two Raman modes are reassigned on the basis of group theoretical calculations. The calculated Raman and infrared modes show good agreement with the observed values. The infrared values are assigned for the first time in these oxides. Copyright © 2006 John Wiley & Sons, Ltd.