MODERN PHYSICS LETTERS B, cilt.24, sa.8, ss.817-824, 2010 (SCI-Expanded)
We study here the temperature dependence of the Raman frequencies for the overtone 2 nu(6) of the librational mode nu(6) in phase III of NH4I. By using the experimental infrared frequencies of the 2 nu(6) mode, we predict the Raman frequencies of this overtone 2 nu(6) mode as a function of temperature at atmospheric pressure in phase III of NH4I. Our calculations indicate that the Raman frequencies of 2 nu(6) exhibit anomalous behavior at around 110 K (P = 0) in phase III of NH4I, as observed experimentally.