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Compare vibrational frequencies for two calculations for O3- (Ozone anion)


A = HF/6-31G*
B = MP2/6-31G*

scale factors=0.8985, 0.943
  symmetry   frequency (cm-1)   reduced mass (amu)   IR Intensity (km mol-1)   Raman Activity (Å4/u)
mode number A B   A B diff. ratio   A B diff. ratio   A B diff. ratio   A B diff. ratio
1 A1 A1   1097 1290 -193.0 0.850   15.995 15.995 0.000 1.000   2.14 5.85 -3.70 0.366          
2 A1 A1   599 630 -31.0 0.951   15.995 15.995 0.000 1.000   8.69 7.53 1.16 1.154          
3 B2 B2   832i 149 -981.0 -5.581   15.995 15.995 0.000 1.000   3110.40 13247.90 -10137.50 0.235          
scaled by     0.8985 0.943
19 08 20 15 07

See section III.C.1 List or set vibrational scaling factors to change the scale factors used here.
See section III.C.2 Calculate a vibrational scaling factor for a given set of molecules to determine the least squares best scaling factor.