Example: Vibrational Raman optical activity (VROA): H2O2
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"Download VROA.run"

   #! /bin/sh

   # Example showing a calculation of normal Vibrational Raman Optical Activity (VROA).

   # For accuracy reasons 'NumericalQuality Good' and EXACTDENSITY are used. 

   $AMSBIN/ams <<eor
   System
     atoms
        O        -0.750254   -0.034490    0.015133
        O         0.750254    0.034490    0.015133
        H        -0.943532    0.744006    0.580040
        H         0.943532   -0.744006    0.580040
     end
   end

   Task SinglePoint

   Properties
     VROA True
   End

   Raman
     IncidentFrequency 2.41 [eV]
   End

   NumericalDifferentiation
      Parallel nGroups=1
   End

   Engine ADF
     title VROA TEST H2O2
     
     numericalquality Good
     
     exactdensity
     
     basis
       type TZP
       core None
     end
     
     xc
       gga BLYP
     end
   EndEngine

   eor

   # Note that used basis set is too small to get accurate results. Better is to
   # use larger basis sets for such a small molecule, like one of the even
   # tempered basis sets (for example Type ET/ET-QZ3P-1DIFFUSE), or use augmented
   # basis sets (for example Type AUG/ATZ2P).
