[gpaw-users] Infrared intensities

[Chithra Asokan]

Hi everyone,

I have been using GPAW to calculate vibrational frequencies of molecules on
surfaces.
I am also interested in calculating the infrared intensities.
I came across the ase Infrared extension for vibrations module using vasp
as the calculator to also calculate intensities here:
https://wiki.fysik.dtu.dk/ase/ase/vibrations/vibrations.html

 However, it looks like the extension only works for calculators that have
the attribute calc.get.dipole_moment, and to the best of my understanding
GPAW does not have the attribute. I was wondering if there is an extension
with similar function in GPAW that I can use to generate IR spectra?

I would greatly appreciate comments/suggestions on this issue.

Thank you,
Chithra
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