[QE-users] Raman Spectra with hybrid functional

Sandeep KUMAR sandeepk.phy at gmail.com
Tue Jul 21 18:05:39 CEST 2020


Dear QE users,
I have calculated Raman and IR spectra for ZnO and CO2,  examples provided
by QE and I think QE works well for semi-local functionals but I am
wondering about the hybrid functionals for Raman spectra. Is it implemented
in QE? Can someone let me know about it?

Thanks and regards

Sandeep


-- 
Dr. Sandeep Kumar (Postdoctoral Research Fellow)
Physics and Materials Science Research Unit
University of Luxembourg
162a, avenue de la Faïencerie
L-1511 Luxembourg
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