Hello,
what are the frequency units in the netcdf files ndb.elph_gkkp_fragment?
Cheers,
Alejandro.
Units frequency. Electron phonon coupling
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amolina
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Units frequency. Electron phonon coupling
Alejandro Molina-Sánchez
Institute of Materials Science (ICMUV)
University of Valencia, Spain
Institute of Materials Science (ICMUV)
University of Valencia, Spain
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Davide Sangalli
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Re: Units frequency. Electron phonon coupling
Dear Alejandro,
yambo uses Hartree for energies.
In the 'gkkp_expanded' in particular the variable 'ph_freqs_sq', that is the square of the phonon energy, should be in Hartree^2.
Best regards,
Davide
yambo uses Hartree for energies.
In the 'gkkp_expanded' in particular the variable 'ph_freqs_sq', that is the square of the phonon energy, should be in Hartree^2.
Best regards,
Davide
Davide Sangalli, PhD
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/
CNR-ISM, Division of Ultrafast Processes in Materials (FLASHit) and MaX Centre
https://sites.google.com/view/davidesangalli
http://www.max-centre.eu/