Dear EPW administrators and users,
I would like to compute the real part of the electron self-energy to see its behavior around the Fermi level. I see that it has already been produced using EPW (for example Fig. 5 (a) in https://arxiv.org/pdf/1005.4418.pdf). I find that in src/selfen_elec.f90, the imaginary part is computed but I don't see a straightforward way to output the real part.
I will really appreciate some help. Am I missing something straightforward?
Thanks and regards,
Soham.
Real part of the electron self energy
Moderator: stiwari
Re: Real part of the electron self energy
Dear Soham,
The real part of the electron-phonon self-energy is printed in the output by default (at least in the most recent version of EPW).
The variable in the routine is called "sigmar_all".
Be aware that this contains only the Fan self-energy (no Debye-Waller term) such that ZPM of the bandgap will not be obtained.
Best,
Samuel
The real part of the electron-phonon self-energy is printed in the output by default (at least in the most recent version of EPW).
The variable in the routine is called "sigmar_all".
Be aware that this contains only the Fan self-energy (no Debye-Waller term) such that ZPM of the bandgap will not be obtained.
Best,
Samuel
Prof. Samuel Poncé
Chercheur qualifié F.R.S.-FNRS / Professeur UCLouvain
Institute of Condensed Matter and Nanosciences
UCLouvain, Belgium
Web: https://www.samuelponce.com
Chercheur qualifié F.R.S.-FNRS / Professeur UCLouvain
Institute of Condensed Matter and Nanosciences
UCLouvain, Belgium
Web: https://www.samuelponce.com
Re: Real part of the electron self energy
Dear Samuel,
Thanks. I overlooked it.
Sincerely,
Soham.
Thanks. I overlooked it.
Sincerely,
Soham.