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Phonon mode selection

Posted: Sat Feb 24, 2018 3:52 am
by chrisewolf
Dear all,

I was wondering if it was possible in epw to select a phonon mode (branch index) when calculating the electron-phonon self energy (last equation here: http://epw.org.uk/Documentation/Electron-phononCoupling) in order to distinguish the individual contributions?

I looked through the docs but I am not sure if the "cumulative" method does this:

Code: Select all

Band index for which the cumulant calculation is done.
                   For more than one band, you need to perform multiple calculation and add the results together.


Thanks for your help as always!

Best,
Chris

Re: Phonon mode selection

Posted: Sat Feb 24, 2018 8:46 am
by carla.verdi
Dear Chris,

The cumulant expansion is a method for calculating the spectral function.
If you want to see the contribution of different phonon modes to the e-ph self-energy, you can set verbosity=3.
Beware that this will only follow the phonon mode index, rather than the actual nature of the phonon branch.

Best
Carla

Re: Phonon mode selection

Posted: Sat Feb 24, 2018 12:51 pm
by chrisewolf
Mille grazie Carla, that is exactly what I want!

Best,
Chris