Dear Experts,
I am new to EPW code.
I am trying to plot mode resolved EPC distribution in the Brillouin zone like in the attached figure. What input settings should I provide and In which file these data are written?
Mode resolved EPC
Moderator: stiwari
Mode resolved EPC
- Attachments
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- numbers correspond to different phonon modes
- 1.png (101.1 KiB) Viewed 3575 times
Re: Mode resolved EPC
Hi mkmr484,
I think in the beginning, working through some tutorials would really help understanding the input/output file/format. For example, https://epwdoc.gitlab.io/source/doc/MgB2.html will help you.
Best,
Hari
I think in the beginning, working through some tutorials would really help understanding the input/output file/format. For example, https://epwdoc.gitlab.io/source/doc/MgB2.html will help you.
Best,
Hari
Re: Mode resolved EPC
Hi mkmr484,
Thank you for following my work. I calculate it directly with matdyn.x without EPW. Of course, EPW can also do it if you really understand the input/output file/format.
With matdyn.x, you can get γqν at indicated q points and calculate λqν accorrding to Eqn. 1 (in PRB 2022, 105, 245420). After this, you could plot data with Octave or matlab...
Best,
pfliu