Search found 2 matches

by salahs_2002
Fri Jun 01, 2018 8:29 am
Forum: Ground state
Topic: electron phonon coupling supercell
Replies: 3
Views: 3108

Re: electron phonon coupling supercell

Dear Matthieu Verstraete

Thanks for your reply, your notes were very useful. thank you very much.
can you please give me more details about the fist note.
I am still beginner in the field.


Thanks
by salahs_2002
Fri May 25, 2018 9:57 am
Forum: Ground state
Topic: electron phonon coupling supercell
Replies: 3
Views: 3108

electron phonon coupling supercell

Dear all I am trying to calculate electron phonon coupling constant for Al, like in the tutorial. I got it right for unit cell 0.44 but when I tried super cell 2*2*2 the constant is 0.205 I think the issue is in qpath in anaddb input file for the unit cell the qpath was nqpath 7 qpath 0.0 0.0 0.0 1/...