Search found 4 matches

by mahdi109
Mon Apr 08, 2019 12:56 pm
Forum: Running the code
Topic: Wannierization error in superconducting calculations
Replies: 1
Views: 5404

Wannierization error in superconducting calculations

Dear all, I have tried the EPW examples (superconducting properties of fcc Pb and MgB2). I am trying to calculate the superconducting gaps of Borophene sheet (2D) Now. At the first step I met following error after runing the epw.x : from epw_setup : error # 1 coarse k-mesh needs to be strictly ...
by mahdi109
Sun Apr 07, 2019 11:12 am
Forum: Running the code
Topic: error in running pp.py
Replies: 5
Views: 5575

Re: error in running pp.py

Thank you very much.
by mahdi109
Mon Apr 01, 2019 10:51 pm
Forum: Running the code
Topic: error in running pp.py
Replies: 5
Views: 5575

Re: error in running pp.py

?Dear Samuel, Thank you so much. It worked. But I am still having problems with "epw_super" (MgB2) example. when I run pp.py, I get the following error: cp: cannot stat MgB2.fc: No such file or directory as I know, MgB2.fc is the result of q2r.x, So, should I perform q2r calculation for this example ...
by mahdi109
Sat Mar 16, 2019 8:59 pm
Forum: Running the code
Topic: error in running pp.py
Replies: 5
Views: 5575

error in running pp.py

Dear all, I am trying to calculate the superconducting properties of fcc Pb by solving the isotropic Migdal-Eliashberg equations. This is the error which I face when I run pp.py. python pp.py File "pp.py", line 17 print '{0}.dyn{1} to {0}.dyn_q{1}.xml'.format(prefix,idyn) ^ SyntaxError: invalid ...