[QE-users] problem in running pw2wannier90.x

Soumendra Kumar Das soumendra.batu at gmail.com
Tue Feb 1 06:03:15 CET 2022


Dear QE users,

I am running the wannier canculation for Bi2Se3. I have successfully run
scf, nscf, wannier90.x -pp. But while running pw2wannier90.x I am getting
this error.


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     Error in routine pw2wannier90 (1):
     reading inputpp namelist
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

     stopping ...

Here is my input filr for pw2wan.

&inputpp
  outdir     =  'temp2'
  prefix     =  'Bi2Se3'
  seedname   =  'wannier'
  write_amn  =  .true.
  write_mmn  =  .true.
  write_unk  =  .true.


Please suggest to me what I should do on this. I am using qe-6.5.
-- 
*---------------------------------------*
*Thanks and Regards*
*Soumendra Kumar Das*
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