[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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