[QE-users] Error reading charge-density file when running pw2wannier90.x
Valentin VASSILEV GALINDO
valentin.vassilev at uni.lu
Thu Feb 2 09:03:43 CET 2023
Dear QE community,
I would like to start using QE with wannier90. For this, I started running the examples available within the wannier90 code but I always get the following error:
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
task # 0
from read_rhog : error # 1
error reading file ./cnt.save/charge-density
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
I have tried with examples 13 and 15, using the inputs as they are given with no changes from my side. I'm using QE 6.8.
As explained in the documentation, I run first the .scf input and the .nscf input of QE's pw.x. After that, I run wannier90.x as post-processing tool to generate the .nnkp file. Then, it is when I run pw2wannier90.x and get the aforementioned error.
I will be very thankful for any help you can provide.
Best regards,
Valentin Vassilev Galindo
----------------------------------------
Dr. Valentin Vassilev Galindo
Research Associate
Bio/Chemo/Mechanics of Materials
IMDEA Materials Institute
Calle Eric Kandel 2
28906, Getafe, Madrid (Spain)
valentin.vassilev at imdea.org<mailto:valentin.vassilev at imdea.org> | https://materials.imdea.org<https://materials.imdea.org/> | https://materials.imdea.org/groups/bcmom/
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20230202/a16b9e53/attachment.html>
More information about the users
mailing list