[QE-users] QE + Wannier90 + problem with spn file
Arena Konta
qe6user at gmail.com
Tue Jan 26 21:02:06 CET 2021
Dear QE Users
I have a problem with spn files. I prepared calculations with various version of QE (6.6, 6.5, 6.2.1) with p2wannier90 and wannier90 (version 3.1). Everything seems to be ok, expect, when I run postwannier90 app I got error:
* Energy bands in eV, coloured by SHC
* Berry curvature-like term for spin Hall conductivity in Ang^2
Reading overlaps from Wannier.mmn in get_AA_R : Created on 26Jan2021 at 17: 3:27
Reading spin matrices from Wannier.spn in get_SS_R : reated on 26Jan2021 at 17: 31: 3
34 1000
0.8621686762
Exiting.......
Error: Problem reading input file Wannier.spn
What can be wrong with this file? I did diffrent calculations using ELK and the same wannier90 library, and everything seems to be also OK.
--
with regards
Arena Konta
The Institute of Thermophysics in Novosibirsk Scientific Center
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