[QE-users] band_structure_calculation
Amin Mirzai
amin.mirzai at mek.lth.se
Mon Mar 5 15:47:42 CET 2018
Dear QE users,
Does anybody have any idea regarding following error:
%%%%%%%%%%%%%
Error in routine bands (1):
reading bands namelist
%%%%%%%%%%%%%%
This error occurs while I try to plot band structure of the chosen material. All other calculations (scf and nscf) perform correctly. However, when it comes to bands.x calculation, it fails.
here is the input file for the bands.x:
&BANDS
prefix = "eu",
outdir = './out',
lsym = .true.,
filband = 'eu.dat'
/
With kind regards,
Amin Mirzai,
PhD candidate
Dept. of Maskinteknologi,
Lund University,
P.O. Box 118,
SE-221 00 Lund,
Sweden
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