Hello,
I have a problem that has been previously discussed, but I was unable to solve
it or find a proper solution. I am experiencing a problem with 'bands.x' on my
Ubuntu 22.04.2 LTS running on Windows 11. I was able to perform band
calculations using pw.x, but when I attempt to use bands.x, I encounter the
following error.
~/QE/Au_bands$ bands.x < Au_bands_pp.in |tee Au_bands_pp.out
Program BANDS v.6.7MaX starts on 22Nov2023 at 22:29:39
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
"P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017);
URL http://www.quantum-espresso.org";,
in publications or presentations arising from this work. More details at
http://www.quantum-espresso.org/quote
Parallel version (MPI), running on 1 processors
MPI processes distributed on 1 nodes
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
Error in routine bands (1):
reading bands namelist
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
stopping ...
--------------------------------------------------------------------------
MPI_ABORT was invoked on rank 0 in communicator MPI_COMM_WORLD
with errorcode 1.
NOTE: invoking MPI_ABORT causes Open MPI to kill all MPI processes.
You may or may not see output from other processes, depending on
exactly when Open MPI kills them.
....................................................................................
Input file: Au_bands_pp.in
&BANDS
outdir = './tmp/'
prefix = 'gold'
filband = 'Au_bands.dat'
/
....................................................................................
All of my input files for pw.x have the same prefix, which is 'gold' (prefix =
'gold').
....................................................................................
I really appreciate anyone's help.
Regards,
Bennár Michal
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