[QE-users] Error in thermo_pw

[Pooja Vyas]

Dear users,
Please find the attached input files which I want to run using thermo_pw.
After making the three input files, I tried running the file using the
command:
"mpirun -np 8 -machinefile h1 /apps/codes/qe/6.4/bin/thermo_pw.x <
cao.mur_lc_t.in > cao.mur_lc_t.out"

Doing this, the following files and directory were produced:
anhar_files                 CRASH                        g2
                       gnuplot_files        therm_files
 g3                              h1
thermo_control
cao.mur_lc_t.in          dynamical_matrices    g4
ph_control
cao.mur_lc_t.out        elastic_constants        g5
phdisp_files
cao_mur_lc_t.save     energy_files                g6
  pseudo
cao_mur_lc_t.xml       g1                               g7
                        restart

But, the run got terminated due to some reason and as you can see a file
named CRASH was produced. The CRASH file had the following error:

 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         1
     from pw_readschemafile : error #         1
     xml data file not found
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         3
     from pw_readschemafile : error #         1
     xml data file not found
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         7
     from pw_readschemafile : error #         1
     xml data file not found
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%


 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
     task #         4
     from pw_readschemafile : error #         1
     xml data file not found
 %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%

can anyone please explain me what can be the reason for this error? What
should be the chronology of running the three files?
Thanks and regards.
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