[QE-users] Way forward for further calculations of bands, pdos
Sagar Dahal
sagardahal at celebrationcoed.edu.np
Sat Jan 3 17:49:10 CET 2026
Greetings,
I had run two times nscf using Quantum Espresso after successful completion
of scf. The last line after PARALLEL ROUTINES is below.
For 1st NSCF calculation, also, the same message arose, and in another NSCF
calculation, a similar message came.
===================================================================================
= BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES
= PID 16362 RUNNING AT node2
= EXIT CODE: 6
= CLEANING UP REMAINING PROCESSES
= YOU CAN IGNORE THE BELOW CLEANUP MESSAGES
===================================================================================
Intel(R) MPI Library troubleshooting guide:
https://software.intel.com/node/561764
Will it affect further calculation of bands and pods using Quantum
Espresso? After this also, I tried for bands and PDOS; it came, but I had
some confusion. Will further calculation and computation be correct?
Regards
sagar
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