[QE-users] simple_ip error
Anibal Thiago Bezerra
anibal.bezerra at unifal-mg.edu.br
Wed Oct 14 22:17:54 CEST 2020
Dear Quantum Espresso users and developers,
I'm trying to use simple.x and simple_ip.x to retrieve the optical
properties of metallic alloys. The simple.x calculation finished with no
errors (at least no error messages), but the simple_ip.x calculation
freezes after starting the mpi. The output file stops with
-------------------------------
Program SIMPLE_IP v.6.5 starts on 14Oct2020 at 14:47: 8
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 12 processors
MPI processes distributed on 1 nodes
R & G space division: proc/nbgrp/npool/nimage = 12
MPI PARALLEL VERSION
Number of procs: 12
simple_ip: Version 1.00
-----------------------------
and a crash message from the scheduler rises as
----------------------
At line 47 of file input_simple_ip.f90 (unit = 5, file = 'stdin')
Fortran runtime error: End of file
srun: error: physics18: task 0: Exited with exit code 2
-------------------------
I've changed the number of processors, used pools, images, and got no
success.
Is the problem related to the instalattion itself?
Thanks a lot!
Best wishes!
Anibal
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