[Pw_forum] QE calculations terminated with errors
Jibiao Li
jibiaoli at foxmail.com
Fri Sep 8 12:48:06 CEST 2017
Dear QE experts,
I recently installed QE 6.1 on a 28-core workstation. When I typed "mpirun -np 8 pw.x" it looks fine. But as I run a calculation by typing "mpirun -np 8 pw.x <ads.relax.inp> ads.relax.out", it terminated with following errors. Please help me remove this errors if I may get your help.
Jibiao Li
Yangtze Normal University
Chongqing, China
[bmllzr at bmllzr H.25ml]$ mpirun -np 8 pw.x
Program PWSCF v.6.1 (svn rev. 13369) starts on 9Sep2017 at 2:31:11
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);
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 8 processors
R & G space division: proc/nbgrp/npool/nimage = 8
Waiting for input...
[bmllzr at bmllzr H.25ml]$ mpirun -np 8 pw.x <ads.relax.inp> ads.relax.out&
[1] 12888
[bmllzr at bmllzr H.25ml]$ forrtl: severe (24): end-of-file during read, unit 9, file /home/bmllzr/Calc/NO_Fe100/H.25ml/input_tmp.in
Image PC Routine Line Source
pw.x 0000000000D10BBE Unknown Unknown Unknown
pw.x 0000000000D0F656 Unknown Unknown Unknown
pw.x 0000000000CB0692 Unknown Unknown Unknown
pw.x 0000000000C4CA5B Unknown Unknown Unknown
pw.x 0000000000C4BFC2 Unknown Unknown Unknown
pw.x 0000000000C76174 Unknown Unknown Unknown
pw.x 00000000008CA1AC read_namelists_mo 1963 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
libopen-pal.so.6 00002B6633AD6650 Unknown Unknown Unknown
libmpi.so.1 00002B6633398E1D Unknown Unknown Unknown
mca_coll_tuned.so 00002B663E5F0B78 Unknown Unknown Unknown
libmpi.so.1 00002B66333AB612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002B6633141CE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002B964D53A994 Unknown Unknown Unknown
libopen-pal.so.6 00002B964433069A Unknown Unknown Unknown
libmpi.so.1 00002B9643BF2E1D Unknown Unknown Unknown
mca_coll_tuned.so 00002B964EDFDB78 Unknown Unknown Unknown
libmpi.so.1 00002B9643C05612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002B964399BCE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002AD0F19408C5 Unknown Unknown Unknown
libopen-pal.so.6 00002AD0E865B69A Unknown Unknown Unknown
libmpi.so.1 00002AD0E7F1DE1D Unknown Unknown Unknown
mca_coll_tuned.so 00002AD0F3203B78 Unknown Unknown Unknown
libmpi.so.1 00002AD0E7F30612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002AD0E7CC6CE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002AC99E9C687D Unknown Unknown Unknown
libopen-pal.so.6 00002AC9997C569A Unknown Unknown Unknown
libmpi.so.1 00002AC999087E1D Unknown Unknown Unknown
mca_coll_tuned.so 00002AC9A4417B78 Unknown Unknown Unknown
libmpi.so.1 00002AC99909A612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002AC998E30CE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002B30A0AC7882 Unknown Unknown Unknown
libopen-pal.so.6 00002B309786269A Unknown Unknown Unknown
libmpi.so.1 00002B3097124E1D Unknown Unknown Unknown
mca_coll_tuned.so 00002B30A238AB78 Unknown Unknown Unknown
libmpi.so.1 00002B3097137612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002B3096ECDCE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002B794B4A8994 Unknown Unknown Unknown
libopen-pal.so.6 00002B79462A769A Unknown Unknown Unknown
libmpi.so.1 00002B7945B69E1D Unknown Unknown Unknown
mca_coll_tuned.so 00002B7950E7AB78 Unknown Unknown Unknown
libmpi.so.1 00002B7945B7C612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002B7945912CE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
forrtl: error (78): process killed (SIGTERM)
Image PC Routine Line Source
mca_btl_vader.so 00002BA3F8F31861 Unknown Unknown Unknown
libopen-pal.so.6 00002BA3EFBA969A Unknown Unknown Unknown
libmpi.so.1 00002BA3EF46BE1D Unknown Unknown Unknown
mca_coll_tuned.so 00002BA3FA7F4B78 Unknown Unknown Unknown
libmpi.so.1 00002BA3EF47E612 Unknown Unknown Unknown
libmpi_mpifh.so.2 00002BA3EF214CE3 Unknown Unknown Unknown
pw.x 0000000000887358 bcast_integer_ 37 mp_base.f90
pw.x 00000000008655AB mp_mp_mp_bcast_i1 293 mp.f90
pw.x 00000000008CA1BE read_namelists_mo 1966 read_namelists.f90
pw.x 00000000008C2BF5 read_namelists_mo 1881 read_namelists.f90
pw.x 00000000008BEF4E read_input_mp_rea 68 read_input.f90
pw.x 00000000004101D1 MAIN__ 47 pwscf.f90
pw.x 000000000041013C Unknown Unknown Unknown
libc.so.6 00000038ED21ECDD Unknown Unknown Unknown
pw.x 0000000000410039 Unknown Unknown Unknown
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