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<p>Can someone please help me figure out why I get this error right
at the end of a scf calculation? I have tried QE 6.8 and 7.0. The
error appears right after convergence is finished and it starts
writing the data to files.</p>
<p><br>
</p>
<p>[thor1:10342:0:10342] Caught signal 11 (Segmentation fault:
address not mapped to object at address 0x7ffdc1593910)<br>
==== backtrace (tid: 10342) ====<br>
0 0x0000000000012c20 __funlockfile() :0<br>
1 0x0000000005fb8762 fox_m_fsys_format_mp_real_dp_str_() ???:0<br>
2 0x0000000005fcc963 fox_m_fsys_format_mp_str_real_dp_fmt_()
???:0<br>
3 0x0000000005fc3e34
fox_m_fsys_format_mp_str_real_dp_array_fmt_chk_() ???:0<br>
4 0x0000000005f7671a
m_wxml_overloads_mp_charactersarrayrealdp_() ???:0<br>
5 0x00000000009e9bff qes_write_module_mp_qes_write_output_()
???:0<br>
6 0x00000000005565bd pw_restart_new_mp_pw_write_schema_() ???:0<br>
7 0x0000000000552284 punch_() ???:0<br>
8 0x0000000000597f9d run_pwscf_() ???:0<br>
9 0x0000000000414ce1 MAIN__() ???:0<br>
10 0x0000000000414b22 main() ???:0<br>
11 0x0000000000023493 __libc_start_main() ???:0<br>
12 0x0000000000414a2e _start() ???:0<br>
=================================<br>
forrtl: severe (174): SIGSEGV, segmentation fault occurred<br>
Image PC Routine
Line Source<br>
pw.x 000000000636E3BA for__signal_handl
Unknown Unknown<br>
libpthread-2.28.s 00007F933D03FC20 Unknown
Unknown Unknown<br>
pw.x 0000000005FB8762 Unknown
Unknown Unknown<br>
pw.x 0000000005FCC963 Unknown
Unknown Unknown<br>
pw.x 0000000005FC3E34 Unknown
Unknown Unknown<br>
pw.x 0000000005F7671A Unknown
Unknown Unknown<br>
pw.x 00000000009E9BFF Unknown
Unknown Unknown<br>
pw.x 00000000005565BD Unknown
Unknown Unknown<br>
pw.x 0000000000552284 Unknown
Unknown Unknown<br>
pw.x 0000000000597F9D Unknown
Unknown Unknown<br>
pw.x 0000000000414CE1 Unknown
Unknown Unknown<br>
pw.x 0000000000414B22 Unknown
Unknown Unknown<br>
libc-2.28.so 00007F933A115493 __libc_start_main
Unknown Unknown<br>
pw.x 0000000000414A2E Unknown
Unknown Unknown</p>
<p>Here is the end of the scf output file:</p>
<p><br>
TS-vdW stress (kbar) 0.00 0.00 0.00<br>
0.00 0.00 0.00<br>
0.00 0.00 0.00<br>
<br>
<br>
0.00 0.00 0.00<br>
0.00 0.00 0.00<br>
<br>
<br>
0.00 0.00 0.00<br>
<br>
<br>
Writing output data file
vac-5sro-5ptoD-7sto-5ptoU-5sro-vac/vac-5sro-5ptoD-7sto-5ptoU-5sro-vac.save/<br>
<br>
===================================================================================<br>
= BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES<br>
= RANK 1 PID 10343 RUNNING AT thor1<br>
= KILLED BY SIGNAL: 9 (Killed)<br>
===================================================================================<br>
<br>
</p>
<p>Convergence was achieved but no matter what I do I get the same
thing.</p>
<p><br>
</p>
<p>Thank you!<br>
</p>
<p><br>
</p>
<div class="moz-signature">-- <br>
<b>Dr. Lucian Dragos Filip</b><br>
National Institute of Materials Physics<br>
Atomistilor str. 405A, PO Box MG. 7<br>
Magurele, 077125<br>
Bucharest, Romania<br>
E-mail: <url><a class="moz-txt-link-abbreviated" href="mailto:lucian.filip@infim.ro">lucian.filip@infim.ro</a></url><br>
Website: <url><a class="moz-txt-link-freetext" href="https://lucianfilip.wordpress.com/">https://lucianfilip.wordpress.com/</a></url><br>
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