Dear all
Nowadays I am interested in meta-GGA DFT calculation of MoS2 materials.It
needs qe package compiled with libxc.
However after installation complete without error, testing pw.x reports
following error:
forrtl: severe (174): SIGSEGV, segmentation fault occurred
Image PC Routine Line Source
libxcf90.so.5.2.3 00002ACD67024118 for__signal_handl Unknown Unknown
libpthread-2.17.s 00002ACD68D276D0 Unknown Unknown Unknown
pw.x 00000000010F3F0E Unknown Unknown Unknown
pw.x 00000000009973E8 date_and_tim_ 23
date_and_tim.f90
pw.x 00000000007E9BF3 environment_mp_en 169
environment.f90
pw.x 000000000040C705 MAIN__ 55 pwscf.f90
pw.x 000000000040C69E Unknown Unknown Unknown
libc-2.17.so 00002ACD68F56445 __libc_start_main Unknown Unknown
pw.x 000000000040C5A9 Unknown Unknown Unknown
It seems that libxcf90 were implemented in wrong way. My config.log file
and installation information file "make.inc" is listed in the attachment file.
When excluding libxc in make.inc, all the things runs normally.
My QE version is 6.3. with libxc version 4.2.3
Thanks
Yadong Wei
Harbin Institute of Technology
make.inc
Description: Binary data
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