Which OneAPI version? The usual piece of advice applies: try to figure out whether a newer (or older) compiler version fixes the problem. Just noticed that the 2022.1 version of OneAPI is out.
Paolo On Thu, Dec 23, 2021 at 10:45 AM LEUNG Clarence <[email protected]> wrote: > Dear QE users and developers, > > > > Recently, I compile the newest QE7.0 and QE6.8 with oneapi. However, error > occur as follows: > > iteration # 1 ecut= 75.00 Ry beta= 0.10 > > Davidson diagonalization with overlap > > forrtl: severe (174): SIGSEGV, segmentation fault occurred > > Image PC Routine Line > Source > > pw.x 0000000001038FDA Unknown Unknown Unknown > > libpthread-2.17.s 00002AAAB38B3630 Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB27FCBAC Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB27FC7BA Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB2399677 Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB222F9F2 Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB21FFACA Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB22E2FEC Unknown Unknown Unknown > > libmpi.so.12.0.0 00002AAAB239C239 MPI_Gatherv Unknown Unknown > > libmpifort.so.12. 00002AAAB1DD565F MPI_GATHERV Unknown Unknown > > pw.x 0000000000E2FDED mp_mp_mp_gatherv_ 2252 mp.f90 > > pw.x 0000000000B4CE47 cegterg_ 399 > cegterg.f90 > > pw.x 000000000070AECD diag_bands_IP_dia 719 > c_bands.f90 > > pw.x 00000000007097E8 diag_bands_ 289 > c_bands.f90 > > pw.x 0000000000706943 c_bands_ 126 > c_bands.f90 > > pw.x 00000000004104A4 electrons_scf_ 625 > electrons.f90 > > pw.x 000000000040D8EA electrons_ 159 > electrons.f90 > > pw.x 0000000000585C2E run_pwscf_ 154 > run_pwscf.f90 > > pw.x 000000000040AF1C MAIN__ 85 > pwscf.f90 > > pw.x 000000000040AD92 Unknown Unknown Unknown > > libc-2.17.so 00002AAAB3DE4555 __libc_start_main Unknown > Unknown > > pw.x 000000000040ACA9 Unknown Unknown Unknown > > > > On the other hands, I compile the newest QE7.0 and QE6.8 with intel > parallel studio 2018, both work. > > It is very appreciated that you can give me some suggestions. > > > > Thanks！ > > Best regards, > > LIANG Xiongyi > > Postdoctoral Fellow > > Hong Kong Quantum AI Lab > > The University of Hong Kong > > > _______________________________________________ > Quantum ESPRESSO is supported by MaX (www.max-centre.eu) > users mailing list [email protected] > https://lists.quantum-espresso.org/mailman/listinfo/users -- Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche, Univ. Udine, via delle Scienze 206, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
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