Thanks Gavin. I tried commenting that line but it got stuck in lapw1 loop and it gave the following error:
LAPW0 END LAPW0 END LAPW0 END LAPW0 END ssh_askpass: exec(/usr/libexec/openssh/gnome-ssh-askpass): No such file or directory^M Host key verification failed.^M Regards Reza On Wed, Sep 26, 2012 at 6:21 PM, Gavin Abo <gsabo at crimson.ua.edu> wrote: > You might try commenting > > !call W2kinit > > in SRC_lapw1/lapw1.F (line 34 Wien2k 12.1) and recompile as was mentioned: > > http://zeus.theochem.tuwien.ac.at/pipermail/wien/2012-August/017575.html > > > On 9/26/2012 10:03 AM, Reza Mahani wrote: > > > Hi Prof Blaha and wien2k users, > > I have recently installed wien2k 12.1 without any errors and I was running > a test job with it inorder to check the parallel mode. It gave me the > following errors: > dayfile content: > > Calculating GaAs in /lunarc/nobackup/users/reza/WIEN2k/test/GaAs > on an010 with PID 21141 > using WIEN2k_12.1 (Release 22/7/2012) in > /lunarc/nobackup/users/reza/Wien2k_12.1 > > > start (Wed Sep 26 10:19:05 CEST 2012) with lapw0 (100/99 to go) > > cycle 1 (Wed Sep 26 10:19:05 CEST 2012) (100/99 to go) > > > lapw0 -p (10:19:05) starting parallel lapw0 at Wed Sep 26 10:19:06 > CEST 2012 > -------- .machine0 : 8 processors > 16.100u 2.127s 0:06.00 303.6% 0+0k 132168+24680io 202pf+0w > > lapw1 -c -up -p (10:19:12) starting parallel lapw1 at Wed Sep 26 > 10:19:12 CEST 2012 > -> starting parallel LAPW1 jobs at Wed Sep 26 10:19:12 CEST 2012 > running LAPW1 in parallel mode (using .machines) > 1 number_of_parallel_jobs > an010 an010 an010 an010 an010 an010 an010 an010(120) Child > id 3 SIGSEGV, contact developers > Child id 0 SIGSEGV, contact developers > Child id 7 SIGSEGV, contact developers > Child id 1 SIGSEGV, contact developers > Child id 2 SIGSEGV, contact developers > Child id 6 SIGSEGV, contact developers > Child id 5 SIGSEGV, contact developers > Child id 4 SIGSEGV, contact developers > 0.341u 0.463s 0:01.42 56.3% 0+0k 1976+5760io 47pf+0w > Summary of lapw1para: > an010 k=0 user=0 wallclock=0 > 0.423u 0.884s 0:03.75 34.6% 0+0k 2496+6152io 53pf+0w > > lapw1 -c -dn -p (10:19:16) starting parallel lapw1 at Wed Sep 26 > 10:19:16 CEST 2012 > -> starting parallel LAPW1 jobs at Wed Sep 26 10:19:16 CEST 2012 > running LAPW1 in parallel mode (using .machines.help) > 1 number_of_parallel_jobs > an010 an010 an010 an010 an010 an010 an010 an010(120) Child > id 7 SIGSEGV, contact developers > Child id 2 SIGSEGV, contact developers > Child id 0 SIGSEGV, contact developers > Child id 4 SIGSEGV, contact developers > Child id 1 SIGSEGV, contact developers > Child id 6 SIGSEGV, contact developers > Child id 3 SIGSEGV, contact developers > Child id 5 SIGSEGV, contact developers > 0.123u 0.130s 0:01.18 21.1% 0+0k 0+1448io 15pf+0w > Summary of lapw1para: > an010 k=0 user=0 wallclock=0 > 0.209u 0.545s 0:03.70 20.0% 0+0k 0+1832io 15pf+0w > > lapw2 -c -up -p (10:19:20) running LAPW2 in parallel mode > ** LAPW2 crashed! > > > > job.err content: > > LAPW0 END > LAPW0 END > epl: Subscript out of range. > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > w2k_dispatch_signal(): received: Segmentation fault > -------------------------------------------------------------------------- > MPI_ABORT was invoked on rank 7 in communicator MPI_COMM_WORLD > with errorcode 80. > > Could you please tell me what causes this problem? > > Regards > Reza > > > > > _______________________________________________ > Wien mailing listWien at > zeus.theochem.tuwien.ac.athttp://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > > > _______________________________________________ > Wien mailing list > Wien at zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > > -------------- next part -------------- An HTML attachment was scrubbed... URL: <http://zeus.theochem.tuwien.ac.at/pipermail/wien/attachments/20120927/f30bd91c/attachment.htm>
