respected prof. Blaha,i am facing problems in parallel execution, i sent an email to wien mailing list (which i recieve emails all the time) but it gives this error.please designate my email address as permitted sender host (SPF) as the error says. Also i will be very grateful for guiding me about my parallel job crashing . . . . Regards, Arshad Farhan From: postmaster at postech.ac.kr To: arshadfarhan at hotmail.com Subject: [NDR] Delivery Failure Notice : [Wien] parallel LAPW2 crash List-Post: wien@zeus.theochem.tuwien.ac.at Date: Wed, 6 Jun 2012 12:16:32 +0900
Your message cannot be delivered to the following recipients: Recipient :ysj at gsnu.ac.kr Reason:550 Your E-Mail Address does not designate Permitted Sender Hosts(SPF) --Forwarded Message Attachment-- From: arshadfar...@hotmail.com To: wien at zeus.theochem.tuwien.ac.at List-Post: wien@zeus.theochem.tuwien.ac.at Date: Wed, 6 Jun 2012 12:25:56 +0900 Subject: [Wien] parallel LAPW2 crash Dear Wien user, i'm trying to minimize the internal positions by: min -p -sp -j "runsp_lapw -I -i 80 -fc 1. -p " the parallel settings are: MPICH_HOME=/opt/mpi/gcc/mpich-1.2.7p1 MPICH_EXEC=$MPICH_HOME/bin/mpirun and my parallel job crashes every time with the error: forrtl: No such file or directory forrtl: severe (29): file not found, unit 21, file /home/mafarhan/WIEN2k/case2/case2.scf2up_2 Image PC Routine Line Source sumpara 00000000004A4D9D Unknown Unknown Unknown sumpara 00000000004A38A5 Unknown Unknown Unknown sumpara 0000000000453E69 Unknown Unknown Unknown sumpara 000000000041890F Unknown Unknown Unknown sumpara 0000000000418142 Unknown Unknown Unknown sumpara 0000000000421BDD Unknown Unknown Unknown sumpara 000000000041203F Unknown Unknown Unknown sumpara 000000000040CCB5 Unknown Unknown Unknown sumpara 00000000004030BA Unknown Unknown Unknown libc.so.6 000000376C21D994 Unknown Unknown Unknown sumpara 0000000000402FD9 Unknown Unknown Unknown cp: cannot stat `.in.tmp': No such file or directory rm: cannot remove `.in.tmp': No such file or directory rm: cannot remove `.in.tmp1': No such file or directory however, the scf cycle finishes without any error when executed without parallel tag please help me, Regards, M. Arshad Farhan _______________________________________________ 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/20120607/8a9b0d71/attachment.htm> -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... 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