[Wien] FW: [NDR] Delivery Failure Notice : parallel LAPW2 crash

Thu Jun 7 03:22:45 CEST 2012

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
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: arshadfarhan at hotmail.com
To: wien at 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

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