Hi Paolo/Everyone, The 5.02 version has been downloaded and compiled with ifort v13 and gcc. When I run on my local computer, with QE 5.0.2 compiled with gcc, it runs fine. When I run on our HPC, either the ifortv13 or gcc, there is an IOTK error.
I've attached my local in/out files, the bluebear (our HPC) input and output files (only difference in input file are the directories) and the moab error files (one for ifort v13 and one for gcc). There are some unneccessary sections in my input files, but it runs fine with 2 processors on my computer, but not on the hpc. We've also tried it with 1, 2 or 16 cores and still the same IOTK error. All the best, Ben > On Feb 11, 2013, at 18:16 , Ben Palmer wrote: > >> I'm having a few IOTK errors with PWscf from the 5.0.1 suite on our >> University supercomputer, and have read that the probable cause is the >> intel compiler. > I have never had any iotk problem with ifort, while I have had and seen > many with gfortran. The only case of trouble I am aware of, is the one > mentioned in the user guide with ifort v.12.0.0, which disappeared in > subsequent versions. > > P. > --- > Paolo Giannozzi, Dept of Chemistry&Physics&Environment, > Univ. Udine, via delle Scienze 208, 33100 Udine, Italy > Phone +39-0432-558216, fax +39-0432-558222 > > > > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: local.in Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment.pl -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: local.out Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment-0001.pl -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: bluebear.in Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment-0002.pl -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: bluebear.out Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment-0003.pl -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: job_gcc.o10718.txt Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment.txt -------------- next part -------------- An embedded and charset-unspecified text was scrubbed... Name: job_ifort13.o9872.txt Url: http://pwscf.org/pipermail/pw_forum/attachments/20130216/9447ac19/attachment-0001.txt
