[CP2K:7500] Compiling cp2k on intel ifort 13.1.3 icc 13.0.0

Cohen, Ronald rco... at carnegiescience.edu
Thu Mar 10 13:24:05 UTC 2016


Dear Iain,

Thank you so much for your quick response! Indeed you are right--there
seems to be a problem with our cluster. Although I loaded:

 . /opt/intel/compilers_and_libraries_2016.0.079/linux/bin/compilervars.sh
intel64

I am getting an older compiler:

mpif90 -V
Intel(R) Fortran Intel(R) 64 Compiler XE for applications running on
Intel(R) 64, Version 14.0.0.080 Build 20130728
Copyright (C) 1985-2013 Intel Corporation.  All rights reserved.

[rcohen at deepcarbon makefiles]$ ifort -V
Intel(R) Fortran Intel(R) 64 Compiler XE for applications running on
Intel(R) 64, Version 14.0.0.080 Build 20130728
Copyright (C) 1985-2013 Intel Corporation.  All rights reserved.

So I guess we need the latest compiler installed. What does te PRIVATE
statement do? I have never used it. Thank you!

Sincerely,

Ron


---
Ronald Cohen
Geophysical Laboratory
Carnegie Institution
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On Thu, Mar 10, 2016 at 5:44 AM, Iain Bethune <ibet... at epcc.ed.ac.uk>
wrote:

> Hi Ronald,
>
> Unfortunately Intel don’t have a good record of back-porting bug-fixes
> into older compiler releases.  We also don’t have enough time to keep
> testing older versions of the compiler against the latest code.  However, I
> can confirm that issue is fixed as of the latest releases of the compiler,
> so if you are able to upgrade the problem should go away.
>
> You can find example arch files for the Intel 16.0.1 compiler linked from
> dashboard.cp2k.org
>
> - Iain
>
> --
>
> Iain Bethune
> Project Manager, EPCC
>
> Email: ibet... at epcc.ed.ac.uk
> Twitter: @IainBethune @PrimeGrid @CP2Kproject
> Web: http://www2.epcc.ed.ac.uk/~ibethune
> Tel/Fax: +44 (0)131 650 5201/6555
> Mob: +44 (0)7598317015
> Addr: 2404 JCMB, The King's Buildings, Peter Guthrie Tait Road, Edinburgh,
> EH9 3FD
>
> > On 9 Mar 2016, at 21:27, Ronald Cohen <rco... at carnegiescience.edu>
> wrote:
> >
> > Apparently still not fixed.
> >
> > On Friday, October 18, 2013 at 6:02:24 PM UTC-4, Fiona Reid wrote:
> > Hi Folks,
> > This is a known compiler bug which we reported to Intel and will
> apparently be fixed in the next releases of the compiler. If you want to
> use version 13.1.3 then comment out line 23 (i.e. PRIVATE) of
> dbcsr_lib/dbcsr_error_handling.F and the code should compile/ run fine.
> >
> > Also, when you start compiling the parallel versions you should remove
> the -heap-arrays flag. With SSMP/PSMP builds we had lots of problems caused
> by this flag.
> >
> > Hope that helps,
> >
> > Fiona
> >
> >
> >
> >
> >
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