[CP2K:4646] Cp2k compiled but some test files fail
Samuel Lamphier
samuell... at gmail.com
Tue Oct 1 17:09:47 UTC 2013
Hi, thank you for your insight, I am try to get 13.1.3 working. I am also
having an additional error on another machine. This is a mac pro 10.7.5,
same composer xe and intel setup. I was wondering if you had any knowledge
of this?
xair -r
/Users/cormackgroup/Downloads/cp2k-2.4.0/makefiles/../lib/Darwin/popt/libcp2k_elpa_lib.a
make[1]: xair: No such file or directory
ifort -FR -g -c -D__INTEL -D__FFTMKL -D__FFTW3
-I/opt/intel/composer_xe_2013.5.198/mkl/interfaces/fftw3xf -FR -O2 -xhost
-heap-arrays -fpp -free -g lib_kinds.f90
ifort -FR -g -c -D__INTEL -D__FFTMKL -D__FFTW3
-I/opt/intel/composer_xe_2013.5.198/mkl/interfaces/fftw3xf -FR -O2 -xhost
-heap-arrays -fpp -free -g smm.f90
make[1]: ***
[/Users/cormackgroup/Downloads/cp2k-2.4.0/makefiles/../lib/Darwin/popt/libcp2k_elpa_lib.a]
Error 1
make[1]: *** Waiting for unfinished jobs....
make: *** [build] Error 2
On Monday, September 30, 2013 3:56:26 AM UTC-4, IBethune wrote:
>
> Yes, we are using 13.1.3 from XE 2013 update 5 at the moment and it is
> working fine.
>
> Cheers
>
> - Iain
>
> --
>
> Iain Bethune
> Project Manager, EPCC
>
> Email: ibe... at epcc.ed.ac.uk <javascript:>
> Twitter: @IainBethune
> Web: http://www2.epcc.ed.ac.uk/~ibethune
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> 5201/6555
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> Addr: 2404 JCMB, The King's Buildings, Mayfield Road, Edinburgh, EH9 3JZ
>
>
>
>
>
>
>
>
> On 29 Sep 2013, at 06:24, Joe Greenstone wrote:
>
> > Hi Iain,
> >
> > Had also upgraded to ifort 14.0.0 in composer xe 2013 sp1.
> >
> > Are you now using ifort 13.1.3 in composer xe 2013 update 5?
> >
> >
> >
> > On Saturday, 28 September 2013 05:28:10 UTC+9:30, IBethune wrote:
> > Hi Samuel. We have also just upgraded to the intel 14.0 compiler in
> compeer ex 2013 sp 1 and saw the same problem for various test cases. I've
> reported a bug to Intel and am currently waiting for them to investigate.
> For now it's better to use the 13.1 compiler!
> >
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