Catastrophical Error w/ Intel Compiler and w/o libintwrapper

Matthias Krack matthia... at psi.ch
Tue Nov 24 17:40:39 CET 2009


Hi Frank,

I would suggest to try an older Intel compiler version like 11.0 or
10.1, since there might be problems with 11.1. For instance 10.1 is
working for me with the today's CP2K version, ie. all regtests passed.
Moreover, I would reduce the optimization level from -O3 to -O2.

Matthias

On Nov 24, 12:34 pm, Frank Uhlig <uhlig... at googlemail.com> wrote:
> Hi all,
>
> at first with respect to the last thread concerning the compilation
> (for link see below) I found a setup that works for me and the
> regtests. While trying to compile the whole thing with same setup but
> just without the libintwrapper (meanig excluding the -
> D__HAS_NO_ISO_C_BINDING and the corresponding libraries including
> libstdc++) I get a "catastrophical error" (see output of make).
> Any help or suggestions concerning this would be appreciated.
>
> Thanks,
>
> Frank
>
> used compilers and libraries:
>
> Intel Fortran/C compiler v11.1.059
> OpenMPI v1.3.3
> Libint v1.1.4
> FFTW3 v3.2.2
>
> thread concerning compilation with intel and pgi:
>
> http://groups.google.com/group/cp2k/browse_thread/thread/45381865336e...
>
> working arch-file:
>
> http://cp2k.googlegroups.com/web/Linux-x86-64-intel-libintwrapper.pop...
>
> make-output:
>
> http://groups.google.com/group/cp2k/web/cp2k_make_error.log



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