run error

[xiaoliang]

Hi Teo,

The pgi I am using is 6.2.5. I recompiled the code with

FCFLAGS  = -O3 -Mscalarsse -Mvect=sse -Mcache_align -DLIBC_ULIMIT_HACK
-DLIBC_RENAME_HACK

instead of "-fastsse -tp amd64"

It works now.

xiaoliang

On Jan 25, 6:08 pm, Teodoro Laino <teodor... at gmail.com> wrote:
> Hi,
>
> the input file  you posted is running smoothly.
> Very probably you're using a pgi compiler version bugged (i.e. the
> compiler is miscompiling the code).
> CP2K is *very* demanding about the compilation quality capability of
> F90-2003 compilers.
> Which version are you using?
>
> as we said often in this group,  a working version of pgi is (as far
> as I know for my experience) the 6.2.5 . Maybe others..
> Who knows??
> Keep in mind that pgi, between all available fortran compilers, is
> the less trustworthy!
>
> Cheers,
> Teo
>
> On 25 Jan 2008, at 18:33, xiaoliang wrote:
>
>
>