Hi Yasha,

Yasha Karant <[log in to unmask]> writes:

> I am attempting to build VASP 5.3.3 for a X86-64 SL6, with Nvidia GPUs
> and Nvida CUDA 6, compute engine.
>
> VASP requires lapack 3.4.2
>
> As I was building lapack,
>
> the following failure was reported:
>
> gfortran -O2 -c stbt05.f -o stbt05.o
> stbt05.f: In function ‘stbt05’:
> stbt05.f:189: internal compiler error: Segmentation fault
> Please submit a full bug report,
> with preprocessed source if appropriate.
> See <http://bugzilla.redhat.com/bugzilla> for instructions.
> make[2]: *** [stbt05.o] Error 1
> make[2]: Leaving directory `/dt0/vasp/lapack-3.4.2/TESTING/LIN'
> make[1]: *** [xlintsts] Error 2
> make[1]: Leaving directory `/dt0/vasp/lapack-3.4.2/TESTING'
> make: *** [lapack_testing] Error 2
>
> full output of all relevant make commands available if needed. Up to this
> failure,
> everything seems normal in the make output.
>
> Has anyone seen this error, and if so, what is the workaround?
>
> Is there an installable RPM of this package available so that I do not
> have to build from source?
>
> We have the appropriate VASP license -- does anyone have a set of
> makefiles (or binaries, currently CUDA 6) for the environment we need?
>
> Any information would be appreciated.
>
> Yasha Karant
>

With a similar setup but without GPU support and using Intel's MKL, a
colleague of mine has successfully compiled VASP 5.3.3.  Perhaps you
should try a different LAPACK implementation.

Cheers,

Loris

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