Compiling in AMD Opteron using G95

[LIANG Yunfeng]

Dear all,

In Linux-x86-64-g95.sopt file, could you tell me which version you are
using:

1). GotoBLAS
2). Lapack
3). g95
4). gcc
5). and any cautions on libinit and stdc++ and pthread?

I ever successfully compiled cp2k.sopt by Lapack-3.1.1 and BLAS and G95
[Linux x86_64/EMT64 (32 bit D.I.), version: 0.9).And moreover I have seen
the tests are running correctly in 50 MD steps (QuickStep) for liquid
water with 32 molecules and 5000 MD steps for water monomer. But when I turn
to GotoBLAS, I failed to compile. By another kind of G95 [Linux x86_64/EMT64
(64 bit D.I.)], I was able to compile Lapack.3.1.1 linked with GotoBLAS-1.06.
Then by using compiled Lapack and the 32 bit g95(which is politically wrong
according to cp2k  web), I can compile cp2k but failed to test
in ./cp2k/tests/H2O.inp.

Thanks
Sincerely, Yunfeng
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20080314/88c3107c/attachment.htm>