SGI Altix & MOLCAS 6.0


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Posted by Rafael R. Pappalardo on July 26, 2004 at 17:23:30:

I have been able to compile Molcas 6.0 on an SGI Altix 350 machine. All tests run ok. The problem is trying to compile a version which run in parallel. Then a number of tests dosn't run ok. The log file in test 032 reports:
Label SCF_ITER not found
in module check.

The err file for the same test displays some:
MPI: MPI automatically restricts mapped files for the heap. The current
MALLOC_MMAP_MAX_ environment setting is ignored.

I don't know if this is harmfull or not.

Other tests reports different problems.

Have anybody been suscesffull in installing Molcas in such system?

Thanks for the attention





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