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VASP with OpenMP and MPI

Posted: Thu Oct 02, 2008 1:30 pm
by pavel
Is it possible to compile VASP with combination of OpenMP (shared memory) within one node and MPI for communication between different nodes? It would be very useful for e.g. IBM Power 6 computers with 32 CPU per nodes.
Has anyone an experience?

VASP with OpenMP and MPI

Posted: Mon Oct 06, 2008 1:17 pm
by job
Do you see any OpenMP directives in the source code?

No? Well, that answers it then.. ;)