[Wien] About the machines file for mpi

Peter Blaha pblaha at zeus.theochem.tuwien.ac.at
Mon Jan 24 08:23:06 CET 2005


> For example, for a large system, we use 2 k-points, and 4 nodes. then the .machines file should like this?
> granularity:1
> 1:comp1 comp2
> 1:comp3 comp4
> residue:comp1
> lapw0:comp1 comp2 comp3 comp4

Yes, this machines file is correct (although the 2 lines "granularity and
residue" will not have any effect in your example and are not necessary here).

                                      P.Blaha
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Peter BLAHA, Inst.f. Materials Chemistry, TU Vienna, A-1060 Vienna
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