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How to parrallel running for VASP in the IBM p690

Posted: Fri Jan 13, 2006 5:55 pm
by mqcai
Dear everyone:
I have successful installed the vasp 4.6 in the IBN p690 with the makefile.rs6000, and I can run it with serial calculation.

I want to parrallel. I do not How to do?

PS: IBM p690 AIX system

Can you give me some suggestion?

Thank you in advance?

How to parrallel running for VASP in the IBM p690

Posted: Mon Jan 16, 2006 10:35 am
by admin
for compilation with a parallel fortran compiler on IBM (mpxlf) please have a look at the makefile.sp2 file

How to parrallel running for VASP in the IBM p690

Posted: Wed Mar 29, 2006 9:41 am
by yanyan_1029
I have met the same question on the same system. I change my makefile according to makefile.sp2. But I don't know which directory the file mpif.h lies in.
can you tell me?

How to parrallel running for VASP in the IBM p690

Posted: Tue Apr 11, 2006 12:53 pm
by admin
most probably, it is in the include subdirectory of your lam or mpich
installation