[Pw_forum] QE installation with OpenMPI
Aldo Ugolotti
a.ugolotti at campus.unimib.it
Tue Jan 24 17:25:37 CET 2017
Dear QE users,
I am trying to install QE on a parallel machine; I have already compiled
the OpenMPI(v 2.0.1) library and tested it with some simple codes
without problems. When I compile QE by this command:
./configure FC=mpifort F77=mpifort CC=mpicc
I get this warning message:
checking version of mpif90... gfortran gcc version 5.4.0 20160609
(Ubuntu 5.4.0-6ubuntu1~16.04.4)
configure: WARNING: parallel compiler mpif90 uses gfortran, but serial
compiler mpifort was detected
configure: WARNING: assuming F90=gfortran, discarding mpifort
and QE has problems in running in parallelization.
If I don't specify the compilers' flags I find no warning but I still
have the same parallelization issue, that means that the calculation in
not starting on the host (I can only see an orted process) and I have an
mpirun process on the master.
Can you help me in solving this puzzle?
Thanks in advance,
--
Aldo Ugolotti
Department of Materials Science,
University of Milano-Bicocca,
U5, Via R. Cozzi 55,
20125 Milano, Italy.
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