Building NWChem 6.1 with Intel 11.1 and Openmpi 1.6 on a IB cluster running CentOS 6.2


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Forum Vet
1:36:35 PM PDT - Tue, May 15th 2012
Need to link with library for MPI Fortran bindings
Raffaella,
Since you have defined USE_MPIF, you need to include the library for MPI Fortran bindings (e.g. for openmpi "-lmpi_f90 -lmpi_f77" and
for mpich2 "-lmpichf90")

I have spotted another definition in your environmental that might cause you problems.
Please define FC=ifort and not FC="ifort -i8". The -i8 definition (plus more options) is automatically picked up.

Ciao, Edo