Posted by Valera on August 18, 2012 at 19:20:59:
In Reply to: Parallel installation of Molcas76 posted by Dongwen Zhang on August 18, 2012 at 11:54:20:
Hi,
running molcas on multicore machine is not a smart idea,
all large jobs will run slower!
Our parallelization is for independent cluster nodes..
But if you want to try: install mpich 1.2.x, preferably from source, so the structure of directories is standard (alternatively, you might need to specify location of MPI include files and libraries). And run ./configure -setup.
OS - Molcas is normally tested under CentOS, and Ubuntu, but shouldn't be a problem to use
another Linux distribution.