[molpro-user] Molpro 2010 problem

[Jyh-Shyong]

  Hi Molpro users,

I compiled parallel version of Molpro 2010.01 with ifort and mvapich/GA 
4.2，when I tried to run a test job I got the following
error message:

/opt/vltmpi/OPENIB/mpi/bin/mpirun -machinefile ./hosts -np 4 
/package/chem/molpro/2k10.1/bin/molprop_2010_1_Linux_x86_64_i8.exe  JOB.com
Permission denied.
Some rank on 'irish3' exited without finalize.
Cleaning up all processes ...
done.

Any idea?

File   ./hosts contains 4 lines:

irish3
irish3
irish3
irish3

Thanks for your help.

Jyh-Shyong Ho, Ph.D.
Research Scientist
National Center for High Performance Computing
Hsinchu, Taiwan, ROC