#!/bin/tcsh
#$ -S /bin/tcsh
#$ -l qname=parallel.q
#$ -l h_rt=24:00:00
#$ -o jobtest.out
#$ -e jobtest.err
#$ -cwd
#$ -pe orte 16 
#$ -j y
#$ -R y

module load intel/ict/4.0
module load ofed/openmpi/intel/1.2.8

set MPIRUN  = /usr/mpi/intel/openmpi-1.2.8/bin/mpirun
set HOME    = /home/lambert
set SGW     = $HOME/SGW/branches/lambert/fulltests/examples/SiTrialRun5/gwhs.x
set TDIR    = /share/scratch/lambert/SiTrialRun5
set IDIR    = $HOME/SGW/branches/lambert/fulltests/examples/SiTrialRun5/

cd $TDIR
cp $IDIR/vxc.dat ./
cp $IDIR/imfreq.dat ./
cp $IDIR/klist.dat ./

$MPIRUN -np 16 $SGW -npool 16  > SGW.modielecs.si.out

exit

#
# to submit:
# > qsub job.pbs
# to check tatus:
# > qstat
# > qstat -u lambert
#