#/bin/sh
# Replace jobname with whatever you choose
#PBS -o  jobname.log -e  jobname.err
# Replace the 72:00:00 with the time you need
#PBS -l mem=2gb,walltime=72:00:00
# x is your total number of processors divided by 2
#PBS -l nodes=x:ppn=2

# Added to database 8/2/07 Author: Alicja Haras  

#
# This version runs ADF 2006 on matrix.westgrid.ca
#

LD_LIBRARY_PATH=$LD_LIBRARY_PATH:/opt/hpmpi/lib/linux_amd64
export LD_LIBRARY_PATH

# Put total number of processors here

NSCM=x*2

MPIDIR=/opt/hpmpi
ADFHOME=/home/users/seth/ADF/adf2006/adf.02
ADFBIN=$ADFHOME/bin
ADFRESOURCES=$ADFHOME/atomicdata
SCMLICENSE=$ADFHOME/licence
SCMSPAWNSCRIPT=$ADFBIN/adfs
SCMWISH=/usr/bin/wish8.3
GNUPLOT=/usr/bin/gnuplot
SCM_USETMPDIR=yes
OMP_NUM_THREADS=2
SCM_ERROR_MAIL=no
export ADFHOME ADFBIN ADFRESOURCES SCMLICENSE NSCM SCMSPAWNSCRIPT
export SCMWISH GNUPLOT PVM_ROOT PVM_ARCH OMP_NWM_THREADS
export SCM_TMPDIR SCM_USETMPDIR SCM_ERROR_MAIL

TMPDIR=/scratch/$USER/$PBS_JOBID
export TMPDIR
SCM_TMPDIR=$TMPDIR
export SCM_TMPDIR

mkdir $TMPDIR
cd $PBS_O_WORKDIR

# Use your input file name instead of jobname.in

cp jobname.in $TMPDIR/input
cd $TMPDIR

rm TAPE* t21*

# Put total number of processors in place of x*2

$ADFBIN/adf -n x*2 < input