#!/usr/local/bin/bash
#PBS -S /usr/local/bin/bash
#PBS -o OUT
#PBS -m ea
#PBS -l nodes=1:ppn=1
#PBS -l walltime=2:00:00
#PBS -l cput=2:00:00
#PBS -e ERR

#Script added to database 9/6/05. Author: Shengyong Yang

echo "Node file: $PBS_NODEFILE :"
echo "---------------------"
cat $PBS_NODEFILE
echo "---------------------"
echo "Running on $NUM_PROCS processors."

# Change this to fit your calculation.

ROOT=$PBS_O_WORKDIR/my_calc
echo $ROOT

cd $PBS_O_WORKDIR


/home/users/yangsy/temp/PAW_20020422/bin/alpha/ppaw_fast.x $ROOT.cntl