#!/bin/bash
#SBATCH --job-name=dolo_5000_no_charge
#SBATCH --output=dolo_5000_no_charge_%j.out
#SBATCH --error=dolo_5000_no_charge_%j.err
#SBATCH --partition=long
#SBATCH --nodes=6                                                    
#SBATCH --ntasks-per-node=24 
#SBATCH --ntasks=144                                  
#SBATCH --exclusive
#SBATCH --time=12:00:00                             


source /etc/profile.d/modules.sh
module purge
module load cmake gcc openmpi

mpirun -n 144 ./poet --interp dolo_fgcs_3.R dolo_fgcs_3.qs2 dolo_5000_no_charge
##mpirun -n 96 ./poet --interp  barite_fgcs_2.R barite_fgcs_2.qs2 bar_warmup