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update slurm scripts
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rsdmse committed Aug 7, 2023
1 parent 1c61f03 commit 8c87aa9
Showing 1 changed file with 2 additions and 3 deletions.
5 changes: 2 additions & 3 deletions static/scripts/lammps.slurm
Original file line number Diff line number Diff line change
Expand Up @@ -7,8 +7,7 @@
#SBATCH --partition=parallel

module purge
module load intel/18.0
module load intelmpi/18.0_18.0
module load {{% module-firstversion %}}
module load intel/18.0 intelmpi/18.0_18.0
module load lammps

srun lmp_iimpi -in run.in.npt

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