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Jun 25, 2025
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Lammps doc update to address remaining comments #168

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6 changes: 1 addition & 5 deletions docs/software/sciapps/lammps.md
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Expand Up @@ -71,19 +71,15 @@ A development view is also provided, which contains all libraries and command-li

### Running LAMMPS with Kokkos on the HPC Platform

To start a job, two bash scripts are potentially required: a [SLURM] submission script, and a wrapper for `numactl` which sets up CPU and memory binding.

The submission script is the following:
To start a job, the following bash [SLURM] submission script is required:

```bash title="run_lammps_kokkos.sh"
#!/bin/bash -l
#SBATCH --job-name=<JOB_NAME>
#SBATCH --time=01:00:00 (1)
#SBATCH --nodes=2
#SBATCH --ntasks-per-node=4 (2)
#SBATCH --gpus-per-node=4
#SBATCH --gpus-per-task=1
#SBATCH --gpu-bind=per_task:1
#SBATCH --account=<ACCOUNT> (3)
#SBATCH --uenv=<LAMMPS_UENV>:/user-environment (4)
#SBATCH --view=kokkos (5)
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