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N.B.: The VTST script collection is not available from the vasp environment modules. Instead, it is provided by the vtstscripts environment module(s).
Example Jobscripts
| HTML Kommentar |
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| Codeblock |
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| language | bash |
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| title | For Intel Skylake CPU compute nodes (Phase 1, Göttingen unsafe-only): |
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| #!/bin/bash
#SBATCH --time 12:00:00
#SBATCH --nodes 2
#SBATCH --tasks-per-node 40
export SLURM_CPU_BIND=none
module load impi/2019.5
module load vasp/5.4.4.p1
mpirun vasp_std |
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| Codeblock |
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| language | bash |
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| title | For Intel Cascade Lake CPU compute nodes (Phase 2): |
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|
#!/bin/bash
#SBATCH --time 12:00:00
#SBATCH --nodes 2
#SBATCH --tasks-per-node 96
export SLURM_CPU_BIND=none
module load impi/2019.5
module load vasp/5.4.4.p1
mpirun vasp_std |
...