slurm
Differences
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| Next revision | Previous revision | ||
| slurm [2025/04/26 05:33] – created randon | slurm [2025/09/04 15:57] (current) – randon | ||
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| Line 1: | Line 1: | ||
| In general submission should look like this: | In general submission should look like this: | ||
| - | `#SBATCH --cpus-per-task=(max 64) | + | |
| + | < | ||
| + | # | ||
| + | #SBATCH --cpus-per-task=(max 64) | ||
| #SBATCH --mem=(max 124G) | #SBATCH --mem=(max 124G) | ||
| #SBATCH --time=(max 7-00:00) | #SBATCH --time=(max 7-00:00) | ||
| Line 6: | Line 9: | ||
| your commands here | your commands here | ||
| - | ` | + | </ |
| If you need a gpu, add this line: | If you need a gpu, add this line: | ||
| - | `#SBATCH --gres=gpu: | + | < |
| + | #SBATCH --gres=gpu: | ||
| + | </ | ||
| If you need terachem: | If you need terachem: | ||
| + | < | ||
| source / | source / | ||
| + | </ | ||
| + | |||
| + | If you need anything from computecanada: | ||
| + | < | ||
| + | source / | ||
| + | export CC_CLUSTER=cedar | ||
| + | </ | ||
| + | Premade scripts for creating slurm submission scripts for CP2K, Gaussian and Terachem are available in your $PATH by default (copied to $HOME/ | ||
| + | < | ||
| + | submit_terachem.py | ||
| + | (make_tc.py) | ||
| + | submit_cp2k | ||
| + | submit_g16.py | ||
| + | </ | ||
slurm.1745645582.txt.gz · Last modified: 2025/04/26 05:33 by randon