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| Both sides previous revision Previous revision Next revision | Previous revision | ||
| habrok:examples:gaussian [2023/03/22 13:24] – fokke | habrok:examples:gaussian [2025/06/11 12:10] (current) – Use bash syntax highlighting pedro | ||
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| ====== Gaussian ====== | ====== Gaussian ====== | ||
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| + | **Please be aware that we don't have a site license for Gaussian.** People | ||
| + | < | ||
| + | module load Gaussian | ||
| + | </ | ||
| + | |||
| + | ==== Usage ==== | ||
| The following example can be used as a job script for running Gaussian jobs: | The following example can be used as a job script for running Gaussian jobs: | ||
| - | < | + | < |
| #!/bin/bash | #!/bin/bash | ||
| #SBATCH --job-name=gaussian | #SBATCH --job-name=gaussian | ||