7 lines
149 B
Bash
7 lines
149 B
Bash
#!/bin/bash
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#SBATCH --job-name=SF-B2PLYP
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#SBATCH --nodes=1
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#SBATCH -n 16
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#SBATCH -p q-chem
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qchem CBD_sf_td_B2PLYP_avqz.inp CBD_sf_td_B2PLYP_avqz.log
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