2021-03-15 14:30:41 +01:00
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#!/bin/bash
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#SBATCH --job-name=SF-CIS
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#SBATCH --nodes=1
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2021-03-22 07:08:03 +01:00
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#SBATCH -n 8
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2021-03-15 14:30:41 +01:00
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#SBATCH -p q-chem
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2021-03-22 07:08:03 +01:00
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#SBATCH --mem=20000
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2021-03-15 14:30:41 +01:00
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#g09 cbutadiene_opt.com
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qchem AVQZ/CBD_sf_cis_avqz.inp AVQZ/CBD_sf_cis_avqz.log
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