2021-03-15 14:30:41 +01:00
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#!/bin/bash
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#SBATCH --job-name=EOM-CC(2,3)
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#SBATCH --nodes=1
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2021-03-29 07:18:27 +02:00
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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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2021-03-29 07:18:27 +02:00
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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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2021-03-29 07:18:27 +02:00
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qchem AVDZ/CBD_eom_sf_cc2_3_avdz.inp AVDZ/CBD_eom_sf_cc2_3_avdz.log
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2021-03-15 14:30:41 +01:00
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