CBD/D4h/spin-flip/SF-ADC/sf-adc2/q_chem
2021-03-23 15:00:29 +01:00

12 lines
195 B
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Executable File

#!/bin/bash
#SBATCH --job-name=SF-ADC2
#SBATCH --nodes=1
#SBATCH -n 8
#SBATCH -p q-chem
#SBATCH --mem=20000
#g09 cbutadiene_opt.com
qchem AVTZ/CBD_sf_adc2_avtz.inp AVTZ/CBD_sf_adc2_avtz.log