CBD/D4h/spin-flip/SF-ADC/sf-adc3/q_chem
2021-03-23 15:00:29 +01:00

13 lines
196 B
Bash
Executable File

#!/bin/bash
#SBATCH --job-name=SF-ADC3
#SBATCH --nodes=1
#SBATCH -n 8
#SBATCH -p q-chem
#SBATCH --mem=20000
#g09 cbutadiene_opt.com
qchem AVDZ/CBD_sf_adc3_avdz.inp AVDZ/CBD_sf_adc3_avdz.log