#!/bin/bash #SBATCH --job-name=EOM-CC(2,3) #SBATCH --nodes=1 #SBATCH -n 4 #SBATCH -p q-chem #g09 cbutadiene_opt.com qchem AVTZ/CBD_eom_sf_cc2_3_avtz.inp AVTZ/CBD_eom_sf_cc2_3_avtz.log