Read the log file of g09, and gives some useful parameters. Contact me: [email protected]
gfortran g09log.f90 -o g09log
g09log logfile jobs
logfile: the name of gaussian output log filr jobs: 0-3 0: chk converge energy 1: obtain homo and lumo and its orbital number; 2: write gjf from log, have to check the functional line 3: get total energy