Usage: getfreqs [-c 100.0] [-s Min] [-t 298.15] [-v] [-h] [-a] [--version] Options: -c Cutoff value: any frequency below that will be replaced by the cutoff value for calculation of entropy (in cm^-1) -s Either Min (for minimum) or TS (for transition state structure) -t Temperature to be used in thermodynamics (in K) -a All columns printing (QUILD, ADF, ScanFreq) -v Verbose printing -h Help function (this message) --version Show version number Note: this script does not take into account the spin entropy For more info, see eq. 3 of Inorg. Chem. 2002, 41, 6928-6935 (M. Reiher)