pmutt.io.gaussian.read_frequencies

pmutt.io.gaussian.read_frequencies(filename, units='1/cm')

Reads the frequencies from the Gaussian log file.

Parameters:

• filename (str) – Log file

• units (str, optional) – Units to return frequencies. Default is ‘1/cm’

Returns:

frequencies – Frequencies in units. Default is ‘1/cm’

Return type:

list of float