pmutt.io.excel.set_vib_wavenumbers

pmutt.io.excel.set_vib_wavenumbers(value, output_structure)

Parses element header and assigns to output_structure[‘vib_wavenumber’]

Parameters:

• value (float) – Vibrational frequency in 1/cm

• output_structure (dict) – Structure to assign value. Will assign to output_structure[‘elements’][element]