Plots UV-Vis absorption spectra based on Gaussian excited states calculations and Lorentzian functions.
Requirements: Python 3, matplotlib (https://github.com/matplotlib/matplotlib)
Usage:
python3 uvvis.py <file name> [fwhm]
Plots UV-Vis absorption spectra based on Gaussian excited states calculations and Lorentzian functions.
Python
Plots UV-Vis absorption spectra based on Gaussian excited states calculations and Lorentzian functions.
Requirements: Python 3, matplotlib (https://github.com/matplotlib/matplotlib)
Usage:
python3 uvvis.py <file name> [fwhm]