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@ -5,3 +5,4 @@ git repo for PyCharm project of the AMM course
exspectrum_plotter exspectrum_plotter
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Python function for creating plots of excitation spectra calculated by the **Turbomole** function *escf*. Python function for creating plots of excitation spectra calculated by the **Turbomole** function *escf*.
It requires the packages *numpy*, *pandas*, *matplotlib* and *pathlib*.