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0.0.2a0

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released this 21 Jun 10:01
· 1 commit to main since this release

Version 0.0.2-alpha

First version of the library implementing Gaussian fitting, peak_search and updated plotting functions.

Changelog summary:

  • Added new features to the UVVisSpectrum class:
    • Added wavenumber and electrovolt properties to rescale plots according to wavenumber and energies.
    • Added peak_search function.
  • Added new options to the plot_spectrum function:
    • Added option to select different units for the x-axis.
    • Added option to integrate peak search labels.
  • Early implementation of the FittingEngine class to perform gaussian fitting with baseline of a UVVisSpectrum object.
  • Update to documentation and tests (to be improved in the beta version).