Tutorials

• Theoretical EPR spectrum
  • System
  • Starting a new project
  • Create a model
  • Optimize the model
  • Create radical models
  • Compute the g-values
  • Compute the spectra
  • Postprocessing
  • Summarize your results
  • Fit
• Quantifying the quality of a Fitting
  • Best fitting of a function as a linear combination of another
  • Fitting a function that matches only part of another
  • Why error and correlation?

The fitting tutorial shows how eproducer.best_fit.TheoMatchExpe fits a spectrum with others, how the shift of the field and the field range improve the fit, and why both the error and the correlation are reported. It is a Jupyter notebook: to run it, download it together with its data files into the same directory and open it with Jupyter.

• tutorial_EPRfitter.ipynb

• spectrum1.dat

• spectrum2.dat

• shifted-spectrum2.dat