Research data supporting "Unveiling the interaction mechanisms of electron and X-ray radiation with halide perovskite semiconductors using scanning nano-probe diffraction"
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The original data files for SED are found in the data folder. Each diffraction file can be opened using Python with some additional open-source packages (mainly pyXem).
The nXRD and sXRD files are found in the data folder. They can be opened using Python (using hyperSpy).
In the models folder, documents for modelling and simulations are stored. In the casino_sim there are the CASINO simulation for the electron beam interaction volume. In the cross_sections there are the calculations for the scattering cross sections. In the crystal_structures there are the collections of .cif files with the crystal structures of interest and the diffraction simulations that can be opened using the CrystalMaker software. In the space_radiation folder there are the SPENVIS simulation files.
In the notebooks folder, all the Jupyter Notebook files are stored for the data analysis and data plotting of all the data files. In order to reproduce the results, please use the requirements.txt file to create an Anaconda virtual environment with all the necessary Python packages.
