Dans_Diffraction
Python package that reads crystal structures from CIFs and simulates diffraction patterns. Data are included for calculation of x-ray and neutron structure factors. Single crystal and powder plots can be generated quickly and easily by either a basic GUI or a command line approach.
On the command line, a crystal Object is created with structure properties imported from the CIF, which are editable. The object has many useful attributes including plotting and scattering simulations.
Dans_Diffraction is available from PyPi:
pip install Dans_Diffraction
or Github:
git clone https://github.com/DanPorter/Dans_Diffraction.git
On the command line, a crystal Object is created with structure properties imported from the CIF, which are editable. The object has many useful attributes including plotting and scattering simulations.
Dans_Diffraction is available from PyPi:
pip install Dans_Diffraction
or Github:
git clone https://github.com/DanPorter/Dans_Diffraction.git