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PNPD data analysis

Project description

CrysPy is a crystallographic python library for polarized neutron diffraction data analysis. The package allows the data treatment both for powders and single-crystal samples. Nuclear and (commensurate) magnetic structures refinement can be also perfomed based on the unpolarized neutron diffraction and X-ray diffraction data.

Features

  • CrysPy allows one to analyse the local magnetic anisotropy by the susceptibility approach and the spin/magnetization densities reconstruction by maximume entropy procedure based on polarized neutron diffraction experiments;
  • Core CIF dictionary of the IUCr is used to cover the requirements of archiving and exchanging the data and derived magnetic and structural results;
  • The library is written in Python. It can be used in Jupyter notebooks under the main platforms Windows, MacOSX and Linux or as a standalone application with a simple graphical user interface “CrysPy Editor”.

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Project details


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cryspy-0.6.5.tar.gz (1.3 MB view hashes)

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