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Ad hoc diffractometer

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ad_hoc_diffractometer is a Python package that lets you describe any multi-circle diffractometer geometry and perform X-ray/neutron crystallography calculations.

See the Quick Start guide for a step-by-step walkthrough building an Eulerian four-circle geometry — choosing a coordinate basis, stage stacking, diffraction mode definition(s), and running a forward calculation. Common geometries are provided as examples.

Get started
Install the package and verify the installation.
User Guide
Concepts, how-to guides, and demonstration geometries.
About ...
Features, requirements, use cases, ...
References
All literature citations — geometry papers, physical constants, and numerical methods.

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Release files for ad-hoc-diffractometer 1.0.0rc1

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