Tools for the scientific community

Scientific software.

Programs and libraries for diffraction, spectroscopy, and the properties of materials. Find an overview, documentation, and download links for each project.

Diffraction

Dioptas

Interactive diffraction analysis, from detector images and calibration to integrated patterns, maps, and phase identification.

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Equations of state

Peritheos

Equations of state, thermodynamic calculations, and a literature-based material catalogue, with Python and Rust interfaces.

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Total scattering

Glassure

Total-scattering analysis and pair distribution functions, with a Rust numerical core, Python workflows, and an experimental browser interface.

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Diffraction library

Dioptrin

Fast diffraction integration in Rust with a Python interface, from a single detector image to parallel file batches.

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Spectroscopy

T-Rax

Analysis of spectroscopic data from laser-heated diamond anvil cell experiments.

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Mössbauer spectroscopy

MossA

Fitting conventional and synchrotron energy-domain Mössbauer spectra.

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Electron spectroscopy

EELSA

Tools for analysing electron energy loss spectroscopy data.

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