inscape: INtegrating with Single Crystal Adaptive Peak Envelopes
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Oct 10, 2023 - Python
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single-crystal-diffraction
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A Program for the Calculation of Effective One-Particle Potentials (OPPs)
cheminformatics crystallography powder-diffraction x-ray-diffraction probability-density-function neutron-diffraction single-crystal-diffraction one-particle-potential
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Aug 22, 2021 - Python
This is a Mathematica script to perform algebraic calculations of distances and angles between planes and directions in crystallography.
crystallography solid-state-physics powder-diffraction x-ray-diffraction polycrystal single-crystal-diffraction reciprocal-space crystalline-materials
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Updated
Jan 13, 2025 - Mathematica
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