XRD simulator
Project description
For each crystal, we consider 13 distinct conditions, categorized into three main aspects:
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- Sample-related factors: average grain size, orientation effects, extinction effects of symmetry, and deformation under internal stress.
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- Testing conditions: atomic thermal vibrations at room temperature, air scattering noise, and instrumental vibrations.
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- Diffractometer-related factors: Distance between the detector and sample, detector size, slit height, sample height, and angular zero shift.
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