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Figure 3
The relative frequency distribution of the deviations between the fitted lattice parameter calculated with equation (3)[link] and the lattice parameter derived using CALM. Considered are 99 elements and 249 compounds. The application of Zmax instead of [{\overline Z}] generates slightly higher predicted offsets, cf. the grey bar at 0.6%.

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 56| Part 2| April 2023| Pages 361-366
https://doi.org/10.1107/S1600576723000146
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