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Figure 1
Iterative cell optimization of Vie-1, an NdIII-based metal–organic framework (triclinic space group [P\bar{1}]): a, b, c axes, α, β, γ angles, R1 values, and Z scores. Z scores show the difference of the models after and before cell optimization with CELLOPT(C++). Negative values refer to a lower Z score after optimization and thus to an improvement of the geometry.

Journal logoJOURNAL OF
APPLIED
CRYSTALLOGRAPHY
ISSN: 1600-5767
Volume 55| Part 3| June 2022| Pages 647-655
https://doi.org/10.1107/S160057672200276X
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