Using invariom modelling to distinguish correct and incorrect central atoms in `duplicate structures' with neighbouring 3d elements

Wandtke, C. M.; Weil, M.; Simpson, J.; Dittrich, B.

doi:10.1107/S2052520617010745

Acta Crystallographica Section B
Acta Crystallographica
Section B STRUCTURAL SCIENCE, CRYSTAL ENGINEERING AND MATERIALS

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Figure 6
Comparisons of R(F) values for the refinements of the different metal atoms with different EDD models against the two data sets of pairs (8) and (9).

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 73| Part 5| October 2017| Pages 794-804

https://doi.org/10.1107/S2052520617010745

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