Understanding and rationalizing the structure of ionic solids by computational application of Beck's extended coordination number rule

Langer, N.; Kohlmann, H.

doi:10.1107/S2052520626001794

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

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Figure 2
Element- and ECN-specific coordination matrices for the crystal structure of SrFeF₅. In addition to the matrices, the sums of the rows (CNs of the anions) and the columns (CNs of the cations) as well as selected coordination environments represented by the notation are also shown.

STRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS

ISSN: 2052-5206

Volume 82| Part 2| April 2026| Pages 224-236

https://doi.org/10.1107/S2052520626001794

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