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 8
Agreement between (a) ECN- and (b) element-specific coordination matrices of the SNS and the experimentally determined structure in subdatasets with different numbers of cationic ECN sites.

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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