Continuous invariant-based asymmetries of periodic crystals quantify deviations from higher symmetry

Majumder, S.; Widdowson, D.; Elkin, Y.; Anosova, O.; Cooper, A.I.; Day, G.M.; Kurlin, V.A.

doi:10.1107/S2052252526002988

Figure 21
The histograms of $[\overline{{\rm CIA}}_{\infty}]$ for simulated crystals represented by three base points at `ends' of molecules in Fig. 2. Row 1: T0. Row 2: T1. Row 3: T2. Row 4: T2E.

IUCrJ

Volume 13| Part 4| July 2026|

ISSN: 2052-2525

https://doi.org/10.1107/S2052252526002988

MATERIALS | COMPUTATION

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