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Figure 20
(a) Relative energy (kJ mol−1) with respect to the average structure as a function of the modulation parameter (t) for compound 1. (b) Superimposed geometries of compound 1 corresponding to the energy maximum (yellow) and the average structure (gray). (c) Relative energy (kJ mol−1) with respect to the average structure as a function of t for compound 2. (d) Superimposed geometries of compound 2 corresponding to the energy maximum (yellow) and the average structure (gray).

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
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