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Figure 5
(a) The calculated energy frameworks, showing the total energy diagrams (Etot), (b) decomposition of the energy framework into the part corresponding to the inter­actions within a supra­molecular layer and (c) inter­layer inter­actions. In the table the corresponding colour-coded energy values Etot are provided, including their Eele, Epol, Edis, and Erep components. Tube size is set at 100 scale, the blue colour corresponds to the attractive inter­action, yellow to the repulsive inter­actions.

Journal logoCRYSTALLOGRAPHIC
COMMUNICATIONS
ISSN: 2056-9890
Volume 80| Part 11| November 2024| Pages 1235-1239
https://doi.org/10.1107/S2056989024010338
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