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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. |
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