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Figure 7
Frameworks of the total energy, with a tube size of 80 and a low-energy cut-off of 10 kJ mol−1. Parts (a) to (e) show the F, Cl, Br, py and I variants, respectively; the upper row is before and the lower row is after the transition. H atoms have been omitted for clarity. |
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menu![[Figure 7]](op3042fig7.jpg)