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. 2020 Aug 13;11(37):10078–10091. doi: 10.1039/d0sc03665j

Absolute values of the intermolecular HOMO⋯HOMO interaction energies (|βHOMO–HOMO|, eV) for the (BEDT-TTF)3Ta2F10O salt.

Interaction (type) |βHOMO–HOMO| (eV)
I (A–A) 0.2320
II (A–B) 0.7385
III (A–A) 0.0403
IV (A–B) 0.0833
V (A–B) 0.0897