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Computational HOMO and LUMO energies (in Hartree) and energy gaps (LUMO-HOMO) for (A) Na[BMB] and (B) K[BMB] ion-pair complexes with anions of varied molecular chiralities. These computational results were obtained from DFT calculations at the B3LYP/6-311+G(d) level of theory with Grimme's-D3 dispersion correction.
