Table 2. Electronic Coupling (V_ji), Reorganization Energy (λ_e), Driving Force (ΔG), Activation Energy (E_r), and Constant Rates (s^–1) According to Marcus Theory fmor (j → i) Electronic Transitions for the Molecular Complexes BDP-Is, BDP-Pyr, B2-Is, and B2-Pyr in Ethanol.

molecule	i → j	|Vji| (meV)	λe (eV)	ΔG (eV)	Er (eV)	κe (s–1)
BDP-Is	|ψD⟩ → |ψA1⟩	7.36	0.1347	–0.5096	0.2609	1.0212 × 1008
	|ψD⟩ → |ψA2⟩	25.17	0.1347	–0.3179	0.0623	2.5945 × 1012
	|ψD⟩ → |ψA3⟩	4.17	0.1347	0.0851	0.0897	2.4735 × 1010
BDP-Pyr	|ψD⟩ → |ψA1⟩	29.33	0.1356	–0.5245	0.2788	8.0932 × 1008
	|ψD⟩ → |ψA2⟩	6.22	0.1356	–0.4399	0.1707	2.3846 × 1009
	|ψD⟩ → |ψA3⟩	19.01	0.1356	–0.2448	0.0220	7.0189 × 1012
B2-Is	|ψD⟩ → |ψA1⟩	4.87	0.1332	–0.2785	0.0396	2.3546 × 1011
	|ψD⟩ → |ψA2⟩	12.04	0.1332	–0.1988	0.0081	4.8650 × 1012
	|ψD⟩ → |ψA3⟩	1.41	0.1332	0.0436	0.0586	9.3726 × 1009
	|ψD⟩ → |ψA4⟩	1.16	0.1332	0.1036	0.1052	1,0618 × 1009
	|ψD⟩ → |ψA5⟩	2.87	0.1332	0.1837	0.1884	2.5744 × 1008
B2-Pyr	|ψD⟩ → |ψA1⟩	3.70	0.1358	–0.2159	0.0118	3.9816 × 1011
	|ψD⟩ → |ψA2⟩	6.20	0.1358	–0.1108	0.0011	1.6507 × 1012
	|ψD⟩ → |ψA3⟩	1.50	0.1358	0.1366	0.1366	5.3790 × 1008
	|ψD⟩ → |ψA4⟩	1.90	0.1358	0.1723	0.1748	1.9255 × 1008
	|ψD⟩ → |ψA5⟩	3.00	0.1358	0.2763	0.3127	2.2841 × 1006