Fig. 9. Comparison of the Qy–CT couplings in the (a) inter-chain and (b) intra-chain BChl dimers along the MD trajectory and for the crystal structures. The results of the previous work25 are marked as fOPT, whereas cOPT refers to the results of the constrained optimizations. Absolute values are shown (cm–1). Error bars indicate 95% confidence intervals.
