Figure 3.
Ground‐state characteristics of 1PCTrz and various hosts. Displayed are contours of HOMOs and LUMOs and their energy levels. The HOMO energy levels of the hosts are all much lower than that of 1PCTrz, while the LUMO energy levels of the hosts are slightly shallower than that of 1PCTrz, except for that of mCBP, which is considerably higher.