P10/water - B3LYP/DZP/COSMO(80.1) E(P) -164774.3231997 E(P+) -164768.4612212 E(P-) -164777.1801840 E(P*) -164771.4434413 P10_2/water - B3LYP/DZP/COSMO(80.1) E(P) -164774.3330688 E(P+) -164768.4688264 E(P-) -164777.1862258 E(P*) -164771.4708417 P10/TEA - B3LYP/DZP/COSMO(2.3832) E(P) -164772.7347255 E(P+) -164766.3187454 E(P-) -164775.2074636 E(P*) -164769.8985037 P10_2/TEA - B3LYP/DZP/COSMO(2.3832) E(P) -164772.8471663 E(P+) -164766.4065517 E(P-) -164775.3564733 E(P*) -164770.0300851 COSMO energies neglect the outlying charge correction. Excited state energies were obtained by optimising the structures in vacuum followed by a single-point using COSMO