The Ir(ppy)3 complex was studied by dissociative electron attachment spectroscopy (DEAS). Measurements of the lifetime of the molecular anion allowed estimation of electron affinity in the range of EALT = 0.82–0.94 eV at 465–515 K, while calculations in the density functional theory (DFT) approximation predict an underestimated value of 0.33 eV. The results are discussed in comparison with the previously studied Alq3 complex, for which EALT lies in the range of 0.9–1.02 eV determined by DEAS and molecular ion photoelectron spectroscopy, which is in good agreement with the calculated value obtained by DFT.
Asfandiarov et al. (Sun,) studied this question.