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- Wang, Chao; Zhang, Qisheng
- Journal of physical chemistry 2018 v.123 no.7 pp. 4407-4416
- absorption; energy; fluorescence; ionization; light emitting diodes; models; prediction
- ... An efficient computational protocol suitable for both solutions and solid films can accelerate the development of efficient thermally activated delayed fluorescence (TADF) emitters aimed at practical application in organic light-emitting diodes (OLEDs). By employing the localized orbital locator (LOL), we establish an efficient descriptor-tuning methodology for the range-separated (RS) and screene ...