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34.4: Invited Paper : Combinatorial Design of OLED‐Emitting Materials
Author(s) -
AspuruGuzik Alán,
Adams Ryan,
Baldo Marc,
AguileraIparraguirre Jorge,
GómezBombarelli Rafael
Publication year - 2015
Publication title -
sid symposium digest of technical papers
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.351
H-Index - 44
eISSN - 2168-0159
pISSN - 0097-966X
DOI - 10.1002/sdtp.10444
Subject(s) - oled , exploit , computer science , fluorescence , acceptor , state (computer science) , materials science , theoretical computer science , nanotechnology , algorithm , physics , quantum mechanics , computer security , layer (electronics)
We report the first results from a combinatorial design effort focused on new OLED emitters that exploit thermally‐activated delayed fluorescence. Using quantum chemistry and machine learning techniques to prune a pool of over 400,000 combinations of donor and acceptor subgroups, we demonstrate new dyes that are state‐of‐the‐art, yet entirely computationally‐derived.