Fast and Accurate Determination of the Singlet–Triplet Gap in Donor–Acceptor and Multiresonance TADF Molecules by Using Hole–Hole Tamm–Dancoff Approximated Density Functional Theory

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Authors: Woon, Kai-Lin; Nikishau, Pavel A.; Sini, Gjergji

Journal title: Advanced Theory and Simulations

Journal number: 2

Journal publisher: Wiley

Published year: 2022

DOI identifier: 10.1002/adts.202200056

ISSN: 2513-0390