A Facile Strategy to Achieve Large Triplet Gap Based on Excited-State Aromaticity-tunable Five-memebered Ring

29 April 2021, Version 1
This content is a preprint and has not undergone peer review at the time of posting.

Abstract

We have proposed a facile strategy to achieve large triple gap by manipulating the aromaticity and the transition properties of the low-lying excited states, then theoretically designed and experimentally verified a series of donor-bridge-acceptor based on partially conjugated five-membered rings with high aromaticity in T1 state to meet the harsh energy conditions required for hot exciton materials and for singlet fission materials.

Keywords

Quantum Chemistry calculation
Ultrafast spectroscopy
Singlet Fission
Hot exciton

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