Luminescence in crystalline organic materials: from molecules to molecular solids
Luminescent small, all‐organic molecules are of tremendous interest in materials and life
science applications. Nevertheless, targeted design requires a basic understanding of the …
science applications. Nevertheless, targeted design requires a basic understanding of the …
Quantum mechanical studies on the photophysics and the photochemistry of nucleic acids and nucleobases
The photophysics and photochemistry of DNA is of great importance due to the potential
damage of the genetic code by UV light. Quantum mechanical studies have played a key …
damage of the genetic code by UV light. Quantum mechanical studies have played a key …
Consideration of molecular structure in the excited state to design new luminogens with aggregation‐induced emission
K Kokado, K Sada - Angewandte Chemie, 2019 - Wiley Online Library
Aggregation‐induced emission (AIE) is a photoluminescence phenomenon in which an AIE
luminogen (AIEgen) exhibits intense emission in the aggregated or solid state but only weak …
luminogen (AIEgen) exhibits intense emission in the aggregated or solid state but only weak …
Exploring potential energy surfaces for aggregation‐induced emission—from solution to crystal
R Crespo‐Otero, Q Li… - Chemistry–An Asian …, 2019 - Wiley Online Library
Aggregation‐induced emission (AIE) is a phenomenon where non‐luminescent compounds
in solution become strongly luminescent in aggregate and solid phase. It provides a fertile …
in solution become strongly luminescent in aggregate and solid phase. It provides a fertile …
α-Cyanostilbene: a multifunctional spectral engineering motif
Aggregation-induced emission (AIE) is a unique photophysical phenomenon of organic
chromophores, exhibiting a significant emission enhancement in the condensed phase …
chromophores, exhibiting a significant emission enhancement in the condensed phase …
Restricted access to a conical intersection to explain aggregation induced emission in dimethyl tetraphenylsilole
XL Peng, S Ruiz-Barragan, ZS Li, QS Li… - Journal of Materials …, 2016 - pubs.rsc.org
The mechanism behind aggregation induced emission (AIE) in the prototypical dimethyl
tetraphenylsilole (DMTPS) molecule is investigated with ab initio calculations combining the …
tetraphenylsilole (DMTPS) molecule is investigated with ab initio calculations combining the …
Highly Twisted N,N-Dialkylamines as a Design Strategy to Tune Simple Aromatic Hydrocarbons as Steric Environment-Sensitive Fluorophores
The steric-environment sensitivity of fluorescence of 9, 10-bis (N, N-dialkylamino)
anthracenes (BDAA s) was studied experimentally and theoretically. A new design strategy …
anthracenes (BDAA s) was studied experimentally and theoretically. A new design strategy …
How does tetraphenylethylene relax from its excited states?
A Prlj, N Došlić, C Corminboeuf - Physical Chemistry Chemical Physics, 2016 - pubs.rsc.org
Tetraphenylethylene is a prototypical example of a molecule displaying aggregation-
induced emission. Despite many studies on the optical properties of TPE and its derivatives …
induced emission. Despite many studies on the optical properties of TPE and its derivatives …
Aggregation-caused quenching versus crystallization induced emission in thiazolo [5, 4-b] thieno [3, 2-e] pyridine (TTP) derivatives: theoretical insights
We report a QM (TD-DFT) and QM/QM′(ONIOM) study of the modulation of emission in a
series of thiazolo [5, 4, b] thieno [3, 2-e] pyridine (TTP) derivatives [Huang et al., J. Mater …
series of thiazolo [5, 4, b] thieno [3, 2-e] pyridine (TTP) derivatives [Huang et al., J. Mater …
Theoretical insights into luminescence mechanism of Naphthyridine-based thermally activated delayed fluorescence emitter with aggregation-induced emission
Q Zhang, Y Yang, Y Liu - Chemical Physics Letters, 2023 - Elsevier
The luminescent properties of Naphthyridine-based thermally activated delayed
fluorescence (TADF) emitter (CZ-ND) have been studied theoretically. The smaller energy …
fluorescence (TADF) emitter (CZ-ND) have been studied theoretically. The smaller energy …