Principles of aggregation‐induced emission: design of deactivation pathways for advanced AIEgens and applications

S Suzuki, S Sasaki, AS Sairi, R Iwai… - Angewandte Chemie …, 2020‏ - Wiley Online Library
Twenty years ago, the concept of aggregation‐induced emission (AIE) was proposed, and
this unique luminescent property has attracted scientific interest ever since. However, AIE …

Ultrafast excited-state dynamics in nucleic acids

CE Crespo-Hernández, B Cohen, PM Hare… - Chemical …, 2004‏ - ACS Publications
The scope of this review is the nature and dynamics of the singlet excited electronic states
created in nucleic acids and their constituents by UV light. Interest in the UV photochemistry …

Excited-state hydrogen detachment and hydrogen transfer driven by repulsive 1 πσ* states: A new paradigm for nonradiative decay in aromatic biomolecules

AL Sobolewski, W Domcke… - Physical Chemistry …, 2002‏ - pubs.rsc.org
The combined results of ab initio electronic-structure calculations and spectroscopic
investigations of jet-cooled molecules and clusters provide strong evidence of a surprisingly …

Diabatic states of molecules

Y Shu, Z Varga, S Kanchanakungwankul… - The Journal of …, 2022‏ - ACS Publications
Quantitative simulations of electronically nonadiabatic molecular processes require both
accurate dynamics algorithms and accurate electronic structure information. Direct …

Modern aspects of the Jahn− Teller effect theory and applications to molecular problems

IB Bersuker - Chemical reviews, 2001‏ - ACS Publications
I begin this review with a statement that the socalled Jahn-Teller (JT) effect (hereafter JTE),
pseudo-JTE (PJTE), and Renner-Teller effect (RTE), jointly JT vibronic coupling effects, are …

πσ* excited states in molecular photochemistry

MNR Ashfold, GA King, D Murdock, MGD Nix… - Physical Chemistry …, 2010‏ - pubs.rsc.org
The last few years have seen a surge in interest (both theoretical and experimental) in the
photochemistry of heteroaromatic molecules (eg azoles, phenols), which has served to …

Ultrafast dynamics in isolated molecules and molecular clusters

IV Hertel, W Radloff - Reports on Progress in Physics, 2006‏ - iopscience.iop.org
Ultrafast dynamics in isolated molecules and molecular clusters - IOPscience Skip to
content IOP Science home Accessibility Help Search Journals Journals list Browse more …

What leads to aggregation-induced emission?

J Guan, C Shen, J Peng, J Zheng - The Journal of Physical …, 2021‏ - ACS Publications
Aggregation-induced emission (AIE), usually referring to the phenomenon in which
molecules emit more strongly in the aggregate state than in the solution state, is intriguing …

[HTML][HTML] Photochemistry of aryl halides: Photodissociation dynamics

KL Han, GZ He - Journal of Photochemistry and Photobiology C …, 2007‏ - Elsevier
In recent years, the photodissociation dynamics of aryl halides has been a subject of
intensive studies, which is closely related to the atmospheric chemistry. Here we present a …

[HTML][HTML] Ab initio quantum direct dynamics simulations of ultrafast photochemistry with Multiconfigurational Ehrenfest approach

DV Makhov, C Symonds, S Fernandez-Alberti… - Chemical Physics, 2017‏ - Elsevier
Abstract The Multiconfigurational Ehrenfest (MCE) method is a quantum dynamics technique
which allows treatment of a large number of quantum nuclear degrees of freedom. This …