Dynamics of excitons in conjugated molecules and organic semiconductor systems

OP Dimitriev - Chemical Reviews, 2022 - ACS Publications
The exciton, an excited electron–hole pair bound by Coulomb attraction, plays a key role in
photophysics of organic molecules and drives practically important phenomena such as …

Spin-vibronic mechanism for intersystem crossing

TJ Penfold, E Gindensperger, C Daniel… - Chemical …, 2018 - ACS Publications
Intersystem crossing (ISC), formally forbidden within nonrelativistic quantum theory, is the
mechanism by which a molecule changes its spin state. It plays an important role in the …

Spin–orbit coupling and intersystem crossing in molecules

CM Marian - Wiley Interdisciplinary Reviews: Computational …, 2012 - Wiley Online Library
Many light‐induced molecular processes involve a change in spin state and are formally
forbidden in non‐relativistic quantum theory. To make them happen, spin–orbit coupling …

A general method to describe intersystem crossing dynamics in trajectory surface hop**

S Mai, P Marquetand, L González - International Journal of …, 2015 - Wiley Online Library
Intersystem crossing is a radiationless process that can take place in a molecule irradiated
by UV‐Vis light, thereby playing an important role in many environmental, biological and …

Molecular photochemistry: recent developments in theory

S Mai, L González - Angewandte Chemie International Edition, 2020 - Wiley Online Library
Photochemistry is a fascinating branch of chemistry that is concerned with molecules and
light. However, the importance of simulating light‐induced processes is reflected also in …

[LIVRE][B] Highly efficient OLEDs: Materials based on thermally activated delayed fluorescence

H Yersin - 2019 - books.google.com
The essential resource that offers a comprehensive understanding of OLED optimizations
Highly Efficient OLEDs. Materials Based on Thermally Activated Delayed Fluorescence …

On predicting the excited-state properties of thermally activated delayed fluorescence emitters

TJ Penfold - The Journal of Physical Chemistry C, 2015 - ACS Publications
Limitations imposed by spin statistics governing exciton formation has meant that most
efficient organic light-emitting diodes (OLEDs) have relied upon complexes containing …

Phosphorescent carbon dots: Intermolecular interactions, properties, and applications

J Li, H Zhou, H Qiu, Y Yan, X Wang, Z Gao… - Coordination Chemistry …, 2024 - Elsevier
Room-temperature phosphorescence (RTP) materials show promising potential across
diverse domains. Carbon dots (CDs), as an emerging category of RTP materials, have …

Enhanced room‐temperature phosphorescence through intermolecular halogen/hydrogen bonding

L **ao, H Fu - Chemistry–A European Journal, 2019 - Wiley Online Library
Room‐temperature phosphorescence (RTP) materials with high efficiency have attracted
much attention because they have unique characteristics that cannot be realized in …

The excited state antiaromatic benzene ring: a molecular Mr Hyde?

R Papadakis, H Ottosson - Chemical Society Reviews, 2015 - pubs.rsc.org
The antiaromatic character of benzene in its first ππ* excited triplet state (T1) was deduced
more than four decades ago by Baird using perturbation molecular orbital (PMO) theory [J …