Overlap-driven splitting of triplet pairs in singlet fission

EJ Taffet, D Beljonne, GD Scholes - Journal of the American …, 2020 - ACS Publications
We analyze correlated-triplet-pair (TT) singlet-fission intermediates toward two-triplet
separation (T... T) using spin-state-averaged density matrix renormalization group electronic …

Combined Multireference–Multiscale Approach to the Description of Photosynthetic Reaction Centers

M Drosou, S Bhattacharjee… - Journal of Chemical …, 2024 - ACS Publications
A first-principles description of the primary photochemical processes that drive
photosynthesis and sustain life on our planet remains one of the grand challenges of …

[HTML][HTML] Optical projection and spatial separation of spin-entangled triplet pairs from the s1 (21 ag–) state of pi-conjugated systems

R Pandya, Q Gu, A Cheminal, RYS Chen, EP Booker… - Chem, 2020 - cell.com
Summary The S 1 (2 1 A g–) state is an optically dark state of natural and synthetic pi-
conjugated materials that plays a role in optoelectronic processes, such as energy …

Twisted carotenoids do not support efficient intramolecular singlet fission in the orange carotenoid protein

GA Sutherland, JP Pidgeon, HKH Lee… - The Journal of …, 2023 - ACS Publications
Singlet exciton fission is the spin-allowed generation of two triplet electronic excited states
from a singlet state. Intramolecular singlet fission has been suggested to occur on individual …

Impact of Fluctuations in the Peridinin-Chlorophyll a-Protein on the Energy Transfer: Insights from Classical and QM/MM Molecular Dynamics Simulations

M Sokolov, Q Cui - Biochemistry, 2025 - ACS Publications
The peridinin-chlorophyll a-protein is a light-harvesting complex found in dinoflagellates,
which has an unusually high fraction of carotenoids. The carotenoids are directly involved in …

Observation of Dark States in Two-Dimensional Electronic Spectra of Chlorosomes

V Erić, X Li, L Dsouza, A Huijser… - The Journal of …, 2024 - ACS Publications
Observations of low-lying dark states in several photosynthetic complexes challenge our
understanding of the mechanisms behind their efficient energy transfer processes …

The origin of the red shift of Qy band of chlorophylls d and f

VV Poddubnyy, MI Kozlov, IO Glebov - Chemical Physics Letters, 2021 - Elsevier
The key components of the far-red-light forms of PSI and PSII are chlorophylls d and f which
are able to absorb this light contrary to chlorophyll a. The aim of this work is to reveal the …

Investigating the photophysics of new and stable singlet fission materials

P Budden - 2021 - repository.cam.ac.uk
In this thesis, we describe our investigations into the mechanism of singlet exciton fission,
examining the effects of morphology, aromaticity, and photoluminescence yield on the …