Reaction Center Excitation in Photosystem II: From Multiscale Modeling to Functional Principles

A Sirohiwal, DA Pantazis - Accounts of Chemical Research, 2023 - ACS Publications
Conspectus Oxygenic photosynthesis is the fundamental energy-converting process that
utilizes sunlight to generate molecular oxygen and the organic compounds that sustain life …

Quasiparticle Self-Consistent GW-Bethe–Salpeter Equation Calculations for Large Chromophoric Systems

A Förster, L Visscher - Journal of chemical theory and …, 2022 - ACS Publications
The GW-Bethe–Salpeter equation (BSE) method is promising for calculating the low-lying
excitonic states of molecular systems. However, so far it has only been applied to rather …

Excimer evolution hampers symmetry-broken charge-separated states

E Sebastian, J Sunny, M Hariharan - Chemical Science, 2022 - pubs.rsc.org
Achieving long-lived symmetry-broken charge-separated states in chromophoric assemblies
is quintessential for enhanced performance of artificial photosynthetic mimics. However, the …

Alternative Fast and Slow Primary Charge‐Separation Pathways in Photosystem II

M Capone, A Sirohiwal, M Aschi… - Angewandte Chemie …, 2023 - Wiley Online Library
Photosystem‐II (PSII) is a multi‐subunit protein complex that harvests sunlight to perform
oxygenic photosynthesis. Initial light‐activated charge separation takes place at a reaction …

Charge-transfer states in photosynthesis and organic solar cells

J Hustings, R Bonné, R Cornelissen, F Morini… - Frontiers in …, 2022 - frontiersin.org
Light-induced charge-transfer mechanisms are at the heart of both photosynthesis and
photovoltaics. The underlying photophysical mechanisms occurring within photosynthesis …

The electronic origin of far‐red‐light‐driven oxygenic photosynthesis

A Sirohiwal, DA Pantazis - Angewandte Chemie International …, 2022 - Wiley Online Library
Photosystem‐II uses sunlight to trigger charge separation and catalyze water oxidation.
Intrinsic properties of chlorophyll a pigments define a natural “red limit” of photosynthesis …

Triplet states in the reaction center of Photosystem II

S Bhattacharjee, F Neese, DA Pantazis - Chemical Science, 2023 - pubs.rsc.org
In oxygenic photosynthesis sunlight is harvested and funneled as excitation energy into the
reaction center (RC) of Photosystem II (PSII), the site of primary charge separation that …

Exploring the statically screened correction to the self-energy: Charged excitations and total energies of finite systems

A Förster, L Visscher - Physical Review B, 2022 - APS
Electron correlation in finite and extended systems is often described in an effective single-
particle framework within the GW approximation. Here, we use the statically screened …

Superexchange electron transfer and protein matrix in the charge-separation process of photosynthetic reaction centers

K Saito, H Tamura, H Ishikita - The Journal of Physical Chemistry …, 2024 - ACS Publications
In type-II reaction centers, such as photosystem II (PSII) and reaction centers from purple
bacteria (PbRC), light-induced charge separation involves electron transfer from pheophytin …

The initial charge separation step in oxygenic photosynthesis

Y Yoneda, EA Arsenault, SJ Yang, K Orcutt… - Nature …, 2022 - nature.com
Photosystem II is crucial for life on Earth as it provides oxygen as a result of photoinduced
electron transfer and water splitting reactions. The excited state dynamics of the …