Dispersion forces drive water oxidation in molecular ruthenium catalysts.


Journal

RSC advances
ISSN: 2046-2069
Titre abrégé: RSC Adv
Pays: England
ID NLM: 101581657

Informations de publication

Date de publication:
21 Dec 2020
Historique:
received: 22 10 2020
accepted: 01 12 2020
entrez: 15 4 2022
pubmed: 23 12 2020
medline: 23 12 2020
Statut: epublish

Résumé

Rational design of artificial water-splitting catalysts is central for developing new sustainable energy technology. However, the catalytic efficiency of the natural light-driven water-splitting enzyme, photosystem II, has been remarkably difficult to achieve artificially. Here we study the molecular mechanism of ruthenium-based molecular catalysts by integrating quantum chemical calculations with inorganic synthesis and functional studies. By employing correlated

Identifiants

pubmed: 35423068
doi: 10.1039/d0ra09004b
pii: d0ra09004b
pmc: PMC8691110
doi:

Types de publication

Journal Article

Langues

eng

Pagination

425-432

Informations de copyright

This journal is © The Royal Society of Chemistry.

Déclaration de conflit d'intérêts

There are no conflicts to declare.

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Auteurs

Mikael P Johansson (MP)

Department of Chemistry, University of Helsinki P.O. Box 55 FI-00014 Helsinki Finland.
Department of Chemistry, Technical University of Munich (TUM) Lichtenbergstraße 4 Garching D-85747 Germany corinna.hess@ch.tum.de.
Helsinki Institute of Sustainability Science (Helsus) FI-00014 Helsinki Finland.
CSC-IT Center for Science P.O. Box 405 FI-02101 Espoo Finland.

Lukas Niederegger (L)

Department of Chemistry, Technical University of Munich (TUM) Lichtenbergstraße 4 Garching D-85747 Germany corinna.hess@ch.tum.de.

Markus Rauhalahti (M)

Department of Chemistry, University of Helsinki P.O. Box 55 FI-00014 Helsinki Finland.

Corinna R Hess (CR)

Department of Chemistry, Technical University of Munich (TUM) Lichtenbergstraße 4 Garching D-85747 Germany corinna.hess@ch.tum.de.

Ville R I Kaila (VRI)

Department of Chemistry, Technical University of Munich (TUM) Lichtenbergstraße 4 Garching D-85747 Germany corinna.hess@ch.tum.de.
Department of Biochemistry and Biophysics, Stockholm University Stockholm Sweden ville.kaila@dbb.su.se.

Classifications MeSH