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research article

Electronic energy levels of aqueous hydroxyl species

Ambrosio, Francesco
•
Chen, Wei  
•
Pasquarello, Alfredo  
October 2, 2025
Physical Chemistry Chemical Physics

By properly describing the structural and electronic properties of aqueous hydroxyl species with advanced ab initio methods, the adiabatic and vertical energy levels associated with reduction and oxidation processes are accurately reproduced.

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Type
research article
DOI
10.1039/d5cp02299a
Author(s)
Ambrosio, Francesco
Chen, Wei  

École Polytechnique Fédérale de Lausanne

Pasquarello, Alfredo  

École Polytechnique Fédérale de Lausanne

Date Issued

2025-10-02

Publisher

Royal Society of Chemistry (RSC)

Published in
Physical Chemistry Chemical Physics
Editorial or Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
CSEA  
Available on Infoscience
October 20, 2025
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/255060
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