Water at electrode-electrolyte interfaces : combining HOD vibrational spectra with ab initio-molecular dynamics simulations

Gunasekaran, PavithraDu, XianglongBurley, AndrewLe, JiaboCheng, JunCuesta, Angel2024-10-302024-10-302024-11-14Gunasekaran, P, Du, X, Burley, A, Le, J, Cheng, J & Cuesta, A 2024, 'Water at electrode-electrolyte interfaces : combining HOD vibrational spectra with ab initio-molecular dynamics simulations', Chemical Science, vol. 15, no. 42, pp. 17469-17480. https://doi.org/10.1039/D4SC04766D2041-6520crossref: 10.1039/D4SC04766DORCID: /0000-0003-4243-1848/work/168098472ORCID: /0009-0000-3115-3964/work/181759903https://hdl.handle.net/2164/24519121886870engSubstantive connection via eligible employment contractQD ChemistryQA75 Electronic computers. Computer scienceOtherRPG-2021-342Supplementary DataQDQA75Water at electrode-electrolyte interfaces : combining HOD vibrational spectra with ab initio-molecular dynamics simulationsJournal article10.1039/D4SC04766Dhttp://www.scopus.com/inward/record.url?scp=85205803735&partnerID=8YFLogxK1542