Theoretical modelling of the Hydrogen evolution reaction on MXenes: A critical review

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dc.contributor.authorMeng, Ling
dc.contributor.authorViñes Solana, Francesc
dc.contributor.authorIllas i Riera, Francesc
dc.date.accessioned2025-03-13T16:45:05Z
dc.date.available2025-03-13T16:45:05Z
dc.date.issued2023-06-07
dc.date.updated2025-03-13T16:45:06Z
dc.description.abstractMXenes, two-dimensional (2D) transition-metal carbides and nitrides with diverse compositions and structures, have attracted notable attention due to their potential as promising alternatives to the conventional Pt-group catalysts for the hydrogen evolution reaction (HER). Hereby, we analyze the state-of-art approaches in theoretical modelling HER in MXenes with the aim of assessing their intrinsic activity for this crucial electrocatalytic reaction, analyze diverse thermodynamic and electronic properties proposed as descriptors, inspect kinetic aspects, and explore linear scaling relations. Ultimately, we present an overview of the challenges, perspectives, and future research of HER in MXenes.
dc.format.extent7 p.
dc.format.mimetypeapplication/pdf
dc.identifier.idgrec738221
dc.identifier.issn2451-9103
dc.identifier.urihttps://hdl.handle.net/2445/219699
dc.language.isoeng
dc.publisherElsevier B.V.
dc.relation.isformatofReproducció del document publicat a: https://doi.org/10.1016/j.coelec.2023.101332
dc.relation.ispartofCurrent Opinion In Electrochemistry, 2023, vol. 40, p. 101332
dc.relation.urihttps://doi.org/10.1016/j.coelec.2023.101332
dc.rightscc-by-nc-nd (c) Meng, Ling, et al., 2023
dc.rights.accessRightsinfo:eu-repo/semantics/openAccess
dc.rights.urihttp://creativecommons.org/licenses/by-nc-nd/4.0/
dc.sourceArticles publicats en revistes (Ciència dels Materials i Química Física)
dc.subject.classificationNitrurs
dc.subject.classificationHidrogen
dc.subject.classificationElectrocatàlisi
dc.subject.otherNitrides
dc.subject.otherHydrogen
dc.subject.otherElectrocatalysis
dc.titleTheoretical modelling of the Hydrogen evolution reaction on MXenes: A critical review
dc.typeinfo:eu-repo/semantics/article
dc.typeinfo:eu-repo/semantics/publishedVersion

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