Logo do repositório
 
Publicação

Correction

dc.contributor.authorMendes, Mónica
dc.contributor.authorAmeixa, João
dc.contributor.authorRodrigues, Rodrigo
dc.contributor.authorSequeira, Diogo
dc.contributor.authorJones, Nykola C.
dc.contributor.authorHoffmann, Søren V.
dc.contributor.authorBarbosa, Alessandra Souza
dc.contributor.authorda Silva, Filipe Ferreira
dc.contributor.institutionCeFITec – Centro de Física e Investigação Tecnológica
dc.contributor.institutionDF – Departamento de Física
dc.contributor.pblRSC - Royal Society of Chemistry
dc.date.accessioned2026-08-18T09:59:01Z
dc.date.available2026-08-18T09:59:01Z
dc.date.issued2026-06-03
dc.descriptionPublisher Copyright: This journal is © the Owner Societies, 2026.
dc.description.abstractThe authors wish to clarify and acknowledge the context of previously published work relevant to this study. In particular, the work by Garcia et al. (Sci. Adv., 2022, 8, eadd4614), cited in the original article, not only reports vacuum ultraviolet circular dichroism measurements of propylene oxide but also includes time-dependent density functional theory calculations of its electronic excited states, in particular vertical excitation energies and rotatory strengths. The present work focuses on high-resolution VUV photoabsorption cross sections over an extended energy range and provides a more detailed characterization of the excited states based on TDDFT calculations, including excitation energies, oscillator strengths, and assignments derived from natural transition orbital (NTO) analysis. In addition, the evolution of the excited-state character along selected nuclear coordinates is explored, revealing Rydberg–valence mixing effects. The authors acknowledge that the relationship between these studies could have been more clearly stated in the original manuscript and regret any lack of clarity in this regard. The Royal Society of Chemistry apologises for these errors and any consequent inconvenience to authors and readers.en
dc.description.versionpublishersversion
dc.description.versionpublished
dc.format.extent1
dc.format.extent510573
dc.identifier.doi10.1039/d6cp90081j
dc.identifier.issn1463-9076
dc.identifier.otherPURE: 166644283
dc.identifier.otherPURE UUID: 1e307100-c465-46fc-bba2-d1e7bd011f4f
dc.identifier.otherScopus: 105041245376
dc.identifier.otherPubMed: 42132896
dc.identifier.otherORCID: /0000-0002-2182-2965/work/224221556
dc.identifier.urihttp://hdl.handle.net/10362/205456
dc.identifier.urlhttps://www.scopus.com/pages/publications/105041245376
dc.language.isoeng
dc.peerreviewedyes
dc.subjectGeneral Physics and Astronomy
dc.subjectPhysical and Theoretical Chemistry
dc.titleCorrectionen
dc.title.subtitleProbing the photoabsorption features and electronic excited states of propylene oxide: an experimental and theoretical studyen
dc.typeother
degois.publication.firstPage
degois.publication.issue21
degois.publication.lastPage
degois.publication.titlePhysical Chemistry Chemical Physics
degois.publication.volume28
dspace.entity.typePublication
rcaap.rightsopenAccess

Ficheiros