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dc.contributor.authorMalola, Sami
dc.contributor.authorHäkkinen, Hannu
dc.date.accessioned2024-03-14T12:58:51Z
dc.date.available2024-03-14T12:58:51Z
dc.date.issued2024
dc.identifier.citationMalola, S., & Häkkinen, H. (2024). On transient absorption and dual emission of the atomically precise, DNA-stabilized silver nanocluster Ag16Cl2. <i>Chemical Communications</i>, <i>60</i>(24), 3315-3318. <a href="https://doi.org/10.1039/d3cc06085c" target="_blank">https://doi.org/10.1039/d3cc06085c</a>
dc.identifier.otherCONVID_207496778
dc.identifier.urihttps://jyx.jyu.fi/handle/123456789/93909
dc.description.abstractDNA-stabilized silver nanoclusters with 10 to 30 silver atoms are interesting biocompatible nanomaterials with intriguing fluorescence properties. However, they are not well understood, since atom-scale high level theoretical calculations have not been possible due to a lack of firm experimental structural information. Here, by using density functional theory (DFT), we study the recently atomically resolved (DNA)2–Ag16Cl2 nanocluster in solvent under the lowest-lying singlet (S1) and triplet (T1) excited states, estimate the relative emission maxima for the allowed (S1 - S0) and dark (T1 - S0) transitions, and evaluate the transient absorption spectra. Our results offer a potential interpretation of the recently reported transient absorption and dual emission of similar DNA-stabilized silver nanoclusters, providing a mechanistic view on their photophysical properties that are attractive for applications in biomedical imaging and biophotonics.en
dc.format.mimetypeapplication/pdf
dc.language.isoeng
dc.publisherRoyal Society of Chemistry
dc.relation.ispartofseriesChemical Communications
dc.rightsCC BY 3.0
dc.titleOn transient absorption and dual emission of the atomically precise, DNA-stabilized silver nanocluster Ag16Cl2
dc.typearticle
dc.identifier.urnURN:NBN:fi:jyu-202403142423
dc.contributor.laitosFysiikan laitosfi
dc.contributor.laitosKemian laitosfi
dc.contributor.laitosDepartment of Physicsen
dc.contributor.laitosDepartment of Chemistryen
dc.contributor.oppiaineNanoscience Centerfi
dc.contributor.oppiaineNanoscience Centeren
dc.type.urihttp://purl.org/eprint/type/JournalArticle
dc.type.coarhttp://purl.org/coar/resource_type/c_2df8fbb1
dc.description.reviewstatuspeerReviewed
dc.format.pagerange3315-3318
dc.relation.issn1359-7345
dc.relation.numberinseries24
dc.relation.volume60
dc.type.versionpublishedVersion
dc.rights.copyright© 2024 The Royal Society of Chemistry
dc.rights.accesslevelopenAccessfi
dc.relation.grantnumber355083
dc.subject.ysonanohiukkaset
dc.subject.ysofluoresenssi
dc.subject.ysoemissio (fysiikka)
dc.subject.ysohopea
dc.format.contentfulltext
jyx.subject.urihttp://www.yso.fi/onto/yso/p23451
jyx.subject.urihttp://www.yso.fi/onto/yso/p3265
jyx.subject.urihttp://www.yso.fi/onto/yso/p4149
jyx.subject.urihttp://www.yso.fi/onto/yso/p7409
dc.rights.urlhttps://creativecommons.org/licenses/by/3.0/
dc.relation.doi10.1039/d3cc06085c
dc.relation.funderResearch Council of Finlanden
dc.relation.funderSuomen Akatemiafi
jyx.fundingprogramAcademy Project, AoFen
jyx.fundingprogramAkatemiahanke, SAfi
jyx.fundinginformationThis work was supported by the Academy of Finland (grant 355083). The computations were made at the Finnish national supercomputing center CSC (computing grant 2002721).
dc.type.okmA1


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