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Modeling metal-ligand bonds – from ground to excited states

dc.creatorZlatar, Matija
dc.date.accessioned2022-06-12T10:43:47Z
dc.date.available2022-06-12T10:43:47Z
dc.date.issued2022
dc.identifier.urihttps://cer.ihtm.bg.ac.rs/handle/123456789/5078
dc.description.abstractIn this talk, our efforts in understanding and controlling metal-ligand bonding will be presented, mainly based on the density functional calculations. The influence of the excited states on the electronic ground state and the impact of the ground electronic state on the fate of excited states will be emphasized.sr
dc.language.isoensr
dc.publisherFrankfurt, Germany : MBN Research Center gGmbHsr
dc.relationinfo:eu-repo/grantAgreement/ScienceFundRS/Ideje/7750288/RS//sr
dc.relationinfo:eu-repo/grantAgreement/MESTD/inst-2020/200026/RS//sr
dc.relationCOST Action CA20129 MultIChem (Multiscale Irradiation and Chemistry Driven Processes and Related Technologies)sr
dc.relation.isreferencedbyhttps://cer.ihtm.bg.ac.rs/handle/123456789/5668
dc.rightsopenAccesssr
dc.rights.urihttps://creativecommons.org/licenses/by/4.0/
dc.sourceBook of abstracts - 1st International Conference "Multiscale Irradiation and Chemistry Driven Processes and Related Technologies" (MultIChem 2022), Boppard am Rhein, Germany, 16-18 May, 2022sr
dc.subjectDFTsr
dc.subjectcoordination chemistrysr
dc.subjectmetal-ligand bondingsr
dc.subjectchemical bondingsr
dc.subjectenergy decomposition analysissr
dc.subjectexcited statessr
dc.subjectTDDFTsr
dc.subjectdissociationsr
dc.subjectneutral dissociationsr
dc.subjectirradiation chemistrysr
dc.titleModeling metal-ligand bonds – from ground to excited statessr
dc.typeconferenceObjectsr
dc.rights.licenseBYsr
dc.rights.holderTMMagCatsr
dc.citation.spage44
dc.description.otherPresentation: [https://cer.ihtm.bg.ac.rs/handle/123456789/5668]
dc.identifier.rcubhttps://hdl.handle.net/21.15107/rcub_cer_5078
dc.identifier.fulltexthttp://cer.ihtm.bg.ac.rs/bitstream/id/22189/MutIChem2022_program_abstract_MZlatar.pdf
dc.type.versionpublishedVersionsr


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