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Icosahedral Clusters [In@Tr12]10–: Synthesis, Characterization, and Electronic Structure Investigations of Na4A6Tr13 (A = Rb, Cs; Tr = In, Tl)
Janesch, Melissa, Karttunen, Antti J. und Gärtner, Stefanie
(2025)
Icosahedral Clusters [In@Tr12]10–: Synthesis, Characterization, and Electronic Structure Investigations of Na4A6Tr13 (A = Rb, Cs; Tr = In, Tl).
European Journal of Inorganic Chemistry.
Veröffentlichungsdatum dieses Volltextes: 18 Sep 2025 05:32
Artikel
DOI zum Zitieren dieses Dokuments: 10.5283/epub.77757
Zusammenfassung
While thallium forms several clusters in alkali metal thallides, indium clusters in related alkali metal indides are very rare. Here the mixing of the heavy trielides indium and thallium to approximate icosahedral entities present in Na4A6Tr13 (A = K, Rb, Cs; Tr = In, Tl) is reported. Experimental results prove that at least up to 76% indium can be introduced in this structure type. From the ...
While thallium forms several clusters in alkali metal thallides, indium clusters in related alkali metal indides are very rare. Here the mixing of the heavy trielides indium and thallium to approximate icosahedral entities present in Na4A6Tr13 (A = K, Rb, Cs; Tr = In, Tl) is reported. Experimental results prove that at least up to 76% indium can be introduced in this structure type. From the moment indium is provided, the central atom of the icosahedral unit changes from thallium to indium, while the vertices of the cluster are mixed occupied by both, thallium and indium. The bonding and energetics of the compounds are investigated with quantum chemical methods.
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| Dokumentenart | Artikel | ||||
| Titel eines Journals oder einer Zeitschrift | European Journal of Inorganic Chemistry | ||||
| Verlag: | Wiley | ||||
|---|---|---|---|---|---|
| Datum | 9 September 2025 | ||||
| Institutionen | Chemie und Pharmazie > Institut für Analytische Chemie, Chemo- und Biosensorik | ||||
| Projekte |
Gefördert von:
Deutsche Forschungsgemeinschaft (DFG)
(468336522)
| ||||
| Identifikationsnummer |
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| Stichwörter / Keywords | clusters · density functional method calculations · indium · single crystal X-ray diffraction · thallium | ||||
| Dewey-Dezimal-Klassifikation | 500 Naturwissenschaften und Mathematik > 540 Chemie | ||||
| Status | Veröffentlicht | ||||
| Begutachtet | Ja, diese Version wurde begutachtet | ||||
| An der Universität Regensburg entstanden | Zum Teil | ||||
| URN der UB Regensburg | urn:nbn:de:bvb:355-epub-777578 | ||||
| Dokumenten-ID | 77757 |
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