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  Crystal structure, chemical bonding, and electrical and thermal transport in Sc5Rh6Sn18

Feig, M., Akselrud, L., Schnelle, W., Dyadkin, V., Chernyshov, D., Ormeci, A., et al. (2020). Crystal structure, chemical bonding, and electrical and thermal transport in Sc5Rh6Sn18. Dalton Transactions, 49(20), 6832-6841. doi:10.1039/d0dt00324g.

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Feig, Manuel1, Autor           
Akselrud, Lev1, Autor           
Schnelle, Walter2, Autor           
Dyadkin, Vadim3, Autor
Chernyshov, Dmitry3, Autor
Ormeci, Alim1, Autor           
Simon, Paul4, Autor           
Leithe-Jasper, Andreas5, Autor           
Gumeniuk, Roman3, Autor
Affiliations:
1Chemical Metal Science, Max Planck Institute for Chemical Physics of Solids, Max Planck Society, ou_1863405              
2Walter Schnelle, Inorganic Chemistry, Max Planck Institute for Chemical Physics of Solids, Max Planck Society, ou_1863441              
3External Organizations, ou_persistent22              
4Paul Simon, Chemical Metal Science, Max Planck Institute for Chemical Physics of Solids, Max Planck Society, ou_1863418              
5Andreas Leithe-Jasper, Chemical Metal Science, Max Planck Institute for Chemical Physics of Solids, Max Planck Society, ou_1863406              

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 Zusammenfassung: Single crystals of Sc5Rh6Sn18 were grown from Sn-flux. The crystal structure (SG: I4(1)/acd, a = 13.5529(2) angstrom, c = 27.0976(7) angstrom) was studied by high-resolution X-ray diffraction on powder and single crystal material as well as by TEM. All methods confirm it to crystallize with a Sc5Ir6Sn18 (space group I4(1)/acd) type structure. The performed structural studies also suggest the presence of local domains with a broken average translational symmetry. An analysis of the chemical bonding situation reveals highly polar covalent Sc2-Sn1, Sn-Rh and Sc2-Rh bonds, two- and three-centre bonds involving Sn-atoms as well as the ionic nature of Sc1 bonding. The thermopower of Sc5Rh6Sn18 is isotropic, small and negative (i.e. dominance of electron-like charge carriers). Due to structural disorder, the thermal conductivity is lower in comparison with regular metallic systems.

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Sprache(n): eng - English
 Datum: 2020-04-172020-04-17
 Publikationsstatus: Erschienen
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 Art der Begutachtung: -
 Identifikatoren: ISI: 000537869500032
DOI: 10.1039/d0dt00324g
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Titel: Dalton Transactions
  Kurztitel : Dalton Trans.
Genre der Quelle: Zeitschrift
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Ort, Verlag, Ausgabe: Cambridge, UK : Royal Society of Chemistry
Seiten: - Band / Heft: 49 (20) Artikelnummer: - Start- / Endseite: 6832 - 6841 Identifikator: ISSN: 1477-9226
CoNE: https://pure.mpg.de/cone/journals/resource/954925269323