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Spin-orbit coupling and crystal-field splitting in Ti-doped Ca2RuO4 studied by ellipsometry
Univ Cologne, Inst Phys 2, D-50937 Cologne, Germany..
Univ Cologne, Inst Phys 2, D-50937 Cologne, Germany..
Univ Cologne, Inst Phys 2, D-50937 Cologne, Germany..
Univ Cologne, Inst Theoret Phys, D-50937 Cologne, Germany..
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2022 (English)In: Physical Review B, ISSN 2469-9950, E-ISSN 2469-9969, Vol. 106, no 8, article id 085103Article in journal (Refereed) Published
Abstract [en]

In Ca2RuO4, the competition of spin-orbit coupling ζ and tetragonal crystal-field splitting ΔCF has been discussed controversially for many years. The orbital occupation depends on ΔCF/ζ, which allows us to address this ratio via the optical spectral weights of the lowest intersite Mott-Hubbard excitations. We study the optical conductivity of Ca2Ru0.99Ti0.01O4 in the range of 0.75–5 eV by ellipsometry, using the large single crystals that can be grown for small Ti concentrations. Based on a local multiplet calculation, our analysis results in 2.4≤ΔCF/ζ≲4 at 15 K. The dominant crystal field yields a ground state close to xy orbital order but spin-orbit coupling is essential for a quantitative description of the properties. Furthermore, we observe a pronounced decrease of ΔCF with increasing temperature, as expected based on the reduction of octahedral distortions.

Place, publisher, year, edition, pages
American Physical Society (APS) , 2022. Vol. 106, no 8, article id 085103
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Condensed Matter Physics
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URN: urn:nbn:se:kth:diva-322493DOI: 10.1103/PhysRevB.106.085103ISI: 000888609100001Scopus ID: 2-s2.0-85136186311OAI: oai:DiVA.org:kth-322493DiVA, id: diva2:1719909
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QC 20221216

Available from: 2022-12-16 Created: 2022-12-16 Last updated: 2022-12-19Bibliographically approved

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Hermanns, Maria

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