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Band structure of o...
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Kramer, K. P.Universität Zürich,University of Zürich
(author)
Band structure of overdoped cuprate superconductors: Density functional theory matching experiments
- Article/chapterEnglish2019
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2019
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LIBRIS-ID:oai:research.chalmers.se:022409cd-e6a9-415e-b330-988f6a88e260
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https://research.chalmers.se/publication/511353URI
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https://research.chalmers.se/publication/511164URI
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https://doi.org/10.1103/PhysRevB.99.224509DOI
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Language:English
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Summary in:English
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Subject category:art swepub-publicationtype
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Subject category:ref swepub-contenttype
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A comprehensive angle-resolved photoemission spectroscopy study of the band structure in singlelayer cuprates is presented with the aim of uncovering universal trends across different materials. Five different hole-and electron-overdoped cuprate superconductors (La1.59Eu0.2Sr0.21CuO4, La1.77Sr0.23CuO4, Bi1.74Pb0.38Sr1.88CuO6+delta, Tl2Ba2CuO6+delta, and Pr1.15La0.7Ce0.15CuO4) have been studied with special focus on the bands with a predominately d-orbital character. Using a light polarization analysis, the e(g) and t(2g) bands are identified across these materials. A clear correlation between the d(3z2-r2) band energy and the apical oxygen distance d(A) is demonstrated. Moreover, the compound dependence of the d(x2-y2) band bottom and the t(2g) band top is revealed. A direct comparison to density functional theory (DFT) calculations employing hybrid exchange-correlation functionals demonstrates excellent agreement. We thus conclude that the DFT methodology can be used to describe the global band structure of overdoped single-layer cuprates on both the hole-and electron-doped side.
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Horio, M.Universität Zürich,University of Zürich
(author)
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Tsirkin, S. S.Universität Zürich,University of Zürich
(author)
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Sassa, Yasmine,1981Chalmers tekniska högskola,Chalmers University of Technology(Swepub:cth)sassa
(author)
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Hauser, K.Universität Zürich,University of Zürich
(author)
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Matt, C. E.Universität Zürich,University of Zürich,Paul Scherrer Institut
(author)
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Sutter, D.Universität Zürich,University of Zürich
(author)
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Chikina, A.Paul Scherrer Institut
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Schroter, N. B. M.Paul Scherrer Institut
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Krieger, J. A.Eidgenössische Technische Hochschule Zürich (ETH),Swiss Federal Institute of Technology in Zürich (ETH),Paul Scherrer Institut
(author)
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Schmitt, T.Paul Scherrer Institut
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Strocov, V. N.Paul Scherrer Institut
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Plumb, N. C.Paul Scherrer Institut
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Shi, M.Paul Scherrer Institut
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Pyon, S.University of Tokyo, Japan
(author)
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Takayama, T.University of Tokyo, Japan
(author)
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Takagi, H.University of Tokyo, Japan
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Adachi, T.Sophia University
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Ohgi, T.Tohoku University
(author)
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Kawamata, T.Tohoku University
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Koike, Y.Tohoku University
(author)
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Kondo, T.University of Tokyo, Japan
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Lipscombe, O. J.University of Bristol
(author)
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Hayden, S. M.University of Bristol
(author)
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Ishikado, M.Comprehensive Research Organization for Science and Society (CROSS)
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Eisaki, H.National Institute of Advanced Industrial Science and Technology (AIST)
(author)
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Neupert, T.Universität Zürich,University of Zürich
(author)
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Chang, J.Universität Zürich,University of Zürich
(author)
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Universität ZürichChalmers tekniska högskola
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In:Physical Review B99:222469-99692469-9950
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Kramer, K. P.
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Horio, M.
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Tsirkin, S. S.
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Sassa, Yasmine, ...
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Hauser, K.
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Matt, C. E.
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Sutter, D.
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Chikina, A.
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Schroter, N. B. ...
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Krieger, J. A.
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Schmitt, T.
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Strocov, V. N.
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Plumb, N. C.
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Shi, M.
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Pyon, S.
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Takayama, T.
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Takagi, H.
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Adachi, T.
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Ohgi, T.
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Kawamata, T.
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Koike, Y.
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Kondo, T.
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Lipscombe, O. J.
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Hayden, S. M.
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Ishikado, M.
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Eisaki, H.
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Neupert, T.
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Chang, J.
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