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dc.contributor.authorIgoshev, P. A.en
dc.contributor.authorChizhov, D. E.en
dc.contributor.authorIrkhin, V. Y.en
dc.contributor.authorStreltsov, S. V.en
dc.date.accessioned2025-02-25T10:49:39Z-
dc.date.available2025-02-25T10:49:39Z-
dc.date.issued2024-
dc.identifier.citationIgoshev, P. A., Chizhov, D. E., Irkhin, V. Y., & Streltsov, S. V. (2024). Spin-orbit coupling induced orbital entanglement in a three-band Hubbard model. Physical Review B, 110(11). https://doi.org/10.1103/PhysRevB.110.115110apa_pure
dc.identifier.issn2469-9950-
dc.identifier.issn2469-9969-
dc.identifier.otherFinal2
dc.identifier.otherAll Open Access; Green Open Access3
dc.identifier.otherhttps://www.scopus.com/inward/record.uri?eid=2-s2.0-85204236165&doi=10.1103%2fPhysRevB.110.115110&partnerID=40&md5=79eefcf1b600658b9136dcb72f6c85761
dc.identifier.otherhttp://arxiv.org/pdf/2406.07386pdf
dc.identifier.urihttp://elar.urfu.ru/handle/10995/141637-
dc.description.abstractThe effect of the spin-orbit coupling on the ground state properties of the square-lattice three-band Hubbard model with a single electron per site is studied by a generalized Hartree-Fock approximation. We calculate the full phase diagram and show that there appear additional orbital-entangled phases brought about by competition of various exchange channels or by the spin-orbit coupling in addition to conventional states stabilized by the Kugel-Khomskii mechanism. One of these phases previously proposed to explain magnetic properties of Sr2VO4 is characterized by vanishing dipolar magnetic moments and antiferro-octupolar ordering. We calculated microscopic parameters for this material and demonstrate that it is located near a phase boundary of two orbital-entangled and two conventional antiferromagnetic ferro-orbital states. © 2024 American Physical Society.en
dc.description.sponsorshipMinistry of Education and Science of the Russian Federation, Minobrnauka, (122021000038-7); Ministry of Education and Science of the Russian Federation, Minobrnauka; Russian Science Foundation, RSF, (23-42-00069); Russian Science Foundation, RSFen
dc.description.sponsorshipS.V.S. thanks G. Khaliullin and K. Kugel for useful discussions and B. Kim and C. Franchini for unpublished estimates of Hubbard's and Hund's using cRPA for different models and for various stimulating communications. The research funding from the Ministry of Science and Higher Education of the Russian Federation (the state assignment, theme \u201CQuantum\u201D No. 122021000038-7) for implementation of generalized Hartree-Fock method in computer codes is acknowledged. The application of this treatment to perovskites is supported by the Russian Science Foundation, Project No. 23-42-00069.en
dc.format.mimetypeapplication/pdfen
dc.language.isoenen
dc.publisherAmerican Physical Societyen
dc.rightsinfo:eu-repo/semantics/openAccessen
dc.sourcePhysical Review B2
dc.sourcePhysical Review Ben
dc.subjectANTIFERROMAGNETISMen
dc.subjectEXCHANGE COUPLINGen
dc.subjectHARTREE APPROXIMATIONen
dc.subjectMAGNETIC MOMENTSen
dc.subjectQUANTUM ENTANGLEMENTen
dc.subjectSPIN ORBIT COUPLINGen
dc.subjectSTRONTIUM COMPOUNDSen
dc.subjectGROUND STATE PROPERTIESen
dc.subjectHARTREE-FOCK APPROXIMATIONSen
dc.subjectHUBBARDen
dc.subjectMICROSCOPIC PARAMETERen
dc.subjectOCTUPOLAR ORDERen
dc.subjectORBITALSen
dc.subjectPROPERTYen
dc.subjectSINGLE ELECTRONen
dc.subjectSPIN-ORBIT COUPLINGSen
dc.subjectSQUARE LATTICESen
dc.subjectHUBBARD MODELen
dc.titleSpin-orbit coupling induced orbital entanglement in a three-band Hubbard modelen
dc.typeArticleen
dc.typeinfo:eu-repo/semantics/articleen
dc.typeinfo:eu-repo/semantics/submittedVersionen
dc.identifier.doi10.1103/PhysRevB.110.115110-
dc.identifier.scopus85204236165-
local.contributor.employeeIgoshev P.A., Institute of Metal Physics, S. Kovalevskaya Street 18, Ekaterinburg, 620108, Russian Federationen
local.contributor.employeeChizhov D.E., Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Mira Street 19, Ekaterinburg, 620002, Russian Federationen
local.contributor.employeeIrkhin V.Y., Institute of Metal Physics, S. Kovalevskaya Street 18, Ekaterinburg, 620108, Russian Federationen
local.contributor.employeeStreltsov S.V., Institute of Metal Physics, S. Kovalevskaya Street 18, Ekaterinburg, 620108, Russian Federation, Department of Theoretical Physics and Applied Mathematics, Ural Federal University, Mira Street 19, Ekaterinburg, 620002, Russian Federationen
local.issue11-
local.volume110-
dc.identifier.wos001361593900007-
local.contributor.departmentInstitute of Metal Physics, S. Kovalevskaya Street 18, Ekaterinburg, 620108, Russian Federationen
local.contributor.departmentDepartment of Theoretical Physics and Applied Mathematics, Ural Federal University, Mira Street 19, Ekaterinburg, 620002, Russian Federationen
local.identifier.pure63243359-
local.description.order115110
local.identifier.eid2-s2.0-85204236165-
local.fund.rsfMinistry of Education and Science of the Russian Federation, Minobrnauka, (122021000038-7); Ministry of Education and Science of the Russian Federation, Minobrnauka; 23-42-00069
local.identifier.wosWOS:001361593900007-
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