Kitaev exchange and field-induced quantum spin-liquid states in honeycomb α-RuCl3

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Contributors

  • Ravi Yadav - , Chair of Solid State Theory, Leibniz Institute for Solid State and Materials Research Dresden (Author)
  • Nikolay A. Bogdanov - , Leibniz Institute for Solid State and Materials Research Dresden, Max Planck Institute for Solid State Research (Author)
  • Vamshi M. Katukuri - , Leibniz Institute for Solid State and Materials Research Dresden, Swiss Federal Institute of Technology Lausanne (EPFL) (Author)
  • Satoshi Nishimoto - , Chair of Experimental Solid State Physics, Leibniz Institute for Solid State and Materials Research Dresden, TUD Dresden University of Technology (Author)
  • Jeroen Van Den Brink - , Chair of Solid State Theory, Leibniz Institute for Solid State and Materials Research Dresden, Harvard University (Author)
  • Liviu Hozoi - , Leibniz Institute for Solid State and Materials Research Dresden (Author)

Abstract

Large anisotropic exchange in 5d and 4d oxides and halides open the door to new types of magnetic ground states and excitations, inconceivable a decade ago. A prominent case is the Kitaev spin liquid, host of remarkable properties such as protection of quantum information and the emergence of Majorana fermions. Here we discuss the promise for spin-liquid behavior in the 4d5 honeycomb halide α-RuCl3. From advanced electronic-structure calculations, we find that the Kitaev interaction is ferromagnetic, as in 5d5 iridium honeycomb oxides, and indeed defines the largest superexchange energy scale. A ferromagnetic Kitaev coupling is also supported by a detailed analysis of the field-dependent magnetization. Using exact diagonalization and density-matrix renormalization group techniques for extended Kitaev-Heisenberg spin Hamiltonians, we find indications for a transition from zigzag order to a gapped spin liquid when applying magnetic field. Our results offer a unified picture on recent magnetic and spectroscopic measurements on this material and open new perspectives on the prospect of realizing quantum spin liquids in d 5 halides and oxides in general.

Details

Original languageEnglish
Article number37925
JournalScientific reports
Volume6
Publication statusPublished - 30 Nov 2016
Peer-reviewedYes

Keywords

ASJC Scopus subject areas