J$_{\mathrm{eff}}=$1/2 Mott spin-orbit insulating state close to the cubic limit in Ca$_{4}$IrO$_{6}$

ORAL

Abstract

The J$_{\mathrm{eff}}=$1/2 Mott spin-orbit insulating state is manifested in systems with large cubic crystal field splitting and spin-orbit coupling that are comparable to the on-site Coulomb interaction, U. 5d transition metal oxides host parameters in this regime and recently strong evidence for this state in Sr$_{2}$IrO$_{4}$, and additional iridates, has been presented. All the candidates, however, have distorted octahedra, such as the elongation along the c-axis in Sr$_{2}$IrO$_{4}$, and consequently a non-cubic local crystal field environment. Consequently the materials form a mixed J$_{\mathrm{eff}}=$1/2,3/2 ground state. The lack of a material with an unmixed J$_{\mathrm{eff}}=$1/2 has impacted the development and testing of robust models of this novel insulating and magnetic state. We present neutron diffraction, resonant x-ray scattering and DFT calculations that not only reveal Ca$_{4}$IrO$_{6}$ is a new candidate J$_{\mathrm{eff}}=$1/2 material with long-range magnetic order, but furthermore resides close to the required cubic limit. Both our experimental and theoretical investigation indicate Ca$_{4}$IrO$_{6}$ is uniquely positioned to act as a canonical system to investigate of the J$_{\mathrm{eff}}=$1/2 state.

Authors

  • S. Calder

    Oak Ridge National Lab

  • G.-X. Cao

    Oak Ridge National Lab

  • Satoshi Okamoto

    Oak Ridge National Lab, Oak Ridge National Laboratory

  • Jong-Woo Kim

    Argonne National Laboratory

  • Valentino Cooper

    Oak Ridge National Lab, Oak Ridge National Laboratory, Oak Ridge National Lab, Oak Ridge, TN

  • Zheng Gai

    Oak Ridge National Lab, Oak Ridge National Laboratory

  • Brian Sales

    Oak Ridge National Lab, Oak Ridge National Laboratory

  • M.D. Lumsden

    Oak Ridge National Lab, Quantum Condensed Matter Division, Oak Ridge National Laboratory

  • David Mandrus

    Oak Ridge Natl Lab, Department of Materials Science and Engineering, the University of Tennessee, Knoxville, TN 37996, USA, Oak Ridge National Lab, Univ of Tennessee, University of Tennessee and Oak Ridge National Laboratory, Univ of Tennessee Knoxville, University of Tennessee, Oak Ridge National Laboratory

  • A.D. Christianson

    Oak Ridge National Lab, Oak Ridge National Laboratory, Quantum Condensed Matter Division, Oak Ridge National Laboratory