Itinerant antiferromagnetism in RuO$_{2}$

ORAL

Abstract

Bulk rutile RuO$_{2}$ has long been considered a Pauli paramagnet. Here we report that RuO$_{2}$ exhibits a hitherto undetected lattice distortion below approximately 900 K. The distortion is accompanied by antiferromagnetic order up to at least 300 K with a small room temperature magnetic moment of approximately 0.05 $\mu$ B as evidenced by polarized neutron diffraction. Density functional theory plus U (DFT$+$U) calculations indicate that antiferromagnetism is favored even for small values of the Hubbard U of the order of 1 eV. The antiferromagnetism may be traced to a Fermi surface instability, lifting the band degeneracy imposed by the rutile crystal field. The combination of high N\'{e}el temperature and small itinerant moments make RuO$_{2}$ unique among ruthenate compounds and among oxide materials in general.

Authors

  • Paul Snijders

    Oak Ridge National Lab, Oak Ridge National Laboratory

  • Tom Berlijn

    Oak Ridge National Laboratory

  • Olivier Delaire

    Duke University

  • Haidong Zhou

    Department of Physics and Astronomy, University of Tennessee, Knoxville, Tennessee 37996, USA, University of Tennessee, University of Tennessee, Knoxville, University of Tennessee,Knoxville, TN 37996, USA, University of Tennessee, Knoxville, National High Magnetic Field Laboratory

  • Thomas Maier

    Oak Ridge National Laboratory, Computer Science and Mathematics Division and Center for Nanophase Materials Sciences, Oak Ridge National Laboratory, Oak Ridge, TN 37831-6494, USA, Oak Ridge National Lab, Oak Ridge National Lab.

  • Huibo Cao

    Quantum Condensed Matter Division, Oak Ridge National Laboratory, Oak Ridge, TK 37831, USA, Oak Ridge National Laboratory, Quantum Condensed Matter Division, Oak Ridge National Laboratory

  • Songxue Chi

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

  • Masaaki Matsuda

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

  • Yang Wang

    Oak Ridge National Laboratory

  • Michael Koehler

    University of Tennessee

  • Paul Kent

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

  • Hanno Weitering

    University of Tennessee