Dimensionality-strain phase diagram of strontium iridates

Bongjae Kim (Corresponding author), Peitao Liu, Cesare Franchini

Publications: Contribution to journalArticlePeer Reviewed

Abstract

The competition between spin-orbit coupling, bandwidth (W), and electron-electron interaction (U) makes iridates highly susceptible to small external perturbations, which can trigger the onset of novel types of electronic and magnetic states. Here we employ first principles calculations based on density functional theory and on the constrained random phase approximation to study how dimensionality and strain affect the strength of U and W in (SrIrO3)(m)/(SrTiO3()) superlattices. The result is a phase diagram explaining two different types of controllable magnetic and electronic transitions, spin-flop and insulator-to-metal, connected with the disruption of the J(eff) = 1/2 state which cannot be understood within a simplified local picture.
Original languageEnglish
Article number115111
Number of pages7
JournalPhysical Review B
Volume95
Issue number11
DOIs
Publication statusPublished - 7 Mar 2017

Funding

B.K. thanks J. Matsuno and V.V. Shankar for fruitful discussions. This work was supported by the joint Austrian Science Fund (FWF) and Indian Department of Science and Technology (DST) project INDOX (I1490-N19). P.L. is grateful to the China Scholarship Council (CSC)-FWF Scholarship Program. Computing time at the Vienna Scientific Cluster is greatly acknowledged.

Austrian Fields of Science 2012

  • 103025 Quantum mechanics
  • 103036 Theoretical physics
  • 103015 Condensed matter
  • 103009 Solid state physics

Keywords

  • WANNIER FUNCTIONS
  • SR2IRO4
  • OXIDE

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