Structural and Dynamical Properties of Barium Stannate

ORAL

Abstract

Barium stannate based perovskites have recently drawn attention due to their potential as transparent conducting oxides and reports of high carrier mobility in La-doped single crystals. Published DFT calculations and experimental results have suggested phonon instabilities at high symmetry zone boundary positions and local octahedral rotations, respectively, for BaSnO$_3$. Here, we discuss recent structural measurements of BaSnO$_3$, in which we have searched for such distortions by employing a combination of single crystal neutron diffraction and total scattering analysis of powder neutron diffraction. Moreover, we discuss lattice dynamical measurements, comparing phonon dispersion measurements to DFT calculations.

Authors

  • D Phelan

    • Argonne National Laboratory
    • Argonne Nat'l Lab
    • Argonne National Labs
  • M. J. Krogstad

    • Northern Illinois University / Argonne National Laboratory
  • A. Lopez-Bezanilla

    • Argonne National Laboratory
  • D. Parshall

    • NIST Center for Neutron Research
  • Y. Gim

    • University of Illinois
  • S. L. Cooper

    • University of Illinois
  • H. Zheng

    • Argonne National Laboratory