Ab-Initio and Experimental Investigation of Ce-Doped Sr<sub>2</sub>MgWO<sub>6</sub> and Sr<sub>2</sub>ZnWO<sub>6</sub> Double Perovskite Oxides as Novel Scintillators

POSTER

Abstract

Scintillators are materials that emit light upon exposure to ionizing radiation and are essential components in radiation detection, medical imaging, and high-energy physics. While traditional scintillators are based on halide or garnet systems, the search for new, stable, and cost-effective alternatives remains an active area of research. The Sr2MgWO6 and Sr2ZnWO6 double perovskite oxides, already known phosphor hosts, offer excellent structural and compositional flexibility, making them promising candidates as scintillator hosts. In this work, we explore the effect of Ce doping as a pathway to transform these materials into efficient scintillators. Using first-principles calculations we show that Ce doping on the Sr-site introduces localized 4f states within the band gaps of both materials. These localized states can serve as radiative recombination centers essential for scintillation. Building upon our computational insights, we synthesized Ce-doped Sr2MgWO6 and Sr2ZnWO6 samples and carried out structural, and luminescence characterization. Preliminary photoluminescence measurements reveal Ce3+-related emission along with intrinsic emission from WO6 octahedrons.

Presenters

  • Ajinkya C Hire

    • Los Alamos National Laboratory

Authors

  • Ajinkya C Hire

    • Los Alamos National Laboratory
  • Rebecca Lalk

    • University of Tennessee, Knoxville
  • Kurt E Sickafus

    • Los Alamos National Laboratory
  • Kenneth J Mcclellan

    • Los Alamos National Laboratory
  • Darrin D Byler

    • Los Alamos National Laboratory
  • Arjen van Veelen

    • Los Alamos National Laboratory
  • Caitlin A Kohnert

    • Los Alamos National Laboratory
  • Blas Pedro Uberuaga

    • Los Alamos National Laboratory (LANL)
  • Anjana Talapatra

    • Los Alamos National Laboratory