Short Range Order Signature in Crystalline and Amorphous GeSbTe Xanes Spectra

ORAL

Abstract

A new implementation of XANES spectra calculations within DFT and PAW potentials is used to compute the XANES spectra of various amorphous and crystalline GeSbTe structures. A clear correlation between the local order, either tetrahedral or distorted octahedral, and the shape of the XANES signal is observed. These calculations provide a new interpretation of past XANES measurements, relating essentially the phase change mechanism to a moderate modification of the local environment of the Ge atoms.

*This work performed under the auspices of the U.S. Department of Energy by Lawrence Livermore National Laboratory under Contract DE-AC52-07NA27344. This work was supported by the Belgian PAI 3/42 program and the FNRS-FRFC.

Authors

  • Jean-Yves Raty

    • University of Li\`ege
    • University of Liege
  • C\'eline Otjacques

    • University of Li\`ege
  • Rengin Pekoz

    • University of Li\`ege
  • Christophe Bichara

    • CNRS- University Aix-Marseille
  • Vincenzo Lordi

    • Lawrence Livermore National Laboratory
    • Lawrence Livermore National Lab