Structure of As-Se glasses by neutron diffraction with isotope substitution.

J Chem Phys

Department of Physics, University of Bath, Bath BA2 7AY, United Kingdom.

Published: October 2020

AI Article Synopsis

  • The study uses neutron diffraction with selenium isotope substitution to analyze the structure of glassy arsenic selenide (AsSe) samples.
  • The results show correlations between arsenic (As) and selenium (Se) atoms, confirming the chemical ordering of the AsSe network aligned with the "8-N" rule.
  • However, the presence of As-As bonds disrupts this order as the arsenic content increases, resulting in frozen As-As and Se-Se defect pairs in the glassy structure.

Article Abstract

The method of neutron diffraction with selenium isotope substitution is used to measure the structure of glassy AsSe, AsSe, and AsSe. The method delivers three difference functions for each sample in which the As-As, As-Se, or Se-Se correlations are eliminated. The measured coordination numbers are consistent with the "8-N" rule and show that the AsSe network is chemically ordered, a composition near to which there is a minimum in the fragility index and a boundary to the intermediate phase. Chemical ordering in glassy AsSe and AsSe is, however, broken by the appearance of As-As bonds, the fraction of which increases with the arsenic content of the glass. For the AsSe material, a substantial fraction of As-As and Se-Se defect pairs (∼11%) is frozen into the network structure on glass formation.

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Source
http://dx.doi.org/10.1063/5.0027171DOI Listing

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