Comparison of short-range ion-ion correlations in the alpha, beta and delta phases of Bi2O3

• Neutron total scattering data for alpha-Bi(2)O(3) and delta-Bi(2)O(3), considering both the Bragg and diffuse components, have been analysed by the reverse Monte Carlo (RMC) method to extract experimental information concerning the short-range correlations between pairs of ions. These results complement the average structural information provided by conventional Rietveld refinement of the Bragg scattering alone. The radial and angular distribution functions in the stable ambient temperature alpha phase and superionic delta phase of Bi(2)O(3) are presented and compared with the corresponding data for the metastable beta phase reported previously. These data provide an important insight into the nature of the anion disorder within the highly conducting delta phase and the relationship between the delta phase and its ordered alpha and beta counterparts.

Ämnesord

NATURVETENSKAP  -- Kemi (hsv//swe)

NATURAL SCIENCES  -- Chemical Sciences (hsv//eng)

Nyckelord

Reverse Monte Carlo (RMC)

conductivity

Neutron total scattering

SOFC material

bismuth sesquioxide

interactions

delta-bi2o3

Short-range ion

Oxide conductivity

doped ceria

Bismuth sesquioxide

system

diffraction

oxide fuel-cells

Publikations- och innehållstyp

art (ämneskategori)

ref (ämneskategori)