Lattice parameter changes in the mixed-oxide system Ce 1–x La x O 2–x/2 : a combined experimental and theoretical study
1993; Royal Society of Chemistry; Volume: 3; Issue: 10 Linguagem: Inglês
10.1039/jm9930301007
ISSN1364-5501
AutoresBelinda C. Morris, Wendy R. Flavell, W. C. Mackrodt, Michael A. Morris,
Tópico(s)X-ray Diffraction in Crystallography
ResumoX-Ray diffraction measurements are reported of ceramic samples of the mixed-oxide system Ce1–xLaxO2–x/2 for 0<x<0.9, where x has been determined by EDXA. The solid-state reaction forms a highly crystalline product at an ageing temperature of 1200 °C. The solubility limit of La in the bulk CeO2 at this temperature has been determined as ca. 52% by monitoring the lattice parameter increase and the subsequent appearance of a second La2O3 phase. To model the experimental measurements, atomistic lattice calculations based on electron-gas shell-model potentials have been carried out to estimate the variation of the lattice parameter with La content.
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