RIETVELD REFINEMENT OF THE INCOMMENSURATE STRUCTURE OF THE ELPASOLITE(ORDERED PEROVSKITE) PB2MGTEO6

Citation
G. Baldinozzi et al., RIETVELD REFINEMENT OF THE INCOMMENSURATE STRUCTURE OF THE ELPASOLITE(ORDERED PEROVSKITE) PB2MGTEO6, Journal of physics. Condensed matter, 10(29), 1998, pp. 6461-6472
Citations number
23
Categorie Soggetti
Physics, Condensed Matter
ISSN journal
09538984
Volume
10
Issue
29
Year of publication
1998
Pages
6461 - 6472
Database
ISI
SICI code
0953-8984(1998)10:29<6461:RROTIS>2.0.ZU;2-O
Abstract
Lead magnesium tellurate, Pb2MgTeO6, undergoes two structural phase tr ansitions at about 194 K and 142 K. The structures of the cubic and of the lower-temperature phase have been refined by the Rietveld method at three different temperatures (350, 220 and 6 K). The relative simpl icity of the structure has allowed the incommensurately modulated stru cture for powder samples to be characterized. The modulated displaceme nts of O atoms give rise to a large spread of bond lengths. Pb atoms a re disordered and their average positions are away from the threefold axis. The structural resolution is compared to that from the analysis of the symmetry-adapted coordinates of the optic modes becoming totall y symmetric in the lower-temperature phase.