Acta Crystallographica Section C

Crystal Structure Communications

Volume 59, Part 12 (December 2003)



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Acta Cryst. (2003). C59, i120-i124    [doi:10.1107/S0108270103023321]

Lithium and sodium yttrium orthosilicate oxyapatite, LiY9(SiO4)6O2 and NaY9(SiO4)6O2, at both 100  K and near room temperature

G. R. Redhammer and G. Roth

Abstract: Lithium yttrium orthosilicate oxyapatite [lithium nonayttrium hexakis(silicate) dioxide], LiY9(SiO4)6O2, crystallizes in the centrosymmetric space group P63/m at both 295 and 100  K. The structure closely resembles those of fluorine apatite and sodium yttrium orthosilicate oxyapatite [sodium nonayttrium hexakis(silicate) dioxide], NaY9(SiO4)6O2, which was also investigated, at 270 and 100  K, in this study. There are two different crystallographic sites for the Y3+ ion, which are coordinated by seven and nine O atoms. One-fourth of the nine-coordinated site is occupied by Li or Na atoms, thus maintaining charge balance. The Si atom occupies a tetrahedral site. The two compounds show no symmetry change between room temperature and 100  K, and the alterations in structural parameters are small.

Formula: LiY9(SiO4)6O2 and NaY9(SiO4)6O2

Online 8 November 2003


hkldisplay filedownload file

Structure factor file (CIF format) (19.1 kbytes)
Contains datablock LiY296K


hkldisplay filedownload file

Structure factor file (CIF format) (25.1 kbytes)
Contains datablock LiY100K


hkldisplay filedownload file

Structure factor file (CIF format) (22.8 kbytes)
Contains datablock NaY270K


hkldisplay filedownload file

Structure factor file (CIF format) (31.3 kbytes)
Contains datablock NaY100K


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