Information card for entry 4001801
| Formula |
Li0.15 Nd0.617 O3 Ti |
| Title of publication |
Frustrated Octahedral Tilting Distortion in the Incommensurately Modulated Li3xNd2/3‒xTiO3 Perovskites |
| Authors of publication |
Abakumov, Artem M.; Erni, Rolf; Tsirlin, Alexander A.; Rossell, Marta D.; Batuk, Dmitry; Nénert, Gwilherm; Van Tendeloo, Gustaaf |
| Journal of publication |
Chemistry of Materials |
| Year of publication |
2013 |
| Journal volume |
25 |
| Journal issue |
13 |
| Pages of publication |
2670 - 2683 |
| a |
3.831048 ± 0.000005 Å |
| b |
3.827977 ± 0.000004 Å |
| c |
7.724355 ± 0.000008 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
113.279 ± 0.0002 Å3 |
| Cell temperature |
293 K |
| Ambient diffraction temperature |
293 K |
| Number of distinct elements |
4 |
| Hermann-Mauguin space group symbol |
Pmmm(\a,1/2,0)000(1/2,\b,0)000 |
| Residual factor for all reflections |
0.0517 |
| Residual factor for significantly intense reflections |
0.045 |
| Weighted residual factors for all reflections |
0.0235 |
| Weighted residual factors for significantly intense reflections |
0.0232 |
| Goodness-of-fit parameter for all reflections |
2.02 |
| Method of determination |
powder diffraction |
| Diffraction radiation probe |
x-ray |
| Diffraction radiation wavelength |
0.3962 Å |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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