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Information card for entry 1560714
Preview
| Coordinates | 1560714.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Cu8 S24 Sr8 Th5.78 |
|---|---|
| Calculated formula | Cu8 S24 Sr8 Th5.776 |
| Title of publication | Syntheses, modulated crystal structures of Ba6−2xU2+xAg4Se12 (x = 0 and 0.5), and crystal structure and spectroscopy of Sr4Th2.78Cu4S12 |
| Authors of publication | Mesbah, Adel; Prakash, Jai; Beard, Jessica C.; Malliakas, Christos D.; Lebègue, Sébastien; Ibers, James A. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2018 |
| Journal volume | 268 |
| Pages of publication | 30 - 35 |
| a | 8.2292 ± 0.0003 Å |
| b | 11.5252 ± 0.0004 Å |
| c | 11.1483 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1057.34 ± 0.07 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 4 |
| Space group number | 31 |
| Hermann-Mauguin space group symbol | P m n 21 |
| Hall space group symbol | P 2ac -2 |
| Residual factor for all reflections | 0.0305 |
| Residual factor for significantly intense reflections | 0.0247 |
| Weighted residual factors for significantly intense reflections | 0.0519 |
| Weighted residual factors for all reflections included in the refinement | 0.0541 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.203 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 262309 (current) | 2021-02-27 | cif/ Adding structures of 1560714 via cif-deposit CGI script. |
1560714.cif |
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Users of the data should acknowledge the original authors of the
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