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Information card for entry 3000125
Preview
| Coordinates | 3000125.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | radium-barium sulfate |
|---|---|
| Formula | Ba O16 Ra3 S4 |
| Calculated formula | Ba O16 Ra3 S4 |
| Title of publication | Crystal structure of radium sulfate: An X-ray powder diffraction and density functional theory study |
| Authors of publication | Matyskin, Artem V.; Ylmen, Rikard; Lagerkvist, Petra; Ramebäck, Henrik; Ekberg, Christian |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2017 |
| Journal volume | 253 |
| Pages of publication | 15 - 20 |
| a | 9.06956 ± 0.00014 Å |
| b | 5.51771 ± 0.00015 Å |
| c | 7.27476 ± 0.00012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 364.052 ± 0.013 Å3 |
| Cell temperature | 303 K |
| Ambient diffraction temperature | 303 K |
| Number of distinct elements | 4 |
| Space group number | 62 |
| Hermann-Mauguin space group symbol | P n m a |
| Hall space group symbol | -P 2ac 2n |
| Residual factor R(I) for significantly intense reflections | 7.2267 |
| Goodness-of-fit parameter for all reflections | 1.507 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.5418 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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