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Information card for entry 7219229
Preview
| Coordinates | 7219229.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | Calcium tungstate |
|---|---|
| Formula | Ca O4 W |
| Calculated formula | Ca O4 W |
| SMILES | O=[W](=O)([O-])[O-].[Ca+2] |
| Title of publication | Rietveld refinement, cluster modelling, growth mechanism and photoluminescence properties of CaWO4:Eu3+microcrystals |
| Authors of publication | Gonçalves, R. F.; Cavalcante, L. S.; Nogueira, I. C.; Longo, E.; Godinho, M. J.; Sczancoski, J. C.; Mastelaro, V. R.; Pinatti, I. M.; Rosa, I. L. V.; Marques, A. P. A. |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 7 |
| Pages of publication | 1654 |
| a | 5.244797 ± 0.00003 Å |
| b | 5.244797 Å |
| c | 11.3813 ± 0.00013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 313.076 ± 0.004 Å3 |
| Cell temperature | 298 K |
| Ambient diffraction temperature | 298 K |
| Number of distinct elements | 3 |
| Space group number | 88 |
| Hermann-Mauguin space group symbol | I 41/a :2 |
| Hall space group symbol | -I 4ad |
| Residual factor for all reflections | 0.05 |
| Residual factor for significantly intense reflections | 0.0342 |
| Weighted residual factors for significantly intense reflections | 0.0666 |
| RFsqd | 0.02583 |
| Goodness-of-fit parameter for all reflections | 1.95 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.95 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5405 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301864 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/21/ Each referenced PubChem compound corresponds to the full crystal structure. |
7219229.cif |
| 264550 | 2021-04-26 | cif/7/21/92/ Removed the _chemical_name_systematic data item from entries 7219229-7219232 since it had incorrect values. |
7219229.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
7219229.cif |
| 133165 | 2015-03-06 | cif/ Updating files of 7219229, 7219230, 7219231, 7219232 Original log message: Adding full bibliography for 7219229--7219232.cif. |
7219229.cif |
| 129440 | 2015-01-08 | cif/ Adding structures of 7219229, 7219230, 7219231, 7219232 via cif-deposit CGI script. |
7219229.cif |
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Users of the data should acknowledge the original authors of the
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