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Information card for entry 4337115
Preview
| Coordinates | 4337115.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Bi3.56 K1.319 O11 P2 |
|---|---|
| Calculated formula | Bi3.56 K1.3195 O11 P2 |
| Title of publication | Labile Degree of Disorder in Bismuth-Oxophosphate Compounds: Illustration through Three New Structural Types. |
| Authors of publication | Aliev, A.; Endara, D.; Huvé, M; Colmont, M.; Roussel, P.; Delevoye, L.; Tran, T. T.; Halasyamani, P. S.; Mentré, O |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2014 |
| Journal volume | 53 |
| Journal issue | 2 |
| Pages of publication | 861 - 871 |
| a | 13.7008 ± 0.0002 Å |
| b | 13.7008 ± 0.0002 Å |
| c | 5.6633 ± 0.0001 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1063.07 ± 0.03 Å3 |
| Cell temperature | 293 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 114 |
| Hermann-Mauguin space group symbol | P -4 21 c |
| Hall space group symbol | P -4 2n |
| Residual factor for all reflections | 0.0419 |
| Residual factor for significantly intense reflections | 0.0314 |
| Weighted residual factors for significantly intense reflections | 0.0364 |
| Weighted residual factors for all reflections included in the refinement | 0.0618 |
| Goodness-of-fit parameter for significantly intense reflections | 2.2 |
| Goodness-of-fit parameter for all reflections included in the refinement | 3.42 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288070 (current) | 2023-12-06 | cif/ Corrected misspelt data names in multiple entries using the 'cif_correct_tags' program and a data names replacement file from cod-tools revision 9818. This change affected only the misspelt variants of the '_atom_site_site_symmetry_multiplicity' and '_atom_site_refinement_flag' data names. |
4337115.cif |
| 176432 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries. |
4337115.cif |
| 106169 | 2014-03-15 | cif/ Adding structures of 4337115 via cif-deposit CGI script. |
4337115.cif |
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