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Information card for entry 2243990
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| Coordinates | 2243990.cif |
|---|---|
| Structure factors | 2243990.hkl |
| Original IUCr paper | HTML |
| Chemical name | Potassium sodium titanium iron tris(phosphate) |
|---|---|
| Formula | Fe K1.65 Na0.35 O12 P3 Ti |
| Calculated formula | Fe K1.65 Na0.35 O12 P3 Ti |
| Title of publication | Mixed-metal phosphates K~1.64~Na~0.36~TiFe(PO~4~)~3~ and K~0.97~Na~1.03~Ti~1.26~Fe~0.74~(PO~4~)~3~ with a langbeinite framework |
| Authors of publication | Zatovsky, Igor V.; Strutynska, Nataliia Yu.; Ogorodnyk, Ivan V.; Baumer, Vyacheslav N.; Slobodyanik, Nickolai S.; Butenko, Denis S. |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2021 |
| Journal volume | 77 |
| Journal issue | 12 |
| Pages of publication | 1299 - 1302 |
| a | 9.8201 ± 0.00013 Å |
| b | 9.8201 ± 0.00013 Å |
| c | 9.8201 ± 0.00013 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 947 ± 0.02 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 198 |
| Hermann-Mauguin space group symbol | P 21 3 |
| Hall space group symbol | P 2ac 2ab 3 |
| Residual factor for all reflections | 0.0253 |
| Residual factor for significantly intense reflections | 0.0247 |
| Weighted residual factors for all reflections included in the refinement | 0.0638 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.137 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 271910 (current) | 2022-01-07 | cif/ hkl/ Adding structures of 2243990, 2243991 via cif-deposit CGI script. |
2243990.cif 2243990.hkl |
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