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Information card for entry 2237321
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| Coordinates | 2237321.cif |
|---|---|
| Structure factors | 2237321.hkl |
| Original IUCr paper | HTML |
| Common name | penikisite |
|---|---|
| Chemical name | Barium dimagnesium dialuminium triphosphate trihydroxide |
| Formula | Al2 Ba H3 Mg1.97 Mn0.03 O15 P3 |
| Calculated formula | Al2 Ba H3 Mg1.97 Mn0.03 O15 P3 |
| Title of publication | Penikisite, BaMg~2~Al~2~(PO~4~)~3~(OH)~3~, isostructural with bjarebyite |
| Authors of publication | Bowman, Michael G.; Downs, Robert T.; Yang, Hexiong |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2013 |
| Journal volume | 69 |
| Journal issue | 2 |
| Pages of publication | i4 - i5 |
| a | 8.9577 ± 0.0004 Å |
| b | 12.015 ± 0.0005 Å |
| c | 4.9079 ± 0.0002 Å |
| α | 90° |
| β | 100.505 ± 0.002° |
| γ | 90° |
| Cell volume | 519.37 ± 0.04 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 11 |
| Hermann-Mauguin space group symbol | P 1 21/m 1 |
| Hall space group symbol | -P 2yb |
| Residual factor for all reflections | 0.0155 |
| Residual factor for significantly intense reflections | 0.015 |
| Weighted residual factors for significantly intense reflections | 0.0387 |
| Weighted residual factors for all reflections included in the refinement | 0.0389 |
| 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 |
|---|---|---|---|
| 181295 (current) | 2016-04-03 | hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/73. |
2237321.cif 2237321.hkl |
| 176798 | 2016-02-21 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23. |
2237321.cif 2237321.hkl |
| 88064 | 2013-08-29 | Adding _cod_database_fobs_code data item to all COD CIFs that have Fobs deposited and did not have this data item yet. | 2237321.cif 2237321.hkl |
| 75609 | 2013-03-10 | hkl/ (saulius@koala.ibt.lt) Adding newly assigned range 2 Fobs files. |
2237321.cif 2237321.hkl |
| 75332 | 2013-03-09 | cif/ Adding structures of 2237321 via cif-deposit CGI script. |
2237321.cif |
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Users of the data should acknowledge the original authors of the
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