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Information card for entry 1008808
Preview
| Coordinates | 1008808.cif |
|---|---|
| Original IUCr paper | HTML |
| External links | AMCSD |
| Common name | Potassium titanyl phosphate |
|---|---|
| Chemical name | Potassium oxotitanium phosphate(V) |
| Formula | K O5 P Ti |
| Calculated formula | K O5 P Ti |
| Title of publication | NaTiOPO~4~ and KTiOPO~4~ at 110 K |
| Authors of publication | Dahaoui, Slimane; Hansen, Niels K.; Menaert, Bertrand |
| Journal of publication | Acta Crystallographica, Section C: Crystal Structure Communications |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 9 |
| Pages of publication | 1173 - 1176 |
| a | 12.7982 ± 0.0009 Å |
| b | 6.3937 ± 0.0007 Å |
| c | 10.5853 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 866.2 ± 0.1 Å3 |
| Cell temperature | 110 ± 3 K |
| Ambient diffraction temperature | 110 ± 3 K |
| Number of distinct elements | 4 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n a 21 |
| Hall space group symbol | P 2c -2n |
| Residual factor for all reflections | 0.0123 |
| Residual factor for significantly intense reflections | 0.0123 |
| Weighted residual factors for significantly intense reflections | 0.0119 |
| Goodness-of-fit parameter for significantly intense reflections | 1 |
| Diffraction radiation wavelength | 0.56087 Å |
| Diffraction radiation type | AgKα |
| Duplicate of | 2006468 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180689 (current) | 2016-04-01 | cod/ (antanas@echidna.ibt.lt) cif/ hkl/ Adding hkl files for entries 2006467, 2006468. |
1008808.cif |
| 180687 | 2016-04-01 | cif/ (antanas@echidna.ibt.lt) Changing the generic COD entry header to the IUCr one in entries 1008808, 2006468. |
1008808.cif |
| 180686 | 2016-04-01 | cif/ (antanas@echidna.ibt.lt) Adding additional information from entry 1008808 to entry 2006468 and vice versa since entry 1008808 contained information not present in the original CIF (oxydation numbers). Marking entry 1008808 as a duplicate of entry 2006468. |
1008808.cif |
| 130149 | 2015-01-27 | cod/ (saulius@kolibris) Deriving Hall space group symbols for 12003 CIFs using the 'cif_filter --estimate-spacegroup' command. |
1008808.cif |
| 35911 | 2012-02-28 | cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree. |
1008808.cif |
| 966 | 2010-01-30 | cif/ Adding _cod_database_code tags to all COD entries. Adding tag description to the cif_cod.dic dictionary so that COD entries can be validated. |
1008808.cif |
| 19 | 2008-01-26 | Changing all end-of-line codes from DOS style to UNIX style in all COD CIF files, for more convenient processing: In the cod/cif/ directory: ff \*.cif | xargs perl -i -pe 's/\r\n/\n/' |
1008808.cif |
| 14 | 2008-01-14 | Appending a header with SVN keywords, COD URL and copying policy to all COD CIF files. |
1008808.cif |
| 13 | 2008-01-13 | Setting the svn:keywords property to "Author Date Revision URL Id" for all CIF files in the cod/cif directory. |
1008808.cif |
| 1 | 2007-11-30 | Adding all .cif files from the COD, downloaded in a Cod.zip file on 2007.02.07 (and the same Cod.zip is downloadable today, on 2007.11.29) |
1008808.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.