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Information card for entry 1529336
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| Coordinates | 1529336.cif |
|---|---|
| Structure factors | 1529336.hkl |
| Original paper (by DOI) | HTML |
| Formula | F7 N2 Ta |
|---|---|
| Calculated formula | F7 H8 N2 Ta |
| Title of publication | Ferroelastic phase transitions in (NH4)2TaF7 |
| Authors of publication | E.I. Pogoreltsev; S.V. Melnikova; A.V. Kartashev; M.S. Molokeev; M.V. Gorev; I.N. Flerov; N.M. Laptash |
| Journal of publication | Physics of the Solid State |
| Year of publication | 2013 |
| Journal volume | 55 |
| Journal issue | 3 |
| Pages of publication | 611 - 618 |
| a | 5.89467 ± 0.00027 Å |
| b | 5.89467 ± 0.00027 Å |
| c | 10.68564 ± 0.00048 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 371.3 ± 0.03 Å3 |
| Number of distinct elements | 3 |
| Space group number | 129 |
| Hermann-Mauguin space group symbol | P 4/n m m :2 |
| Hall space group symbol | -P 4a 2a |
| Residual factor for all reflections | 0.05232 |
| Residual factor R(I) for significantly intense reflections | 0.0744 |
| Method of determination | powder diffraction |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.5406 Å |
| Diffraction radiation type | CuKα~1~~2~ |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 186594 (current) | 2016-09-16 | cif/1/ Adding attached hydrogens to N and O atoms. |
1529336.cif 1529336.hkl |
| 181862 | 2016-04-06 | hkl/ (antanas@echidna.ibt.lt) Adding svn headers to multiple entries in range 1. |
1529336.cif 1529336.hkl |
| 176429 | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
1529336.cif 1529336.hkl |
| 176428 | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
1529336.cif 1529336.hkl |
| 152732 | 2015-08-04 | cif/ hkl/ Adding structures of 1529336 via cif-deposit CGI script. |
1529336.cif 1529336.hkl |
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Users of the data should acknowledge the original authors of the
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