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Information card for entry 1563203
Preview
| Coordinates | 1563203.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Calcium nitride deuteride |
|---|---|
| Formula | Ca2 D0.9 H0.1 N |
| Calculated formula | Ca2 D0.899 H0.1 N |
| Title of publication | Order and disorder in Ca2ND0.90H0.10‒A structural and thermal study |
| Authors of publication | Verbraeken, Maarten C.; Suard, Emmanuelle; Irvine, John T.S. |
| Journal of publication | Journal of Solid State Chemistry |
| Year of publication | 2011 |
| Journal volume | 184 |
| Journal issue | 8 |
| Pages of publication | 2088 - 2096 |
| a | 3.61525 ± 0.00001 Å |
| b | 3.61525 ± 0.00001 Å |
| c | 17.71161 ± 0.00121 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 200.477 ± 0.014 Å3 |
| Cell temperature | 723 K |
| Ambient diffraction temperature | 293 K |
| Number of distinct elements | 4 |
| Space group number | 166 |
| Hermann-Mauguin space group symbol | R -3 m :H |
| Hall space group symbol | -R 3 2" |
| Residual factor R(I) for significantly intense reflections | 6.3281 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.91137 Å |
| Diffraction radiation type | ConstantWavelengthNeutronDiffraction |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 266224 (current) | 2021-06-07 | cif/ Adding structures of 1563201, 1563202, 1563203 via cif-deposit CGI script. |
1563203.cif |
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