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Information card for entry 1517987
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| Coordinates | 1517987.cif |
|---|
| Formula | D4 O7 P V |
|---|---|
| Calculated formula | D4 O7 P V |
| Title of publication | Intercalation of water molecules in a layer structure VOPO4. Crystal structure of VOPO4.2D2O |
| Authors of publication | Tachez, Michel; Theobald, Francois; Bernard, Jean; Hewat, Alan W. |
| Journal of publication | Revue de Chimie Minerale |
| Year of publication | 1982 |
| Journal volume | 19 |
| Pages of publication | 291 - 300 |
| a | 6.2154 ± 0.0002 Å |
| b | 6.2154 ± 0.0002 Å |
| c | 7.4029 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 285.98 ± 0.03 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 4 |
| Space group number | 85 |
| Hermann-Mauguin space group symbol | P 4/n :1 |
| Hall space group symbol | P 4ab -1ab |
| Residual factor R(I) for significantly intense reflections | 18.6 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.909 Å |
| Diffraction radiation type | neutron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1517987.cif |
| 125310 | 2014-10-13 | cif/ Adding structures of 1517987 via cif-deposit CGI script. |
1517987.cif |
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Users of the data should acknowledge the original authors of the
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