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Information card for entry 1567272
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| Coordinates | 1567272.cif |
|---|
| Common name | ice V |
|---|---|
| Formula | D2 O |
| Calculated formula | D2.01029 O |
| Title of publication | Detailed crystallographic analysis of the ice V to ice XIII hydrogen-ordering phase transition |
| Authors of publication | Salzmann, C. G.; Rosu-Finsen, A.; Sharif, Z.; Radaelli, P.G.; Finney, J. L. |
| Journal of publication | The Journal of Chemical Physics |
| Year of publication | 2021 |
| Journal volume | 154 |
| Pages of publication | 134504 |
| a | 9.19256 ± 0.0001 Å |
| b | 7.52147 ± 0.00011 Å |
| c | 10.31017 ± 0.00011 Å |
| α | 90° |
| β | 109.317 ± 0.0009° |
| γ | 90° |
| Cell volume | 672.728 ± 0.015 Å3 |
| Number of distinct elements | 2 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | A 1 2/a 1 |
| Hall space group symbol | -A 2ya |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 276772 (current) | 2022-07-16 | cif/ Adding structures of 1567272 via cif-deposit CGI script. |
1567272.cif |
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Users of the data should acknowledge the original authors of the
structural data.