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Information card for entry 20000170
Preview
| Coordinates | 20000170.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Zr |
|---|---|
| Calculated formula | Zr |
| Title of publication | Error Estimates for Solid-State Density-Functional Theory Predictions: An Overview by Means of the Ground-State Elemental Crystals |
| Authors of publication | Lejaeghere, K.; Van Speybroeck, V.; Van Oost, G.; Cottenier, S. |
| Journal of publication | Critical Reviews in Solid State and Materials Sciences |
| Year of publication | 2014 |
| Journal volume | 39 |
| Journal issue | 1 |
| Pages of publication | 1 |
| a | 3.23603 Å |
| b | 3.23603 Å |
| c | 5.18953 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 47.063 Å3 |
| Number of distinct elements | 1 |
| Hermann-Mauguin symmetry space group | P 63/m m c |
| Hall symmetry space group | -P 6c 2c |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275 (current) | 2015-06-16 | cif/ Replacing tag _cod_database_code -> _tcod_database_code. |
20000170.cif |
| 181 | 2013-10-30 | cif/ Adding structures of 20000170 via cif-deposit CGI script. |
20000170.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
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.
Users of the data should acknowledge the original authors of the
structural data.