Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1544345
Preview
| Coordinates | 1544345.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | epsilon-Li2SO4 7.2 GPa and 723 K D.C. |
|---|---|
| Formula | Li2 O4 S |
| Calculated formula | Li2 O4 S |
| SMILES | [Li+].[Li+].S(=O)(=O)([O-])[O-] |
| Title of publication | High-pressure forms of lithium sulphate: structural determination and computer simulation Sample: P = 5.2 GPa and T = 723 K |
| Authors of publication | Parfitt, D.C.; Keen, D.A.; Hull, S.; Crichton, W.A.; Mezouar, M.; Wilson, M.; Madden, P.A. |
| Journal of publication | Physical Review B |
| Year of publication | 2005 |
| Journal volume | 72 |
| Pages of publication | 054121 - 054127 |
| a | 5.3452 ± 0.0002 Å |
| b | 7.9323 ± 0.0003 Å |
| c | 6.0292 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 255.636 ± 0.019 Å3 |
| Number of distinct elements | 3 |
| Space group number | 63 |
| Hermann-Mauguin space group symbol | C m c m |
| Hall space group symbol | -C 2c 2 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 187514 (current) | 2016-10-24 | cif/ Adding structures of 1544345 via cif-deposit CGI script. |
1544345.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.