Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4003973
Preview
| Coordinates | 4003973.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | GaMo4Se8 |
|---|---|
| Chemical name | GaMo4Se8 |
| Formula | Ga Mo4 Se8 |
| Calculated formula | Ga Mo4 Se8 |
| Title of publication | Mode Crystallography Analysis through the Structural Phase Transition and Magnetic Critical Behavior of the Lacunar Spinel GaMo4Se8 |
| Authors of publication | Routledge, Kieran; Vir, Praveen; Cook, Nicholas; Murgatroyd, Philip A. E.; Ahmed, Sheikh J.; Savvin, Stanislav N.; Claridge, John B.; Alaria, Jonathan |
| Journal of publication | Chemistry of Materials |
| Year of publication | 2021 |
| a | 7.21984 ± 0.00004 Å |
| b | 7.21984 ± 0.00004 Å |
| c | 17.44441 ± 0.00012 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 787.485 ± 0.008 Å3 |
| Cell temperature | 40 K |
| Ambient diffraction temperature | 40 K |
| Number of distinct elements | 3 |
| Space group number | 160 |
| Hermann-Mauguin space group symbol | R 3 m :H |
| Hall space group symbol | R 3 -2" |
| Residual factor R(I) for significantly intense reflections | 3.1209 |
| Goodness-of-fit parameter for all reflections | 2.0291 |
| Method of determination | powder diffraction |
| Diffraction radiation wavelength | 1.594 Å |
| Diffraction radiation type | Neutron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 267297 (current) | 2021-07-07 | cif/ Adding structures of 4003973, 4003974, 4003975 via cif-deposit CGI script. |
4003973.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.