Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2300639
Preview
| Coordinates | 2300639.cif |
|---|---|
| Structure factors | 2300639.hkl |
| Original paper (by DOI) | HTML |
| Formula | F Fe O3 Se |
|---|---|
| Calculated formula | F Fe O3 Se |
| Title of publication | On the quality of the continuous rotation electron diffraction data for accurate atomic structure determination of inorganic compounds |
| Authors of publication | Wang, Yunchen; Yang, Taimin; Xu, Hongyi; Zou, Xiaodong; Wan, Wei |
| Journal of publication | Journal of Applied Crystallography |
| Year of publication | 2018 |
| Journal volume | 51 |
| Journal issue | 4 |
| a | 4.956 ± 0.001 Å |
| b | 5.202 ± 0.001 Å |
| c | 12.04 ± 0.002 Å |
| α | 90° |
| β | 97.87 ± 0.03° |
| γ | 90° |
| Cell volume | 307.48 ± 0.1 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1655 |
| Residual factor for significantly intense reflections | 0.1439 |
| Weighted residual factors for significantly intense reflections | 0.3737 |
| Weighted residual factors for all reflections included in the refinement | 0.3859 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.181 |
| Diffraction radiation wavelength | 0.0251 Å |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 208877 (current) | 2018-07-06 | cif/ hkl/ Adding structures of 2300634, 2300635, 2300636, 2300637, 2300638, 2300639, 2300640, 2300641, 2300642, 2300643 via cif-deposit CGI script. |
2300639.cif 2300639.hkl |
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.