Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4332948
Preview
| Coordinates | 4332948.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | Fe4 Si9.9 Yb1.2 |
|---|---|
| Calculated formula | Fe4 Si9.914 Yb1.07 |
| Title of publication | Superstructure in RE2-xFe4Si14-y(RE = Y, Gd–Lu) Characterized by Diffraction, Electron Microscopy, and Mössbauer Spectroscopy |
| Authors of publication | Han, Mi-Kyung; Wu, Ya-Qiao; Kramer, Matthew; Vatovez, Benjamin; Grandjean, Fernande; Long, Gary J.; Miller, Gordon J. |
| Journal of publication | Inorganic Chemistry |
| Year of publication | 2006 |
| Journal volume | 45 |
| Journal issue | 26 |
| Pages of publication | 10503 - 10519 |
| a | 3.9493 ± 0.0006 Å |
| b | 3.9493 ± 0.0006 Å |
| c | 15.327 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 207.03 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 194 |
| Hermann-Mauguin space group symbol | P 63/m m c |
| Hall space group symbol | -P 6c 2c |
| Residual factor for all reflections | 0.0189 |
| Residual factor for significantly intense reflections | 0.0188 |
| Weighted residual factors for significantly intense reflections | 0.0487 |
| Weighted residual factors for all reflections included in the refinement | 0.0487 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.154 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288069 (current) | 2023-12-06 | cif/4/33/29/ Corrected multiple data names and values by replacing substring 'Yb' with substring 'Er', e.g. data name '_reflns_numbyb_total' was changed to '_reflns_number_total'. These mistakes were present in the original data file and were not introduced as part of the data deposition or curation process. |
4332948.cif |
| 176467 | 2016-02-16 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4. |
4332948.cif |
| 98663 | 2014-01-30 | cif/ Adding structures of 4332948 via cif-deposit CGI script. |
4332948.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.