Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2300664
Preview
Coordinates | 2300664.cif |
---|---|
Structure factors | 2300664.hkl |
Original paper (by DOI) | HTML |
Formula | Fe4 Mn Si3 |
---|---|
Calculated formula | Fe4 Mn Si3 |
Title of publication | Combined X-ray and neutron single-crystal diffraction in diamond anvil cells |
Authors of publication | Grzechnik, Andrzej; Meven, Martin; Paulmann, Carsten; Friese, Karen |
Journal of publication | Journal of Applied Crystallography |
Year of publication | 2020 |
Journal volume | 53 |
Journal issue | 1 |
Pages of publication | 9 - 14 |
a | 6.7705 ± 0.0006 Å |
b | 6.7705 ± 0.0006 Å |
c | 4.7044 ± 0.0002 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 186.76 ± 0.02 Å3 |
Cell temperature | 293 K |
Ambient diffraction temperature | 293 K |
Number of distinct elements | 3 |
Space group number | 193 |
Hermann-Mauguin space group symbol | P 63/m c m |
Hall space group symbol | -P 6c 2 |
Residual factor for all reflections | 0.0622 |
Residual factor for significantly intense reflections | 0.0619 |
Weighted residual factors for significantly intense reflections | 0.0758 |
Weighted residual factors for all reflections included in the refinement | 0.0758 |
Goodness-of-fit parameter for significantly intense reflections | 0 |
Goodness-of-fit parameter for all reflections included in the refinement | 6.02 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.494 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
247891 (current) | 2020-02-05 | cif/ Updating files of 2300663, 2300664 Original log message: Adding full bibliography for 2300663--2300664.cif. |
2300664.cif 2300664.hkl |
246419 | 2020-01-01 | cif/ hkl/ Adding structures of 2300663, 2300664 via cif-deposit CGI script. |
2300664.cif 2300664.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.