Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4117904
Preview
| Coordinates | 4117904.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Potassium Nickel Selenide |
|---|---|
| Chemical name | Potassium Dinickel Diselenide |
| Formula | K0.95 Ni2 Se2 |
| Calculated formula | K0.955 Ni1.999 Se2 |
| Title of publication | Bonding, Ion Mobility, and Rate-Limiting Steps in Deintercalation Reactions with ThCr2Si2-type KNi2Se2 |
| Authors of publication | James R. Neilson; Tyrel M. McQueen |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2012 |
| Journal volume | 134 |
| Pages of publication | 7750 - 7757 |
| a | 3.9061 ± 0.0001 Å |
| b | 3.9061 Å |
| c | 13.4278 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 204.876 ± 0.007 Å3 |
| Cell temperature | 300 K |
| Ambient diffraction temperature | 300 K |
| Number of distinct elements | 3 |
| Space group number | 139 |
| Hermann-Mauguin space group symbol | I 4/m m m |
| Hall space group symbol | -I 4 2 |
| Goodness-of-fit parameter for all reflections | 6.7 |
| Diffraction radiation wavelength | 0.2127 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 178950 (current) | 2016-03-22 | cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/79. |
4117904.cif |
| 75042 | 2013-03-06 | cif/ Adding structures of 4117904 via cif-deposit CGI script. |
4117904.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.