Crystal Lab › Prototype structures › Cubic
Ce₃Ni₆Si₂
Cubic · space group Im-3m (No. 229) · Pearson cI44
Symmetry elements and Wyckoff positions (interactive)
Ce₃Ni₆Si₂ in Im-3m
SettingUnit cell
- Lattice constants
- a = 8.982 Å, b = 8.982 Å, c = 8.982 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 724.7 ų
- Atoms in the conventional cell
- 44 (Si 8, Ce 12, Ni 24)
- Formula units Z
- 4
- Pearson symbol
- cI44 — cubic, body-centred lattice, 44 atoms per conventional cell
- Symmetry operations
- 96 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Si3 | Si | 8c | 8 | 0.2500 | 0.2500 | 0.2500 |
| Ce1 | Ce | 12e | 12 | 0.2800 | 0.0000 | 0.0000 |
| Ni2 | Ni | 24h | 24 | 0.0000 | 0.3300 | 0.3300 |
The multiplicity and the Wyckoff letter say how many copies of the site the group makes in one cell and on which kind of symmetry element the site sits; the 44 atoms drawn above are these sites multiplied by all 96 operations. Press Wyckoff under Colour to see the sites, and tick a symmetry element on the left to see which atoms lie on it.
How to read the label
A3B6C2_cI44_229_e_h_c-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol cI44, then the space-group number 229, then the Wyckoff letters occupied by each element in turn (Si: 8c; Ce: 12e; Ni: 24h). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
Dy₃Ni₆Si₂, Er₃Ni₆Al₂, Er₃Ni₆Si₂, Eu₃Ni₆Si₂, Gd₃Ni₆Si₂, Ho₃Ni₆Si₂, Lu₃Ni₆Si₂, Nd₃Ni₆Si₂, Pr₃Ni₆Si₂, Sm₃Ni₆Si₂, Tb₃Ni₆Si₂, Tm₃Ni₆Si₂, U₃Ni₆Ge₂, U₃Ni₆Si₂, Yb₃Ni₆Si₂ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A3B6C2_cI44_229_e_h_c-001 (M. J. Mehl et al., Comput. Mater. Sci. 136, S1 (2017); D. Hicks et al., ibid. 161, S1 (2019) and 199, 110450 (2021); S. Eckert et al., ibid. 240, 112988 (2024)). Symmetry elements, Wyckoff assignment and the diagram are computed on this page from the group operations.
← γ-brass (Fe₃Zn₁₀, D8₁) · Space group Im-3m (14 prototypes) · All prototypes · High-pressure (200GPa) H₃S →