Crystal Lab › Prototype structures › Monoclinic
Os₄Al₁₃
Monoclinic · space group C12/m1 (No. 12) · Pearson mC34
Symmetry elements and Wyckoff positions (interactive)
Os₄Al₁₃ in C12/m1
SettingUnit cell
- Lattice constants
- a = 17.640 Å, b = 4.228 Å, c = 7.773 Å; α = 90.00°, β = 115.15°, γ = 90.00°
- Cell volume
- 524.8 ų
- Atoms in the conventional cell
- 34 (Al 26, Os 8)
- Formula units Z
- 2
- Pearson symbol
- mC34 — monoclinic, base-centred lattice, 34 atoms per conventional cell
- Symmetry operations
- 8 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Al1 | Al | 2a | 2 | 0.0000 | 0.0000 | 0.0000 |
| Al2 | Al | 4i | 4 | 0.9130 | 0.0000 | 0.6320 |
| Al3 | Al | 4i | 4 | 0.2430 | 0.0000 | 0.3870 |
| Al4 | Al | 4i | 4 | 0.3680 | 0.0000 | 0.8380 |
| Al5 | Al | 4i | 4 | 0.7100 | 0.0000 | 0.9130 |
| Al6 | Al | 4i | 4 | 0.5860 | 0.0000 | 0.5680 |
| Al7 | Al | 4i | 4 | 0.0910 | 0.0000 | 0.8060 |
| Os8 | Os | 4i | 4 | 0.2060 | 0.0000 | 0.7085 |
| Os9 | Os | 4i | 4 | 0.5081 | 0.0000 | 0.8053 |
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 34 atoms drawn above are these sites multiplied by all 8 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
A13B4_mC34_12_a6i_2i-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol mC34, then the space-group number 12, then the Wyckoff letters occupied by each element in turn (Al: 2a; Al: 4i; Al: 4i; Al: 4i; Al: 4i; Al: 4i; Al: 4i; Os: 4i; Os: 4i). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A13B4_mC34_12_a6i_2i-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.
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