Crystal Lab › Prototype structures › Hexagonal
WAl₅
Hexagonal · space group P6322 (No. 182) · Pearson hP12
Symmetry elements and Wyckoff positions (interactive)
WAl₅ in P6322
SettingUnit cell
- Lattice constants
- a = 4.902 Å, b = 4.902 Å, c = 8.857 Å; α = 90.00°, β = 90.00°, γ = 120.00°
- Cell volume
- 184.3 ų
- Atoms in the conventional cell
- 12 (Al 10, W 2)
- Formula units Z
- 2
- Pearson symbol
- hP12 — hexagonal / trigonal, primitive lattice, 12 atoms per conventional cell
- Symmetry operations
- 12 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Al1 | Al | 2b | 2 | 0.0000 | 1.0000 | 0.2500 |
| Al2 | Al | 2c | 2 | 0.3333 | 0.6667 | 0.2500 |
| W4 | W | 2d | 2 | 0.3333 | 0.6667 | 0.7500 |
| Al3 | Al | 6g | 6 | 0.6667 | 1.0000 | 0.0000 |
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 12 atoms drawn above are these sites multiplied by all 12 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
A5B_hP12_182_bcg_d-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol hP12, then the space-group number 182, then the Wyckoff letters occupied by each element in turn (Al: 2b; Al: 2c; W: 2d; Al: 6g). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
MoAl₅ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A5B_hP12_182_bcg_d-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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