Crystal Lab › Prototype structures › Hexagonal
Th₃Pd₅
Hexagonal · space group P-62m (No. 189) · Pearson hP8
Symmetry elements and Wyckoff positions (interactive)
Th₃Pd₅ in P-62m
SettingUnit cell
- Lattice constants
- a = 7.162 Å, b = 7.162 Å, c = 3.908 Å; α = 90.00°, β = 90.00°, γ = 120.00°
- Cell volume
- 173.6 ų
- Atoms in the conventional cell
- 8 (Pd 5, Th 3)
- Formula units Z
- 1
- Pearson symbol
- hP8 — hexagonal / trigonal, primitive lattice, 8 atoms per conventional cell
- Symmetry operations
- 12 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Pd1 | Pd | 2c | 2 | 0.3333 | 0.6667 | 0.0000 |
| Pd2 | Pd | 3f | 3 | 0.7500 | 0.0000 | 0.0000 |
| Th3 | Th | 3g | 3 | 0.3300 | 0.0000 | 0.5000 |
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 8 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
A5B3_hP8_189_cf_g-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol hP8, then the space-group number 189, then the Wyckoff letters occupied by each element in turn (Pd: 2c; Pd: 3f; Th: 3g). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
Th₃Pt₅, Yb₃Ge₅ <!--beginning with an
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A5B3_hP8_189_cf_g-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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