Crystal Lab › Prototype structures › Tetragonal
High-Temperature UP₂ P₂U
Tetragonal · space group P4/nmm (No. 129) · Pearson tP6
Symmetry elements and Wyckoff positions (interactive)
High-Temperature UP₂ in P4/nmm
SettingUnit cell
- Lattice constants
- a = 3.808 Å, b = 3.808 Å, c = 7.770 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 112.7 ų
- Atoms in the conventional cell
- 6 (P 4, U 2)
- Formula units Z
- 2
- Pearson symbol
- tP6 — tetragonal, primitive lattice, 6 atoms per conventional cell
- Symmetry operations
- 16 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| P1 | P | 2a | 2 | 0.7500 | 0.2500 | 0.0000 |
| P2 | P | 2c | 2 | 0.2500 | 0.2500 | 0.6350 |
| U3 | U | 2c | 2 | 0.2500 | 0.2500 | 0.2800 |
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 6 atoms drawn above are these sites multiplied by all 16 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
A2B_tP6_129_ac_c-002: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tP6, then the space-group number 129, then the Wyckoff letters occupied by each element in turn (P: 2a; P: 2c; U: 2c). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
AmS₂, AmSe₂, AmTe₂, CeS₂, CeSe₂, CeTe₂, CmS₂, CmSe₂, CmTe₂, DyS₂, DySe₂, DyTe₂, ErS₂, ErSe₂, ErTe₂, GdS₂, GdSe₂, GdTe₂, HfSb₂, HoS₂, HoSe₂, HoTe₂, LaS₂, LaSe₂, LaTe₂, LuS₂, LuSe₂, LuTe₂, NdSe₂, NdTe₂, NpAs₂, NpTe₂, PaAs₂, PaP₂, PaSb₂, PrSe₂, PrTe₂, PuS₂, PuSe₂, PuTe₂, SmSe₂, SmTe₂, TbS₂, TbTe₂, ThAs₂, ThBi₂, ThSb₂, TmS₂, TmSe₂, TmTe₂, UAs₂, UBi₂, UP₂, USb₂, UTe₂, YbS₂, YbSe₂, YbTe₂, YS₂, YSe₂, YTe₂ <!--beginning with an
Note: HT.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2B_tP6_129_ac_c-002 (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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