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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

Setting
Loading the group…
x = 0.10, y = 0.17, z = 0.08

Unit 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

SiteElementWyckoffMultiplicityxyz
P1P2a20.75000.25000.0000
P2P2c20.25000.25000.6350
U3U2c20.25000.25000.2800

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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