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S₃U₄

Cubic · space group Pm-3m (No. 221) · Pearson cP7

Symmetry elements and Wyckoff positions (interactive)

S₃U₄ in Pm-3m

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

Unit cell

Lattice constants
a = 5.490 Å, b = 5.490 Å, c = 5.490 Å; α = 90.00°, β = 90.00°, γ = 90.00°
Cell volume
165.5 ų
Atoms in the conventional cell
7 (U 4, S 3)
Formula units Z
1
Pearson symbol
cP7 — cubic, primitive lattice, 7 atoms per conventional cell
Symmetry operations
48 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
U2U1a10.00000.00000.0000
U3U3c30.00000.50000.5000
S1S3d30.50000.00000.0000

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 7 atoms drawn above are these sites multiplied by all 48 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

A3B4_cP7_221_d_ac-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol cP7, then the space-group number 221, then the Wyckoff letters occupied by each element in turn (U: 1a; U: 3c; S: 3d). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Other compounds with this structure

NbC <!--beginning with an

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A3B4_cP7_221_d_ac-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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