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Intermediate Temperature TmNi₂ Ni₂Tm

Cubic · space group P-43m (No. 215) · Pearson cP24

Symmetry elements and Wyckoff positions (interactive)

Intermediate Temperature TmNi₂ in P-43m

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

Unit cell

Lattice constants
a = 7.100 Å, b = 7.100 Å, c = 7.100 Å; α = 90.00°, β = 90.00°, γ = 90.00°
Cell volume
357.9 ų
Atoms in the conventional cell
24 (Tm 8, Ni 16)
Formula units Z
8
Pearson symbol
cP24 — cubic, primitive lattice, 24 atoms per conventional cell
Symmetry operations
24 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
Tm3Tm1a10.00000.00000.0000
Tm4Tm3c30.00000.50000.5000
Ni1Ni4e40.62200.62200.6220
Tm5Tm4e40.27100.27100.2710
Ni2Ni12i120.12200.12200.6120

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 24 atoms drawn above are these sites multiplied by all 24 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_cP24_215_ei_ace-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol cP24, then the space-group number 215, then the Wyckoff letters occupied by each element in turn (Tm: 1a; Tm: 3c; Ni: 4e; Tm: 4e; Ni: 12i). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Note: 700^\circC.

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2B_cP24_215_ei_ace-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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