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π-FeMg₃Al₈Si₆ (E9_{b})

Hexagonal · space group P-62m (No. 189) · Pearson hP18 · Strukturbericht E9b

Symmetry elements and Wyckoff positions (interactive)

π-FeMg₃Al₈Si₆ (E9_{b}) in P-62m

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

Unit cell

Lattice constants
a = 6.620 Å, b = 6.620 Å, c = 7.960 Å; α = 90.00°, β = 90.00°, γ = 120.00°
Cell volume
302.1 ų
Atoms in the conventional cell
18 (Al 8, Fe 1, Mg 3, Si 6)
Formula units Z
1
Pearson symbol
hP18 — hexagonal / trigonal, primitive lattice, 18 atoms per conventional cell
Symmetry operations
12 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
Al1Al1a10.00000.00000.0000
Fe4Fe1b10.00000.00000.5000
Mg5Mg3f30.44400.00000.0000
Al2Al3g30.40300.00000.5000
Al3Al4h40.33330.66670.7310
Si6Si6i60.75000.00000.7220

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 18 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

A8BC3D6_hP18_189_agh_b_f_i-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol hP18, then the space-group number 189, then the Wyckoff letters occupied by each element in turn (Al: 1a; Fe: 1b; Mg: 3f; Al: 3g; Al: 4h; Si: 6i). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Note: E9_{b}, \pi-FeMg₃Al₈Si₆.

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A8BC3D6_hP18_189_agh_b_f_i-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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