Crystal Lab › Prototype structures › Tetragonal
U₆Mn (D2_{c})
Tetragonal · space group I4/mcm (No. 140) · Pearson tI28 · Strukturbericht D2c
Symmetry elements and Wyckoff positions (interactive)
U₆Mn (D2_{c}) in I4/mcm
SettingUnit cell
- Lattice constants
- a = 10.290 Å, b = 10.290 Å, c = 5.240 Å; α = 90.00°, β = 90.00°, γ = 90.00°
- Cell volume
- 554.8 ų
- Atoms in the conventional cell
- 28 (Mn 4, U 24)
- Formula units Z
- 4
- Pearson symbol
- tI28 — tetragonal, body-centred lattice, 28 atoms per conventional cell
- Symmetry operations
- 32 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| Mn1 | Mn | 4a | 4 | 0.0000 | 0.0000 | 0.2500 |
| U2 | U | 8h | 8 | 0.4068 | 0.9068 | 0.0000 |
| U3 | U | 16k | 16 | 0.2141 | 0.1021 | 0.0000 |
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 28 atoms drawn above are these sites multiplied by all 32 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
AB6_tI28_140_a_hk-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol tI28, then the space-group number 140, then the Wyckoff letters occupied by each element in turn (Mn: 4a; U: 8h; U: 16k). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
Pu₆Co, Pu₆Fe, U₆Co, U₆Fe, U₆Ni, U₆Np <!--beginning with an
Note: D2_{c}.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB6_tI28_140_a_hk-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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