Crystal Lab › Prototype structures › Monoclinic
Monoclinic (black) ZnP₂
Monoclinic · space group P121/c1 (No. 14) · Pearson mP24
Symmetry elements and Wyckoff positions (interactive)
Monoclinic (black) ZnP₂ in P121/c1
SettingUnit cell
- Lattice constants
- a = 12.821 Å, b = 7.291 Å, c = 7.561 Å; α = 90.00°, β = 137.49°, γ = 90.00°
- Cell volume
- 477.6 ų
- Atoms in the conventional cell
- 24 (P 16, Zn 8)
- Formula units Z
- 8
- Pearson symbol
- mP24 — monoclinic, primitive lattice, 24 atoms per conventional cell
- Symmetry operations
- 4 per cell
Crystallographic sites
| Site | Element | Wyckoff | Multiplicity | x | y | z |
|---|---|---|---|---|---|---|
| P1 | P | 4e | 4 | 0.6255 | 0.4272 | 0.4095 |
| P2 | P | 4e | 4 | 0.7650 | 0.0197 | 0.3242 |
| P3 | P | 4e | 4 | 0.7572 | 0.4848 | 0.3294 |
| P4 | P | 4e | 4 | 0.9213 | 0.2565 | 0.5256 |
| Zn5 | Zn | 4e | 4 | 0.9195 | 0.7470 | 0.5255 |
| Zn6 | Zn | 4e | 4 | 0.6069 | 0.0965 | 0.3820 |
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 4 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_mP24_14_4e_2e-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol mP24, then the space-group number 14, then the Wyckoff letters occupied by each element in turn (P: 4e; P: 4e; P: 4e; P: 4e; Zn: 4e; Zn: 4e). Two structures with the same label are the same arrangement with different cell parameters or coordinates.
Other compounds with this structure
ZnAs₂ <!--beginning with an
Note: Monoclinic (black) ZnP₂.
Source
Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry A2B_mP24_14_4e_2e-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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