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Variscite 10 [AlPO₄cdot(H₂O)₂]

Orthorhombic · space group Pbca (No. 61) · Pearson oP96 · mineral: variscite 10

Symmetry elements and Wyckoff positions (interactive)

Variscite 10 [AlPO₄cdot(H₂O)₂] in Pbca

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

Unit cell

Lattice constants
a = 9.822 Å, b = 8.561 Å, c = 9.630 Å; α = 90.00°, β = 90.00°, γ = 90.00°
Cell volume
809.7 ų
Atoms in the conventional cell
96 (Al 8, H 32, O 48, P 8)
Formula units Z
8
Pearson symbol
oP96 — orthorhombic, primitive lattice, 96 atoms per conventional cell
Symmetry operations
8 per cell

Crystallographic sites

SiteElementWyckoffMultiplicityxyz
Al1Al8c80.13390.15500.1684
H2H8c80.06300.31000.9720
H3H8c80.98800.37100.0680
H4H8c80.36200.20100.1680
H5H8c80.31400.33400.0850
O6O8c80.11180.29870.3152
O7O8c80.04030.58190.2945
O8O8c80.28540.51250.2901
O9O8c80.15000.47920.5122
O10O8c80.06040.32560.0546
O11O8c80.30730.23600.1150
P12P8c80.14780.46840.3528

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 96 atoms drawn above are these sites multiplied by all 8 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

AB4C6D_oP96_61_c_4c_6c_c-001: the stoichiometry comes first (A, B, C… are the elements in alphabetical order of their site labels), then the Pearson symbol oP96, then the space-group number 61, then the Wyckoff letters occupied by each element in turn (Al: 8c; H: 8c; H: 8c; H: 8c; H: 8c; O: 8c; O: 8c; O: 8c; O: 8c; O: 8c; O: 8c; P: 8c). Two structures with the same label are the same arrangement with different cell parameters or coordinates.

Other compounds with this structure

AlAs₄cdot(H₂O)₂ (mansfieldite), CdSeO₄cdot(H₂O)₂, CrSeO₄cdot(H₂O)₂, FeAs₄cdot(H₂O)₂ (scorodite), FeP₄cdot(H₂O)₂ (strengite), GaAsO₄cdot(H₂O)₂, GaPO₄cdot(H₂O)₂, InAsO₄cdot(H₂O)₂ (yanomamite), InPO₄cdot(H₂O)₂, MnSeO₄cdot(H₂O)₂, TlAsO₄cdot(H₂O)₂, TlPO₄cdot(H₂O)₂, ZnSeO₄cdot(H₂O)₂ <!--beginning with an

Note: Variscite.

Source

Coordinates and cell from the AFLOW Encyclopedia of Crystallographic Prototypes, entry AB4C6D_oP96_61_c_4c_6c_c-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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