Research/Sitter/MAGNDATA / 2.9_Ca3CuNi2(PO4)4.mcif

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Spin lattice of Ca3CuNi2(PO4)4Spin lattice of Ca3CuNi2(PO4)4

Ca3CuNi2(PO4)4

MAGNDATA entry 2.9 · source
noncoplanar magnet
Spins pointing in three dimensions, not confined to a plane.
ordered ≤ 20 K (−253 °C)Colour: where that sits relative to 25 °C. Saturation: how much margin it has.
Structure · 11 properties
Magnetic groupCa 2/c BNS 15.91
Point group2/m1′
Parent space groupC 2/c No. 15
Spinsnoncoplanar · net moment 0 μB per cell
Propagation[1/2 1/2 0] · [-1/2 1/2 0] 2k
Cella 35.4348 · b 9.6422 · c 17.8475 Å · α 90° · β 123.64° · γ 90°
Transition20 K (−253 °C)
Measured at1.5 K
Magnetic ionsCu, Ni
Largest moment component1.7917 μB
MethodNPD

Symmetry

Stereogram of the magnetic point group: each operation applied to one direction. Filled = upper hemisphere, ring = lower; red operations include time reversal. Lines are mirrors; polygons are 2/3/4/6-fold axes; the centre ring is inversion.

Every structure in Ca 2/c →
Atom sites · 28 sites · CSV
siteelementxyzmambmc|m| (μB)
Cu1_1Cu00.2500.3228−0.1426−0.36010.6189
Cu1_2Cu0.7500−0.32280.14260.36010.6189
Ni2_1Ni0.310.26810.96710.1539−0.1984−1.79171.8918
Ni2_2Ni0.060.01810.9671−0.15390.19841.79171.8918
Ca1_1Ca00.47550.25
Ca1_2Ca0.250.72550.25
Ca2_1Ca0.38340.2220.3614
Ca2_2Ca0.63330.47210.3614
P1_1P0.04660.49580.1257
P1_2P0.29670.74580.1257
P2_1P0.17030.47490.1111
P2_2P0.42030.72490.1111
O1_1O0.08960.04060.2121
O1_2O0.33970.29050.2121
O2_1O0.25550.26070.1301
O2_2O0.50560.51070.1301
O3_1O0.05080.34840.0995
O3_2O0.30090.59840.0995
O4_1O0.04010.09060.0477
O4_2O0.290.34060.0477
O5_1O0.1990.05190.1972
O5_2O0.4490.30190.1972
O6_1O0.17820.02410.0381
O6_2O0.42810.27410.0381
O7_1O0.42710.06720.122
O7_2O0.67710.31710.122
O8_1O0.12060.49830.0806
O8_2O0.37060.74830.0806

Moment components are along the crystal axes a, b, c (μB), as magCIF writes them. Symmetry generates the rest of the cell from these sites.

Source

V.Y. Pomjakushin et al. PHYSICAL REVIEW B (2007) · doi:10.1103/PhysRevB.76.174433

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 2.9_Ca3CuNi2(PO4)4.mcif from MAGNDATA · entry page

sha256 of this copy: bb8baf002eb2b9193af5da1c7ca94e9cc3e4914c3e663c4264b200df08c6bd05
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 2.9_Ca3CuNi2(PO4)4.mcif.