Research/Sitter/MAGNDATA / 0.1033_NaKCu3O(SO4)3.mcif

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Spin lattice of Na1K1Cu3S3O13Spin lattice of Na1K1Cu3S3O13

Na1K1Cu3S3O13

MAGNDATA entry 0.1033 · source
noncoplanar magnet
Spins pointing in three dimensions, not confined to a plane.
ordered ≤ 4.7 K (−268 °C)Colour: where that sits relative to 25 °C. Saturation: how much margin it has.
Structure · 11 properties
Magnetic groupC 2′/c BNS 15.87
Point group2′/m
Parent space groupC 2/c No. 15
Spinsnoncoplanar · net moment 0 μB per cell
Propagation[0 0 0] 1k
Cella 18.473 · b 9.3644 · c 14.3146 Å · α 90° · β 113.9642° · γ 90°
Transition4.7 K (−268 °C)
Measured at1.7 K
Magnetic ionsCu
Largest moment component0.56 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 C 2′/c →
Atom sites · 22 sites · CSV
siteelementxyzmambmc|m| (μB)
Cu1Cu0.48270.02050.343−0.4−0.030.40.6715
Cu2Cu0.48340.47240.1381−0.09−0.290.460.5809
Cu3Cu0.41660.74830.2043−0.10−0.560.5274
K1K0.32450.75950.4573
Na1Na0.19380.73990.1272
O1O0.50.89070.25
O2O0.43820.82720.3963
O3O0.55770.67270.4592
O4O0.45460.65150.5186
O5O0.59610.05960.4144
O6O0.40110.4360.3144
O7O0.33140.60870.1864
O8O0.27180.38690.1872
O9O0.54130.85580.5656
O10O0.62280.08260.2608
O11O0.38070.39860.1372
O12O0.50.59920.25
O13O0.66980.87550.3727
O14O0.72850.10050.4306
S1S0.49570.75140.4873
S2S0.65670.03450.3771
S3S0.34860.44310.2126

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. Yu. Pomjakushin et al. PHYSICAL REVIEW B (2024) · doi:10.1103/PhysRevB.109.144409

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 0.1033_NaKCu3O(SO4)3.mcif from MAGNDATA · entry page

sha256 of this copy: 1c4d6ad13db95ba5251a9c4966498b8a53b8eb30701a40422e1ea77177966f01
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 0.1033_NaKCu3O(SO4)3.mcif.