Research/Sitter/MAGNDATA / 1.726_RuCl3.mcif

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Spin lattice of Ru1Cl3Spin lattice of Ru1Cl3

Ru1Cl3

MAGNDATA entry 1.726 · source
antiferromagnet
No net magnetisation, and up and down sublattices are related by a shift or by inversion, so the bands stay spin-degenerate: a conventional antiferromagnet.
Spin group ¹1̄ × ²1: each symmetry marked ¹ keeps every spin, ² swaps up and down.
ordered ≤ 14 K (−259 °C)Colour: where that sits relative to 25 °C. Saturation: how much margin it has.
Structure · 11 properties
Magnetic groupCc 2 BNS 5.16
Point group21′
Parent space groupP 31 1 2 No. 151
Spinscollinear · net moment 0 μB per cell
Propagation[1/2 0 1/2] 1k
Cella 11.92 · b 5.96 · c 34.4 Å · α 90° · β 90° · γ 120°
Transition14 K (−259 °C)
Measured at1.8 K
Magnetic ionsRu
Largest moment component0.58 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 Cc 2 →
Atom sites · 13 sites · CSV
siteelementxyzmambmc|m| (μB)
Ru1_1Ru0.2220.5560.16670.580.2900.5023
Ru1_2Ru0.5560.55600.580.2900.5023
Ru2_1Ru0.3890.2220.16670.580.2900.5023
Ru2_2Ru0.2220.2220−0.58−0.2900.5023
Cl1_1Cl0.3890.5560.4583
Cl1_2Cl0.7220.2220.625
Cl1_3Cl0.8890.2220.7917
Cl2_1Cl0.2220.8890.4583
Cl2_2Cl0.55550.5550.625
Cl2_3Cl0.22250.5560.7917
Cl3_1Cl0.05550.2220.4583
Cl3_2Cl0.8890.8890.625
Cl3_3Cl0.05550.8890.7917

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

C. Ritter et al. Journal of Physics: Conference Series (2016) · doi:10.1088/1742-6596/746/1/012060

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 1.726_RuCl3.mcif from MAGNDATA · entry page

sha256 of this copy: 0943b9d8212c588cb92108ad16e6e7346ce0c6b338749b26aba622b6e96eebcc
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 1.726_RuCl3.mcif.