Research/Sitter/MAGNDATA / 1.816_Ba4PrMn3O12.mcif

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Spin lattice of Ba4Pr1Mn3O12Spin lattice of Ba4Pr1Mn3O12

Ba4Pr1Mn3O12

MAGNDATA entry 1.816 · source
noncoplanar magnet
Spins pointing in three dimensions, not confined to a plane.
ordered ≤ 12.2 K (−261 °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 groupR 3 m No. 166
Spinsnoncoplanar · net moment 0 μB per cell
Propagation[1/4 1/4 3/2] 1k
Cella 20.1499 · b 11.5532 · c 10.0241 Å · α 90° · β 109.532° · γ 90°
Transition12.15 K (−261 °C)
Measured at9 K
Magnetic ionsMn, Pr
Largest moment component1.74 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 · 11 sites · CSV
siteelementxyzmambmc|m| (μB)
Ba1_1Ba0.0530.1250.6235
Ba2_1Ba0.82380.1250.46
Pr1_1Pr0.250.3750.25−0.280−0.090.2639
Mn1_1Mn00.1250.250−1.6101.61
Mn2_1Mn0.62930.1250.3290.61−1.74−0.221.8809
O1_1O0.93380.1250.3512
O1_2O0.9410.48540.6269
O1_3O0.9370.24190.1412
O2_1O0.81410.125−0.0337
O2_2O0.81530.260.707
O2_3O0.82190.010.1996

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. E. Regier et al. Inorganic Chemistry (2024) · doi:10.1021/acs.inorgchem.4c03915

Cite the original paper and MAGNDATA, not this mirror.

Original file

⬇ 1.816_Ba4PrMn3O12.mcif from MAGNDATA · entry page

sha256 of this copy: 5375b997086fa94ac66270e8f314cac1dad909109932fd5f386713e84fec46a6
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 1.816_Ba4PrMn3O12.mcif.