CaBaCo2Fe2O7
MAGNDATA entry 1.0.17 · source
noncoplanar magnet
Spins pointing in three dimensions, not confined to a plane.
ordered ≤ 160 K (−113 °C)Colour: where that sits relative to 25 °C. Saturation: how much margin it has.Research/Sitter/MAGNDATA / 1.0.17_CaBaCo2Fe2O7.mcif
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| Magnetic group | P 3 1 m′ BNS 157.55 |
| Parent space group | P 63 m c No. 186 |
| Spins | noncoplanar · net moment 0 μB per cell |
| Propagation | [1/3 1/3 0] 1k |
| Cell | a 19.2 · b 19.2 · c 10.35 Å · α 90° · β 90° · γ 120° |
| Transition | 160 K (−113 °C) |
| Measured at | 80 K |
| Magnetic ions | Co, Fe |
| Largest moment component | 3.15 μB |
| Method | NSD |
| site | element | x | y | z | ma | mb | mc | |m| (μB) |
|---|---|---|---|---|---|---|---|---|
| Ca1_1 | Ca | 0.1111 | 0.2222 | 0.3703 | ||||
| Ca1_2 | Ca | 0.2222 | 0.1111 | 0.8703 | ||||
| Ca1_3 | Ca | 0.2222 | 0.4444 | 0.8703 | ||||
| Ba1_1 | Ba | 0.1111 | 0.2222 | 0 | ||||
| Ba1_2 | Ba | 0.2222 | 0.1111 | 0.5 | ||||
| Ba1_3 | Ba | 0.2222 | 0.4444 | 0.5 | ||||
| Co1_1 | Co | 0.9431 | 0.0569 | 0.1806 | −1.58 | −2.44 | −0.46 | 2.1924 |
| Co1_2 | Co | 0.9431 | 0.8861 | 0.1806 | −0.95 | −1.9 | 1.45 | 2.1932 |
| Co1_3 | Co | 0.0569 | 0.9431 | 0.6806 | −1.24 | −2.48 | 0.42 | 2.1884 |
| Co1_4 | Co | 0.0569 | 0.1139 | 0.6806 | −0.99 | −1.98 | −1.37 | 2.1948 |
| Fe1_1 | Fe | 0 | 0 | 0.435 | 1.575 | 3.15 | 0 | 2.728 |
| Fe1_2 | Fe | 0 | 0 | 0.935 | 1.575 | 3.15 | 0 | 2.728 |
| O1_1 | O | 0.8349 | 0.1651 | 0.2375 | ||||
| O1_2 | O | 0.1682 | 0.3364 | 0.2375 | ||||
| O1_4 | O | 0.6698 | 0.8349 | 0.7375 | ||||
| O1_5 | O | 0.1651 | 0.3302 | 0.7375 | ||||
| O2_1 | O | 0 | 0 | 0.2473 | ||||
| O2_2 | O | 0 | 0 | 0.7473 | ||||
| O3_1 | O | 0.1041 | 0.0333 | 0.9966 | ||||
| O3_2 | O | 0.1041 | 0.3666 | 0.9966 | ||||
| O3_3 | O | 0.7707 | 0.0333 | 0.9966 | ||||
| O3_4 | O | 0.0708 | 0.1041 | 0.4966 | ||||
| O3_5 | O | 0.0708 | 0.4374 | 0.4966 | ||||
| O3_6 | O | 0.4041 | 0.4374 | 0.4966 |
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.
J.D. Reim et al. Phys. Rev. B (2018) · doi:10.1103/PhysRevB.97.144402
Cite the original paper and MAGNDATA, not this mirror.
⬇ 1.0.17_CaBaCo2Fe2O7.mcif from MAGNDATA · entry page
sha256 of this copy: a82bc1a4f53cdeda330693398448a65bcc1cb82066d8079d35ce68a946d02e95
The mirror keeps the bytes Bilbao served, so the original should hash the same unless MAGNDATA has revised the entry since: shasum -a 256 1.0.17_CaBaCo2Fe2O7.mcif.