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MAGNDATA: A Collection of magnetic structures with portable cif-type files

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MnCl2(CO(NH2)2)2 (#1.659)

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Magnetic structure with all atoms

Magnetic structure with only magnetic atoms

Reference: J. L. Manson, Q.-Z. Huang, C. M. Brown, J. W. Lynn, M. B. Stone, J. Singleton, F. Xiao, Inorg. Chem. (2015) 54 11897 - 11905
DOI: 10.1021/acs.inorgchem.5b02162
Atomic positions from: same reference

Parent space group (paramagnetic phase): Iba2 (#45)
Propagation vector: k1 (1, 1, 1)

Transition Temperature: 2.99(4) K
Experiment Temperature: 1.4 K

Lattice parameters of the magnetic unit cell:
9.16300 12.57720 7.33980 90.00 90.00 90.00
Transformation from parent structure: (a,b,c;0,1/2,0)
    [View matrix form]

BNS Magnetic Space Group: PIca21 (#29.110) (non-standard)
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Transformation to a standard setting: (a,b,c;1/4,1/4,0)
    [View matrix form]
Systematic absences for this Magnetic Space Group via

Magnetic Point Group: mm2.1' (7.2.21)
    [View symmetry operations]
Symmetry-adapted form of material tensors via
Symmetry-adapted form of material tensors for domain-related equivalent structures via

Positions and magnetic moments of symmetry independent atoms:
From now on, magnetic atoms are in boldface and colored in red. Magnetic moments are expressed in units of μB

     [Show only magnetic atoms]                                             Use MVISUALIZE to:
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LabelAtom typexyzMultiplicitySymmetry constraints on MMxMyMz|M|

    [Show all magnetic atoms in unit cell and their moment relations]

Active Irreps:                                           
Irrep decomposition via

labeldim. small irrepdim. full irrepactionnumber of modes
mX3 1 1 primary 2

Comments (symmetry):

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