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CoO AFM magnetic moments (Co ±2.73 μB, PBE+U)

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Version of · via Magnetic ordering (FM vs AFM)

CoO (F-43m): Matra-Genoa structure (on hull)

From Co-Li-O: Matra-Genoa phase diagram (10 near hull, 7 new)

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Structure

Formula: CoO
Space group: F-43m (216)
Crystal system: Cubic
Atoms per cell: 4
Lattice a, b, c: 3.260 Å4.610 Å3.260 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 48.98 Å³
Density: 5.08 g/cm³

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Structure

Formula: CoO
Space group: F-43m (216)
Crystal system: Cubic
Atoms per cell: 4
Lattice a, b, c: 3.260 Å4.610 Å3.260 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 48.98 Å³
Density: 5.08 g/cm³

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Ground-state AFM Mulliken magnetic moments from ABACUS DFT (PBE+U): antiferromagnetic, net 0.00 μB/cell. Site moments: Co -2.73 to 2.73 μB. magCIF (_atom_site_moment) for visualization.

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Size: 1.13 KB
Type: .cif file
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Overview

CoO AFM magnetic moments (Co ±2.73 μB, PBE+U)

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Structure

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Structure

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