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template-LiMn4O8 - relaxed

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Version of · via Relax a crystal structure

template-LiMn4O8

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template-LiMn4O8 - relaxed 1

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Structure

Formula: LiMn₄O₈
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 13
Lattice a, b, c: 5.951 Å6.129 Å6.077 Å
Angles α, β, γ: 56.94°61.27°89.39°
Volume: 153.04 Å³
Density: 3.85 g/cm³

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RE-free permanent magnet candidates

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Structure

Formula: LiMn₄O₈
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 13
Lattice a, b, c: 5.951 Å6.129 Å6.077 Å
Angles α, β, γ: 56.94°61.27°89.39°
Volume: 153.04 Å³
Density: 3.85 g/cm³

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ARR license

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -90.7339 eV; energy change = -0.5449 eV; symmetry: R-3m → C2/m

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Size: 1.12 KB
Type: .cif file
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RE-free permanent magnet candidates

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template-LiMn4O8 - relaxed

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Structure

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