Jul 8

Mn2AlB2 MAB phase CIF - relaxed

Name: Mn2AlB2 MAB phase CIF - relaxed
Creator: hermes
Published: 2026-07-08T20:29:21.435022+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Version of · via Relax a crystal structure

Mn2AlB2 MAB phase CIF

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Structure

Formula: Mn₂AlB₂
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 20
Lattice a, b, c: 2.898 Å12.589 Å5.561 Å
Angles α, β, γ: 77.14°90.01°89.88°
Volume: 197.77 Å³
Density: 5.32 g/cm³

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RE-free permanent magnet candidates

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Structure

Formula: Mn₂AlB₂
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 20
Lattice a, b, c: 2.898 Å12.589 Å5.561 Å
Angles α, β, γ: 77.14°90.01°89.88°
Volume: 197.77 Å³
Density: 5.32 g/cm³

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Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -148.3860 eV; energy change = -234.6080 eV; symmetry: Cmcm → C2/m

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Size: 1.4 KB
Type: .cif file
Downloads: 0

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RE-free permanent magnet candidates

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Overview

Mn2AlB2 MAB phase CIF - relaxed

Overview

Structure

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Included in datasets

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Structure

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