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Fe2MnSn C-doped 12.5at% D019 - relaxed

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Version of · via Relax a crystal structure

Fe2MnSn C-doped 12.5at% D019

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Structure

Formula: Mn₂Fe₄Sn₂C
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 9
Lattice a, b, c: 5.286 Å5.286 Å4.752 Å
Angles α, β, γ: 91.31°88.70°118.18°
Volume: 117.01 Å³
Density: 8.27 g/cm³

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Structure

Formula: Mn₂Fe₄Sn₂C
Space group: C2/m (12)
Crystal system: Monoclinic
Atoms per cell: 9
Lattice a, b, c: 5.286 Å5.286 Å4.752 Å
Angles α, β, γ: 91.31°88.70°118.18°
Volume: 117.01 Å³
Density: 8.27 g/cm³

Properties

Curie temperature

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Predict Curie temperature from a CIF

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Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -68.4832 eV; energy change = -67.5454 eV; symmetry: Amm2 → C2/m

Properties

Curie temperature

367 KCHGNet + CatBoost
Predict Curie temperature from a CIF

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Size: 1005 B
Type: .cif file
Downloads: 1

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3

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Content-Driven Outreach: Next Cycle — Permanent Magnets

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Predict Curie temperature from a CIF, Success

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Overview

Fe2MnSn C-doped 12.5at% D019 - relaxed

Overview

Structure

Attribution

Connections

Included in datasets

Completed assets

Actions

Structure

Properties

Curie temperature

Attribution

Properties

Curie temperature

Stats

Connections

Included in datasets

Completed assets

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Data

Data