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Fe-Bi-S gen_10 - relaxed - 4x4x4 supercell

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Fe-Bi-S gen_10 - relaxed

From Fe-Bi-S gen_10

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Structure

Formula: FeBiS₂
Space group: P2_1/m (11)
Crystal system: Monoclinic
Atoms per cell: 512
Lattice a, b, c: 22.725 Å13.741 Å33.955 Å
Angles α, β, γ: 90.00°102.34°90.00°
Volume: 10358.23 Å³
Density: 6.75 g/cm³

Attribution

Connections

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Included in datasets

RE-free permanent magnet candidates

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Structure

Formula: FeBiS₂
Space group: P2_1/m (11)
Crystal system: Monoclinic
Atoms per cell: 512
Lattice a, b, c: 22.725 Å13.741 Å33.955 Å
Angles α, β, γ: 90.00°102.34°90.00°
Volume: 10358.23 Å³
Density: 6.75 g/cm³

Properties

Curie temperature

166 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.06 TCHGNet
Estimate magnetic moments and Ms from a CIF

Attribution

ARR license

Supercell 4x4x4 of FeBiS2 (Space group: P2_1/m, 256 symmetry operations)

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Stats

Size: 7.75 KB
Type: .cif file
Downloads: 1

Properties

Curie temperature

166 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.06 TCHGNet
Estimate magnetic moments and Ms from a CIF

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Connections

1

Included in datasets

RE-free permanent magnet candidates

DataData

DataData

Overview

Fe-Bi-S gen_10 - relaxed - 4x4x4 supercell

Overview

Structure

Attribution

Connections

Included in datasets

Actions

Structure

Properties

Curie temperature

Saturation magnetization

Attribution

Stats

Properties

Curie temperature

Saturation magnetization

Connections

Included in datasets

Actions

Data

Data