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Fe3Ga_P63mmc.cif - relaxed

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Version of · via Relax a crystal structure

Fe3Ga_P63mmc.cif

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Structure

Formula: GaFe₃
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 8
Lattice a, b, c: 5.161 Å5.161 Å4.208 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 97.07 Å³
Density: 8.12 g/cm³

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Structure

Formula: GaFe₃
Space group: P6_3/mmc (194)
Crystal system: Hexagonal
Atoms per cell: 8
Lattice a, b, c: 5.161 Å5.161 Å4.208 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 97.07 Å³
Density: 8.12 g/cm³

Properties

Curie temperature

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Attribution

ARR license

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -57.7193 eV; energy change = -0.2481 eV; symmetry: P6_3/mmc → P6_3/mmc

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Size: 947 B
Type: .cif file
Downloads: 0

Properties

Curie temperature

648 KCHGNet + CatBoost
Predict Curie temperature from a CIF

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4

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Completed assets

Content-Driven Outreach: Next Cycle — Permanent Magnets

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Predict Curie temperature from a CIF, Success

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Overview

Fe3Ga_P63mmc.cif - relaxed

Overview

Structure

Attribution

Connections

Included in datasets

Completed assets

Actions

Structure

Properties

Curie temperature

Attribution

Stats

Properties

Curie temperature

Connections

Included in datasets

Completed assets

Actions

Data

Data