inJun 29

template-CrFeSnTe4 - relaxed

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Version of · via Relax a crystal structure

template-CrFeSnTe4

1313

Structure

Formula: CrFeSnTe₄
Space group: R3m (160)
Crystal system: Trigonal
Atoms per cell: 7
Lattice a, b, c: 15.099 Å15.096 Å15.096 Å
Angles α, β, γ: 15.74°15.73°15.73°
Volume: 220.45 Å³
Density: 5.55 g/cm³

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Structure

Formula: CrFeSnTe₄
Space group: R3m (160)
Crystal system: Trigonal
Atoms per cell: 7
Lattice a, b, c: 15.099 Å15.096 Å15.096 Å
Angles α, β, γ: 15.74°15.73°15.73°
Volume: 220.45 Å³
Density: 5.55 g/cm³

Properties

Curie temperature

210 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.29 TCHGNet
Estimate magnetic moments and Ms from a CIF

Attribution

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -34.8880 eV; energy change = -5.0734 eV; symmetry: R3m → R3m

ARR license

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Stats

Size: 926 B
Type: .cif file
Downloads: 0

Properties

Curie temperature

210 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.29 TCHGNet
Estimate magnetic moments and Ms from a CIF

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Overview

template-CrFeSnTe4 - relaxed

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