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template-Sr2CoCuSO3 - relaxed

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Version of · via Relax a crystal structure

template-Sr2CoCuSO3

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Structure

Formula: Sr₂CoCuSO₃
Space group: P4mm (99)
Crystal system: Tetragonal
Atoms per cell: 16
Lattice a, b, c: 3.899 Å3.899 Å16.010 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 243.36 Å³
Density: 5.16 g/cm³

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Structure

Formula: Sr₂CoCuSO₃
Space group: P4mm (99)
Crystal system: Tetragonal
Atoms per cell: 16
Lattice a, b, c: 3.899 Å3.899 Å16.010 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 243.36 Å³
Density: 5.16 g/cm³

Properties

Curie temperature

146 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.30 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 = -90.1828 eV; energy change = -0.0146 eV; symmetry: P4mm → P4mm

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Size: 1.26 KB
Type: .cif file
Downloads: 0

Properties

Curie temperature

146 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.30 TCHGNet
Estimate magnetic moments and Ms from a CIF

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DataData

DataData

Overview

template-Sr2CoCuSO3 - 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