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template-Ni(SbO2)2 - relaxed

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Version of · via Relax a crystal structure

template-Ni(SbO2)2

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Structure

Formula: NiSb₂O₄
Space group: P4_2/mbc (135)
Crystal system: Tetragonal
Atoms per cell: 28
Lattice a, b, c: 6.033 Å8.521 Å8.519 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 437.95 Å³
Density: 5.55 g/cm³

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Structure

Formula: NiSb₂O₄
Space group: P4_2/mbc (135)
Crystal system: Tetragonal
Atoms per cell: 28
Lattice a, b, c: 6.033 Å8.521 Å8.519 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 437.95 Å³
Density: 5.55 g/cm³

Properties

Curie temperature

128 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.21 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 = -158.8418 eV; energy change = -0.1805 eV; symmetry: P4_2/m → P4_2/mbc

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Size: 1.71 KB
Type: .cif file
Downloads: 0

Properties

Curie temperature

128 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.21 TCHGNet
Estimate magnetic moments and Ms from a CIF

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Overview

template-Ni(SbO2)2 - 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