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template-Li3Mn3SbO8 - relaxed

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Version of · via Relax a crystal structure

template-Li3Mn3SbO8

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Structure

Formula: Li₃Mn₃SbO₈
Space group: R-3m (166)
Crystal system: Trigonal
Atoms per cell: 15
Lattice a, b, c: 6.120 Å6.120 Å6.120 Å
Angles α, β, γ: 60.87°60.86°60.86°
Volume: 165.20 Å³
Density: 4.38 g/cm³

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Structure

Formula: Li₃Mn₃SbO₈
Space group: R-3m (166)
Crystal system: Trigonal
Atoms per cell: 15
Lattice a, b, c: 6.120 Å6.120 Å6.120 Å
Angles α, β, γ: 60.87°60.86°60.86°
Volume: 165.20 Å³
Density: 4.38 g/cm³

Properties

Curie temperature

83 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.93 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 = -97.4839 eV; energy change = 0.0023 eV; symmetry: R-3m → R-3m

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Size: 1.21 KB
Type: .cif file
Downloads: 0

Properties

Curie temperature

83 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Saturation magnetization

0.93 TCHGNet
Estimate magnetic moments and Ms from a CIF

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Overview

template-Li3Mn3SbO8 - 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