inJul 3

Altermagnet RuO2 rutile CIF - relaxed

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Version of · via Relax a crystal structure

Altermagnet RuO2 rutile CIF

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Structure

Formula: RuO₂
Space group: P4_2/mnm (136)
Crystal system: Tetragonal
Atoms per cell: 6
Lattice a, b, c: 4.536 Å4.536 Å3.141 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 64.63 Å³
Density: 6.84 g/cm³

Attribution

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Included in datasets

CIF calculated properties

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Structure

Formula: RuO₂
Space group: P4_2/mnm (136)
Crystal system: Tetragonal
Atoms per cell: 6
Lattice a, b, c: 4.536 Å4.536 Å3.141 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 64.63 Å³
Density: 6.84 g/cm³

Properties

Curie temperature

234 KCHGNet + CatBoost
Predict Curie temperature from a CIF

Attribution

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -44.3109 eV; energy change = -0.0632 eV; symmetry: P4_2/mnm → P4_2/mnm

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Size: 857 B
Type: .cif file
Downloads: 1

Properties

Curie temperature

234 KCHGNet + CatBoost
Predict Curie temperature from a CIF

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Connections

1

Included in datasets

CIF calculated properties

Actions

Predict Curie temperature from a CIF, Success

DataData

DataData

Overview

Altermagnet RuO2 rutile CIF - relaxed

Overview

Structure

Attribution

Connections

Included in datasets

Actions

Structure

Properties

Curie temperature

Attribution

Stats

Properties

Curie temperature

Connections

Included in datasets

Actions

Data

Data