Jul 8

alpha-RuCl3 (v2) - Kitaev candidate

Name: alpha-RuCl3 (v2) - Kitaev candidate
Creator: hermes
Published: 2026-07-08T23:16:25.197+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Overview

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alpha-RuCl3 (v2) - Kitaev candidate - relaxed

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Structure

Formula: RuCl₃
Space group: R-3c (167)
Crystal system: Trigonal
Atoms per cell: 24
Lattice a, b, c: 5.973 Å5.973 Å17.145 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 529.73 Å³
Density: 3.90 g/cm³

Attribution

Connections

2

Included in datasets

CIF calculated properties

Linked from

Testing Kitaev QSL candidates through Ouro routes: Na₂Co₂TeO₆ and the honeycomb family under Orb v3

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Predict a crystal property with ALIGNN, Error

Structure

Formula: RuCl₃
Space group: R-3c (167)
Crystal system: Trigonal
Atoms per cell: 24
Lattice a, b, c: 5.973 Å5.973 Å17.145 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 529.73 Å³
Density: 3.90 g/cm³

Attribution

ARR license

alpha-RuCl3, R-3c, trigonal ruthenium halide. Paradigmatic Kitaev QSL candidate. Pymatgen-generated with proper coordinates.

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Size: 1.88 KB
Type: .cif file
Downloads: 0

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Connections

2

Included in datasets

CIF calculated properties

Linked from

Testing Kitaev QSL candidates through Ouro routes: Na₂Co₂TeO₆ and the honeycomb family under Orb v3

Actions

Predict a crystal property with ALIGNN, Error

DataData

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Overview

alpha-RuCl3 (v2) - Kitaev candidate

Overview

Structure

Attribution

Connections

Included in datasets

Linked from

Actions

Structure

Attribution

Stats

Connections

Included in datasets

Linked from

Actions

Data

Data