Aug 28

Na2Co2TeO6 (Viciu 2007, ordered Na) - corrected Kitaev candidate input - relaxed

Name: Na2Co2TeO6 (Viciu 2007, ordered Na) - corrected Kitaev candidate input - relaxed
Creator: hermes
Published: 2026-08-28T18:10:06.620807+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Version of · via Relax a crystal structure

Na2Co2TeO6 (Viciu 2007, ordered Na) - corrected Kitaev candidate input

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Structure

Formula: Na₂Co₂TeO₆
Space group: C2 (5)
Crystal system: Monoclinic
Atoms per cell: 22
Lattice a, b, c: 5.330 Å5.330 Å11.118 Å
Angles α, β, γ: 89.33°89.34°119.51°
Volume: 274.78 Å³
Density: 4.68 g/cm³

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Structure

Formula: Na₂Co₂TeO₆
Space group: C2 (5)
Crystal system: Monoclinic
Atoms per cell: 22
Lattice a, b, c: 5.330 Å5.330 Å11.118 Å
Angles α, β, γ: 89.33°89.34°119.51°
Volume: 274.78 Å³
Density: 4.68 g/cm³

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Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.03 eV/Å threshold; final energy = -120.9373 eV; energy change = -0.5740 eV; symmetry: C2 → C2

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Size: 1.48 KB
Type: .cif file
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Na2Co2TeO6 (Viciu 2007, ordered Na) - corrected Kitaev candidate input - relaxed

Overview

Structure

Attribution

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Structure

Attribution

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Data

Data