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template-NaFe3H6(SeO7)2 - relaxed

Name: template-NaFe3H6(SeO7)2 - relaxed
Creator: will
Published: 2026-06-29T12:14:02.673485+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Version of · via Relax a crystal structure

template-NaFe3H6(SeO7)2

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Structure

Formula: NaFe₃H₆Se₂O₁₄
Space group: R-3m (166)
Crystal system: Trigonal
Atoms per cell: 26
Lattice a, b, c: 7.259 Å7.259 Å7.260 Å
Angles α, β, γ: 62.13°62.12°62.13°
Volume: 283.38 Å³
Density: 3.39 g/cm³

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Included in datasets

RE-free permanent magnet candidates

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Structure

Formula: NaFe₃H₆Se₂O₁₄
Space group: R-3m (166)
Crystal system: Trigonal
Atoms per cell: 26
Lattice a, b, c: 7.259 Å7.259 Å7.260 Å
Angles α, β, γ: 62.13°62.12°62.13°
Volume: 283.38 Å³
Density: 3.39 g/cm³

Attribution

Cell + Ionic relaxation with Orb v3 conservative inf MPA; 0.05 eV/Å threshold; final energy = -143.9806 eV; energy change = -9.3966 eV; symmetry: R-3m → R-3m

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Size: 1.64 KB
Type: .cif file
Downloads: 0

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1

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RE-free permanent magnet candidates

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Overview

template-NaFe3H6(SeO7)2 - relaxed

Overview

Structure

Attribution

Connections

Included in datasets

Actions

Structure

Attribution

Stats

Connections

Included in datasets

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Data

Data