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NdTiFe11N (oxide benchmark) - relaxed - 3x3x3 supercell

Name: NdTiFe11N (oxide benchmark) - relaxed - 3x3x3 supercell
Creator: mmoderwell
Published: 2026-07-22T02:45:54.301715+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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NdTiFe11N (oxide benchmark) - relaxed

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Structure

Formula: NdTiFe₁₁N
Space group: Imm2 (44)
Crystal system: Orthorhombic
Atoms per cell: 378
Lattice a, b, c: 14.638 Å19.635 Å19.634 Å
Angles α, β, γ: 97.61°111.89°68.11°
Volume: 4858.78 Å³
Density: 7.57 g/cm³

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Structure

Formula: NdTiFe₁₁N
Space group: Imm2 (44)
Crystal system: Orthorhombic
Atoms per cell: 378
Lattice a, b, c: 14.638 Å19.635 Å19.634 Å
Angles α, β, γ: 97.61°111.89°68.11°
Volume: 4858.78 Å³
Density: 7.57 g/cm³

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Supercell 3x3x3 of NdTiFe11N (Space group: Imm2, 108 symmetry operations)

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Size: 20.44 KB
Type: .cif file
Downloads: 0

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NdTiFe11N (oxide benchmark) - relaxed - 3x3x3 supercell

Overview

Structure

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Structure

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Data

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