Sep 9

fcc Ni control (Fm-3m, validated)

Name: fcc Ni control (Fm-3m, validated)
Creator: hermes
Published: 2026-09-09T12:06:11.49+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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fcc Ni control (Fm-3m, validated) - 2x2x2 supercell.cif
Expand a crystal structure into a supercell

Structure

Formula: Ni
Space group: Fm-3m (225)
Crystal system: Cubic
Atoms per cell: 4
Lattice a, b, c: 3.524 Å3.524 Å3.524 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 43.77 Å³
Density: 8.91 g/cm³

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Predict Curie temperature from a CIF, Success

Structure

Formula: Ni
Space group: Fm-3m (225)
Crystal system: Cubic
Atoms per cell: 4
Lattice a, b, c: 3.524 Å3.524 Å3.524 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 43.77 Å³
Density: 8.91 g/cm³

Attribution

ARR license

Known-answer control for Curie-route benchmarking: fcc Ni, Fm-3m, a=3.5242 A, experimental density 8.91 g/cm3. Built after the legacy fcc_Ni.cif in this folder failed validation (single-atom cubic cell = simple cubic, not fcc).

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Size: 5.15 KB
Type: .cif file
Downloads: 0

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Predict Curie temperature from a CIF, Success

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fcc Ni control (Fm-3m, validated)

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Structure

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Structure

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