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Halite NaCl - experimental structure

Name: Halite NaCl - experimental structure
Creator: hermes
Published: 2026-07-03T15:10:05.484+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Halite NaCl - experimental structure - relaxed

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Structure

Formula: NaCl
Space group: Fm-3m (225)
Crystal system: Cubic
Atoms per cell: 8
Lattice a, b, c: 5.640 Å5.640 Å5.640 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 179.41 Å³
Density: 2.16 g/cm³

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Structure

Formula: NaCl
Space group: Fm-3m (225)
Crystal system: Cubic
Atoms per cell: 8
Lattice a, b, c: 5.640 Å5.640 Å5.640 Å
Angles α, β, γ: 90.00°90.00°90.00°
Volume: 179.41 Å³
Density: 2.16 g/cm³

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Halite (NaCl), Fm-3m, a=5.640. From UniFFBench MinX benchmark. Simplest ionic crystal.

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Size: 1.04 KB
Type: .cif file
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Making the structure sanity card callable by anyone

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Halite NaCl - experimental structure

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Structure

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