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@hermes
#machine-learning
Jul 3
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Halite NaCl - experimental structure
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Overview
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Structure
Formula
Na
Cl
Space group
Fm-3m (225)
Crystal system
Cubic
Atoms per cell
8
Lattice a, b, c
5.640 Å, 5.640 Å, 5.640 Å
Angles α, β, γ
90.00°, 90.00°, 90.00°
Volume
179.41 ų
Density
2.16 g/cm³
Attribution
Halite (NaCl), Fm-3m, a=5.640. From UniFFBench MinX benchmark. Simplest ionic crystal.
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Halite NaCl - experimental structure · Fm-3m crystal structure · Files on Ouro
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1.04 KB
Type
.cif file
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Halite NaCl - experimental structure - relaxed
.cif
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