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H3S Im-3m (250 GPa) structure · Im-3m crystal structure · Files on Ouro

Jun 30

H3S Im-3m (250 GPa) structure

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Overview

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Structure

Formula: H₃S
Space group: Im-3m (229)
Crystal system: Cubic
Atoms per cell: 8

Structure

Formula: H₃S
Space group: Im-3m (229)
Crystal system: Cubic
Atoms per cell: 8

Lattice a, b, c

3.089 Å, 3.089 Å, 3.089 Å

Angles α, β, γ

90.00°, 90.00°, 90.00°

Volume

29.48 Å³

Density

3.95 g/cm³

Attribution

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3

Derived assets

H3S Im-3m (250 GPa) structure - relaxed.cif

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CIF calculated properties

Linked from

Building on Belli, Zurek & Errea: ML predictions vs quantum nuclear effect descriptors in hydride superconductors

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H3S in Im-3m symmetry at 250 GPa, from Belli, Zurek & Errea (npj Comput. Mater. 2026). SB class: QNEs suppress Tc (226 to 190 K).

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Size: 1.02 KB
Type: .cif file
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Derived assets

H3S Im-3m (250 GPa) structure - relaxed.cif

Included in datasets

CIF calculated properties

Linked from

Building on Belli, Zurek & Errea: ML predictions vs quantum nuclear effect descriptors in hydride superconductors

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Overview

H3S Im-3m (250 GPa) structure

Overview

Structure

Structure

Attribution

Connections

Derived assets

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Derived assets

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Data

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