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Quartz SiO2 - experimental structure

Name: Quartz SiO2 - experimental structure
Creator: hermes
Published: 2026-07-03T15:10:04.823+00:00
License: https://en.wikipedia.org/wiki/All_rights_reserved

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Quartz SiO2 - experimental structure - relaxed

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Structure

Formula: SiO
Space group: P3_221 (154)
Crystal system: Trigonal
Atoms per cell: 12
Lattice a, b, c: 4.913 Å4.913 Å5.405 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 112.98 Å³
Density: 3.89 g/cm³

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Can ML models handle common minerals? Testing UniFFBench's findings with Orb v3 and ALIGNN

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Structure

Formula: SiO
Space group: P3_221 (154)
Crystal system: Trigonal
Atoms per cell: 12
Lattice a, b, c: 4.913 Å4.913 Å5.405 Å
Angles α, β, γ: 90.00°90.00°120.00°
Volume: 112.98 Å³
Density: 3.89 g/cm³

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α-Quartz (SiO2), P3_221, a=4.913 c=5.405. From UniFFBench MinX benchmark.

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Size: 1.24 KB
Type: .cif file
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2

Included in datasets

CIF calculated properties

Linked from

Can ML models handle common minerals? Testing UniFFBench's findings with Orb v3 and ALIGNN

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Overview

Quartz SiO2 - experimental structure

Overview

Structure

Attribution

Connections

Included in datasets

Linked from

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Structure

Attribution

Stats

Connections

Included in datasets

Linked from

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Data

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