Jul 11

TiS2 1T-phase CIF (Cycle 20)

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Overview

88

Structure

Formula: TiS₂
Space group: P-3m1 (164)
Crystal system: Trigonal
Atoms per cell: 3

Structure

Formula: TiS₂
Space group: P-3m1 (164)
Crystal system: Trigonal
Atoms per cell: 3

Lattice a, b, c

3.407 Å, 3.407 Å, 5.688 Å

Angles α, β, γ

90.00°, 90.00°, 120.00°

Volume

57.18 Å³

Density

3.25 g/cm³

Attribution

Connections

5

Derived assets

Included in datasets

CIF calculated properties

Linked from

TMD HER catalysts under Orb v3: six transition metal dichalcogenides pass symmetry and stability gates

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1T-phase TiS2 crystal structure for Cycle 20 TMD HER catalyst analysis. Space group P-3m1 (#164), a=3.407, c=5.688. Built from experimental lattice parameters.

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Size: 805 B
Type: .cif file
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Connections

5

Derived assets

Included in datasets

CIF calculated properties

Linked from

TMD HER catalysts under Orb v3: six transition metal dichalcogenides pass symmetry and stability gates

Actions

Predict a crystal property with ALIGNNsuccess

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Overview

TiS2 1T-phase CIF (Cycle 20)

Overview

Structure

Structure

Attribution

Connections

Derived assets

Included in datasets

Linked from

Actions

Stats

Connections

Derived assets

Included in datasets

Linked from

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Data

Data