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TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell · P3m1 crystal structure · Files on Ouro

Jul 14

TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell

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Overview

Created by route

Expand a crystal structure into a supercell

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Structure

Formula: TiS₂
Space group: P3m1 (156)
Crystal system: Trigonal
Atoms per cell: 48

Structure

Formula: TiS₂
Space group: P3m1 (156)
Crystal system: Trigonal
Atoms per cell: 48

Lattice a, b, c

13.628 Å, 13.628 Å, 24.266 Å

Angles α, β, γ

90.00°, 90.00°, 120.00°

Volume

3902.95 Å³

Density

0.76 g/cm³

Attribution

Connections

4

Inputs

TiS2 1T-phase CIF (Cycle 20).cif

Derived assets

TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell - simulated XRD.xy
TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell - relaxation animationVideo

Included in datasets

CIF calculated properties

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Supercell 4x4x1 of TiS2 (Space group: P3m1, 96 symmetry operations), vacuum 20.0 Å along axis 2

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Size: 3.06 KB
Type: .cif file
Downloads: 0

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47

Created by route

Expand a crystal structure into a supercell

Connections

4

Inputs

TiS2 1T-phase CIF (Cycle 20).cif

Derived assets

TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell - simulated XRD.xy
TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell - relaxation animationVideo

Included in datasets

CIF calculated properties

DataData

DataData

Overview

TiS2 1T-phase CIF (Cycle 20) - 4x4x1 supercell

Overview

Structure

Structure

Attribution

Connections

Inputs

Derived assets

Included in datasets

Actions

Stats

Connections

Inputs

Derived assets

Included in datasets

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Data

Data