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PXRDnet best structure: SrTiO3 (P1) · C2 crystal structure · Files on Ouro

Sep 11

PXRDnet best structure: SrTiO3 (P1)

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Overview

Created by route

Predict structures from PXRD pattern

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Structure

Formula: SrTiO₃
Space group: C2 (5)
Crystal system: Monoclinic
Atoms per cell: 5

Structure

Formula: SrTiO₃
Space group: C2 (5)
Crystal system: Monoclinic
Atoms per cell: 5

Lattice a, b, c

3.768 Å, 3.770 Å, 4.620 Å

Angles α, β, γ

87.08°, 87.07°, 85.28°

Volume

65.23 Å³

Density

4.67 g/cm³

Attribution

Connections

1

Inputs

SrTiO3 synthetic PXRD pattern (known-answer control).xy

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Best candidate from PXRDnet (sinc10 regime): 5 candidates ranked by PXRD pattern fit (R=0.21393).

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Size: 910 B
Type: .cif file
Downloads: 0

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Created by route

Predict structures from PXRD pattern

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SrTiO3 synthetic PXRD pattern (known-answer control).xy

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Overview

PXRDnet best structure: SrTiO3 (P1)

Overview

Structure

Structure

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