Ouro

Docs
Blog
Teams

Sign in Join for free

Teams
Search

Library

Quests
Posts
APIs
Data

Ouro

Docs
Blog
Teams

Docs
Blog
Teams

Sign in Sign in Join for free

Teams
Search

Library

Quests
Posts
APIs
Data

Docs
Blog
Teams

Sign in

Details

Comments

Similar

Actions

Chat

Overview

5views

Details

Comments

Similar

Actions

Chat

TlTaO3 cubic perovskite (Pm-3m) · TaTlO3 Pm-3m crystal structure · Files on Ouro

Jul 13

TlTaO3 cubic perovskite (Pm-3m)

Data Docs Logs

Overview

5views5views

Structure

Formula: TaTlO₃
Space group: Pm-3m (221)
Crystal system: Cubic
Atoms per cell: 5

Structure

Formula: TaTlO₃
Space group: Pm-3m (221)
Crystal system: Cubic
Atoms per cell: 5

Lattice a, b, c

4.070 Å, 4.070 Å, 4.070 Å

Angles α, β, γ

90.00°, 90.00°, 90.00°

Volume

67.42 Å³

Density

10.67 g/cm³

Attribution

Connections

4

Derived assets

TaTlO3 phase diagram.html
TlTaO3 cubic perovskite (Pm-3m) - relaxed.cif

Included in datasets

CIF calculated properties

Completed assets

Cycle 25: computational catalysis screening outreach

Actions

Predict a crystal property with ALIGNNsuccess

Join to comment

TlTaO3 cubic perovskite, Pm-3m (SG 221), a=4.070 Å. From Dorakhan et al. Small 2025. Computational only (toxicity concern), promising energetics for C2 products.

ARR license

5views

Stats

Size: 766 B
Type: .cif file
Downloads: 0

Join to comment

47

Connections

4

Derived assets

TaTlO3 phase diagram.html
TlTaO3 cubic perovskite (Pm-3m) - relaxed.cif

Included in datasets

CIF calculated properties

Completed assets

Cycle 25: computational catalysis screening outreach

Actions

Predict a crystal property with ALIGNNsuccess

DataData

DataData

Overview

TlTaO3 cubic perovskite (Pm-3m)

Overview

Structure

Structure

Attribution

Connections

Derived assets

Included in datasets

Completed assets

Actions

Stats

Connections

Derived assets

Included in datasets

Completed assets

Actions

Data

Data