Co3TeO8

Co3TeO8 is a metastable semiconducting oxide material primarily investigated for its potential as a catalyst in oxygen-evolution reactions.

Crystal structure of Co3TeO8 (trigonal, R-3m (No. 166))
Ground-state structure · Materials Project
Overview

About Co3TeO8

Co3TeO8 is a semiconducting oxide that functions as a specialized catalyst for the oxygen-evolution reaction. Its unique structural arrangement allows it to participate in complex electrochemical processes, making it a subject of interest for researchers seeking to optimize catalytic efficiency in energy storage and conversion systems.

As a metastable phase, this material offers distinct reactivity profiles compared to more conventional, highly stable oxides. Its electronic character is defined by its semiconducting nature, which facilitates the charge transfer necessary for effective catalytic performance in various electrochemical environments.

At a glance

Key Properties

Cross-validated computational properties for Co3TeO8, aggregated across 3 databases.

Band Gap

0.14–0.76 eV
Range across DFT structures

Energy Above Hull

0.054 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

26
3 databases, 7 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Co3TeO8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3m (No. 166)trigonal0.000.0540-6.5515.49
C2/m (No. 12)monoclinic0.640.0569-6.5484.62
C2/c (No. 15)monoclinic0.000.0689-6.5364.63
P2/c (No. 13)monoclinic0.760.0707-6.5344.65
P1 (No. 1)triclinic0.340.0778-6.5274.62
C2/c (No. 15)monoclinic0.490.0892-6.5164.67
P1 (No. 1)triclinic0.400.1024-6.5034.64
P-1 (No. 2)triclinic0.140.1595-6.4464.62
P63mc (No. 186)hexagonal0.000.2346-6.3705.66
R-3m (No. 166)trigonal0.000.2513-6.3545.25
C2/m (No. 12)Monoclinic5.64
R-3m (No. 166)
Uses

Applications

Where Co3TeO8 is used.

Oxygen-evolution catalysisElectrochemical energy conversion research
Reference

Frequently Asked Questions

Common questions about Co3TeO8, answered from cross-validated data.

What is Co3TeO8?

Co3TeO8 is a metastable semiconducting oxide material primarily investigated for its potential as a catalyst in oxygen-evolution reactions.

More questions
What is Co3TeO8 used for?
Co3TeO8 is used in oxygen-evolution catalysis and electrochemical energy conversion research.
What is the band gap of Co3TeO8?
Co3TeO8 has a DFT-computed band gap of 0.14–0.76 eV across 26 reported structures.
Is Co3TeO8 a metal, semiconductor, or insulator?
With a band gap up to 0.76 eV it is a semiconductor.
Is Co3TeO8 thermodynamically stable?
Co3TeO8 has a lowest energy above hull of 0.054 eV/atom (metastable).
What is the crystal structure of Co3TeO8?
The lowest-energy reported polymorph of Co3TeO8 is trigonal symmetry, space group R-3m (No. 166).
What is the density of Co3TeO8?
The computed density of the ground-state structure of Co3TeO8 is 5.49 g/cm³.
How many polymorphs of Co3TeO8 are known?
26 structures of Co3TeO8 are reported across 3 databases, spanning 7 distinct space groups.
What elements does Co3TeO8 contain?
Co3TeO8 contains Co, O, and Te (3 elements).
Where does the data for Co3TeO8 come from?
Co3TeO8 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broader class of oxide oxygen-evolution catalysts, Co3TeO8 occupies a niche position compared to more widely utilized transition metal oxides like NiO or LiCoO2. While materials such as LiCoO2 are staples in commercial battery technology, Co3TeO8 is distinguished by its metastable nature and specific tellurium-based stoichiometry, which provides a different structural framework for exploring catalytic activity than the simpler binary or perovskite-structured oxides like LaNiO3.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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