Mn3TeO8

Mn3TeO8 is a semiconducting manganese tellurium oxide studied primarily for its potential role as a catalyst in oxygen-evolution reactions.

Crystal structure of Mn3TeO8 (hexagonal, P63mc (No. 186))
Ground-state structure · Materials Project
Overview

About Mn3TeO8

Mn3TeO8 is a complex oxide belonging to the class of oxygen-evolution catalysts. As a semiconducting material, it offers unique electronic properties that are critical for facilitating electrochemical reactions at the electrode-electrolyte interface.

Despite its metastable nature, the compound has attracted scientific attention due to its structural diversity. Its role in catalytic processes is a subject of ongoing research, particularly in the context of developing efficient materials for sustainable energy conversion technologies.

At a glance

Key Properties

Cross-validated computational properties for Mn3TeO8, aggregated across 3 databases.

Band Gap

0.65 eV
Range across DFT structures

Energy Above Hull

0.070 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

15
3 databases, 3 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Mn3TeO8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P63mc (No. 186)hexagonal0.000.0702-7.5764.82
C2/m (No. 12)monoclinic0.650.0789-7.5674.46
R-3m (No. 166)trigonal0.000.1321-7.5144.44
P63mc (No. 186)Hexagonal4.82
P63mc (No. 186)Hexagonal5.38
P63mc (No. 186)Hexagonal5.06
R-3m (No. 166)Trigonal4.44
P63mc (No. 186)
C2/m (No. 12)Monoclinic4.93
R-3m (No. 166)Trigonal4.94
R-3m (No. 166)Trigonal4.64
C2/m (No. 12)Monoclinic4.46
Uses

Applications

Where Mn3TeO8 is used.

Oxygen-evolution catalysisElectrochemical energy conversion research
Reference

Frequently Asked Questions

Common questions about Mn3TeO8, answered from cross-validated data.

What is Mn3TeO8?

Mn3TeO8 is a semiconducting manganese tellurium oxide studied primarily for its potential role as a catalyst in oxygen-evolution reactions.

More questions
What is Mn3TeO8 used for?
Mn3TeO8 is used in oxygen-evolution catalysis and electrochemical energy conversion research.
What is the band gap of Mn3TeO8?
Mn3TeO8 has a DFT-computed band gap of 0.65 eV across 15 reported structures.
Is Mn3TeO8 a metal, semiconductor, or insulator?
With a band gap up to 0.65 eV it is a semiconductor.
Is Mn3TeO8 thermodynamically stable?
Mn3TeO8 has a lowest energy above hull of 0.070 eV/atom (metastable).
What is the crystal structure of Mn3TeO8?
The lowest-energy reported polymorph of Mn3TeO8 is hexagonal symmetry, space group P63mc (No. 186).
What is the density of Mn3TeO8?
The computed density of the ground-state structure of Mn3TeO8 is 4.82 g/cm³.
How many polymorphs of Mn3TeO8 are known?
15 structures of Mn3TeO8 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Mn3TeO8 contain?
Mn3TeO8 contains Mn, O, and Te (3 elements).
Where does the data for Mn3TeO8 come from?
Mn3TeO8 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broad category of oxide oxygen-evolution catalysts, Mn3TeO8 represents a specialized, less-conventional alternative to the widely characterized spinel and layered structures like LiMn2O4 or LiCoO2. While materials such as LaMnO3 are frequently studied for their robust stability and perovskite-based activity, Mn3TeO8 offers a distinct compositional framework that challenges traditional design paradigms in catalytic material development.

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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