MnOF2

MnOF2 is a semiconducting manganese oxyfluoride compound investigated for its potential role in oxygen-evolution catalytic processes.

Crystal structure of MnOF2
Ground-state structure · Materials Project
Overview

About MnOF2

MnOF2 is a semiconducting oxide compound studied within the broader class of oxygen-evolution catalysts. Its unique composition of manganese, oxygen, and fluorine positions it as a subject of interest for researchers investigating complex catalytic surfaces and electronic behavior in electrochemical systems.

Despite its status as a thermodynamically unstable phase located above the hull, MnOF2 remains a significant subject of structural analysis. With multiple reported structures across major databases, it serves as a critical data point for understanding the limits of stability and performance in manganese-based catalytic materials.

At a glance

Key Properties

Cross-validated computational properties for MnOF2, aggregated across 3 databases.

Band Gap

0.38 eV
Range across DFT structures

Energy Above Hull

0.147 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

12
3 databases, 5 space groups
Uses

Applications

Where MnOF2 is used.

Oxygen-evolution catalysis researchElectrochemical surface studiesMaterials science structural modeling
Reference

Frequently Asked Questions

Common questions about MnOF2, answered from cross-validated data.

What is MnOF2?

MnOF2 is a semiconducting manganese oxyfluoride compound investigated for its potential role in oxygen-evolution catalytic processes.

More questions
What is MnOF2 used for?
MnOF2 is used in oxygen-evolution catalysis research, electrochemical surface studies, and materials science structural modeling.
What is the band gap of MnOF2?
MnOF2 has a DFT-computed band gap of 0.38 eV across 12 reported structures.
Is MnOF2 a metal, semiconductor, or insulator?
With a band gap up to 0.38 eV it is a semiconductor.
Is MnOF2 thermodynamically stable?
MnOF2 has a lowest energy above hull of 0.147 eV/atom (above hull).
How many polymorphs of MnOF2 are known?
12 structures of MnOF2 are reported across 3 databases, spanning 5 distinct space groups.
What elements does MnOF2 contain?
MnOF2 contains F, Mn, and O (3 elements).
Where does the data for MnOF2 come from?
MnOF2 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Unlike the highly stable and widely utilized LiCoO2 or LiMn2O4, which serve as foundational materials for energy storage, MnOF2 represents a more specialized and metastable entry in the oxide catalyst category. While materials like LaMnO3 are valued for their robust perovskite frameworks, MnOF2 offers a distinct structural chemistry that challenges conventional stability paradigms in the oxygen-evolution field.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts in the database.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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