MgFeF4

MgFeF4 is a wide-band-gap insulating fluoride compound that exists as a metastable phase in structural research.

FFeMg
Crystal structure of MgFeF4
Ground-state structure · Materials Project
Overview

About MgFeF4

MgFeF4 is a fluoride compound characterized by its wide-band-gap insulating electronic nature. As a complex inorganic material containing magnesium and iron, it represents a subject of interest for structural studies within the broader landscape of metal fluorides. The material has been documented across multiple databases, reflecting its presence in experimental or computational structural investigations. Being positioned above the thermodynamic hull, it is considered a metastable phase, which highlights the complexity of its synthesis and the specific conditions required to stabilize its atomic arrangement. Its unique composition makes it a candidate for fundamental research into the behavior of transition metal fluorides.

At a glance

Key Properties

Cross-validated computational properties for MgFeF4, aggregated across 3 databases.

Band Gap

0.13–4.63 eV
Range across DFT structures

Energy Above Hull

0.127 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

7
3 databases, 4 space groups
Uses

Applications

Where MgFeF4 is used.

Fundamental materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about MgFeF4, answered from cross-validated data.

What is MgFeF4?

MgFeF4 is a wide-band-gap insulating fluoride compound that exists as a metastable phase in structural research.

More questions
What is MgFeF4 used for?
MgFeF4 is used in fundamental materials science research and solid-state chemistry studies.
What is the band gap of MgFeF4?
MgFeF4 has a DFT-computed band gap of 0.13–4.63 eV across 7 reported structures.
Is MgFeF4 a metal, semiconductor, or insulator?
With a wide band gap up to 4.63 eV it is an insulator / wide-band-gap material.
Is MgFeF4 thermodynamically stable?
MgFeF4 has a lowest energy above hull of 0.127 eV/atom (above hull).
How many polymorphs of MgFeF4 are known?
7 structures of MgFeF4 are reported across 3 databases, spanning 4 distinct space groups.
What elements does MgFeF4 contain?
MgFeF4 contains F, Fe, and Mg (3 elements).
Where does the data for MgFeF4 come from?
MgFeF4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As an unclassified material, MgFeF4 serves as a unique case study in the field of metal fluorides. Without direct structural siblings in this specific class, it stands as a distinct entity that contributes to our understanding of how magnesium and iron ions coordinate with fluorine anions to form complex, albeit metastable, lattice geometries.

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

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