KFeF4

KFeF4 is a thermodynamically stable semiconducting fluoride compound used in fundamental materials research.

FFeK
Crystal structure of KFeF4
Ground-state structure · Materials Project
Overview

About KFeF4

KFeF4 is a complex inorganic fluoride featuring a stable arrangement of potassium and iron ions. As a thermodynamically stable material located on the convex hull, it exhibits robust structural integrity that makes it a subject of interest for fundamental solid-state studies.

Possessing semiconducting electronic characteristics, this compound serves as a model system for investigating transition metal fluoride interactions. Its presence across multiple structural databases highlights its significance in the broader landscape of functional inorganic materials.

At a glance

Key Properties

Cross-validated computational properties for KFeF4, aggregated across 3 databases.

Band Gap

2.20–2.71 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

6
3 databases, 2 space groups
Uses

Applications

Where KFeF4 is used.

Solid-state researchMaterials science characterization
Reference

Frequently Asked Questions

Common questions about KFeF4, answered from cross-validated data.

What is KFeF4?

KFeF4 is a thermodynamically stable semiconducting fluoride compound used in fundamental materials research.

More questions
What is KFeF4 used for?
KFeF4 is used in solid-state research and materials science characterization.
What is the band gap of KFeF4?
KFeF4 has a DFT-computed band gap of 2.20–2.71 eV across 6 reported structures.
Is KFeF4 a metal, semiconductor, or insulator?
With a band gap up to 2.71 eV it is a semiconductor.
Is KFeF4 thermodynamically stable?
Yes — KFeF4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of KFeF4 are known?
6 structures of KFeF4 are reported across 3 databases, spanning 2 distinct space groups.
What elements does KFeF4 contain?
KFeF4 contains F, Fe, and K (3 elements).
Where does the data for KFeF4 come from?
KFeF4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct inorganic fluoride, KFeF4 occupies a unique position in materials science where its thermodynamic stability and semiconducting nature provide a baseline for exploring the properties of complex iron-based fluoride frameworks.

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

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