BaMnF4

BaMnF4 is a semiconducting barium manganese fluoride compound that is thermodynamically stable and structurally diverse.

BaFMn
Crystal structure of BaMnF4
Ground-state structure · Materials Project
Overview

About BaMnF4

BaMnF4 is a complex fluoride compound composed of barium, manganese, and fluorine. As a semiconducting material, it exhibits unique electronic properties that distinguish it from standard ionic insulators, making it a subject of interest for researchers investigating specialized electronic behaviors in inorganic fluorides. Its status as a near-hull material suggests that it is thermodynamically stable enough to be synthesized and studied in laboratory settings.

With multiple reported structures across various databases, this compound represents a well-documented entry in the field of inorganic materials science. Its structural diversity provides a foundation for understanding how manganese-based fluorides can be manipulated for electronic applications, contributing to the broader knowledge of transition metal fluoride chemistry.

At a glance

Key Properties

Cross-validated computational properties for BaMnF4, aggregated across 4 databases.

Band Gap

2.32 eV
Range across DFT structures

Energy Above Hull

0.006 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

13
4 databases, 2 space groups
Uses

Applications

Where BaMnF4 is used.

Materials science researchElectronic property studiesSolid-state chemistry investigations
Reference

Frequently Asked Questions

Common questions about BaMnF4, answered from cross-validated data.

What is BaMnF4?

BaMnF4 is a semiconducting barium manganese fluoride compound that is thermodynamically stable and structurally diverse.

More questions
What is BaMnF4 used for?
BaMnF4 is used in materials science research, electronic property studies, and solid-state chemistry investigations.
What is the band gap of BaMnF4?
BaMnF4 has a DFT-computed band gap of 2.32 eV across 13 reported structures.
Is BaMnF4 a metal, semiconductor, or insulator?
With a band gap up to 2.32 eV it is a semiconductor.
Is BaMnF4 thermodynamically stable?
BaMnF4 has a lowest energy above hull of 0.006 eV/atom (near hull (likely stable)).
How many polymorphs of BaMnF4 are known?
13 structures of BaMnF4 are reported across 4 databases, spanning 2 distinct space groups.
What elements does BaMnF4 contain?
BaMnF4 contains Ba, F, and Mn (3 elements).
Where does the data for BaMnF4 come from?
BaMnF4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a member of the inorganic fluoride family, BaMnF4 serves as a representative example of how transition metal incorporation influences the electronic character of these materials. While many fluorides are characterized by wide-gap insulating behavior, the semiconducting nature of this compound highlights the distinct role that manganese plays in tailoring the electronic landscape of the crystal lattice.

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

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