Na3MnF6

Na3MnF6 is a metastable, semimetallic fluoride compound containing sodium and manganese.

FMnNa
Crystal structure of Na3MnF6
Ground-state structure · Materials Project
Overview

About Na3MnF6

Na3MnF6 is a complex fluoride compound composed of sodium, manganese, and fluorine. Its electronic structure exhibits semimetallic behavior, characterized by a near-zero band gap that distinguishes it from typical insulating fluoride salts.

Due to its position above the thermodynamic hull, this compound is considered a metastable phase. While it has been documented across multiple structural databases, its relative instability suggests it may require specific synthetic conditions to be stabilized or observed in practical settings.

At a glance

Key Properties

Cross-validated computational properties for Na3MnF6, aggregated across 3 databases.

Band Gap

0.09 eV
Range across DFT structures

Energy Above Hull

0.159 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Reference

Frequently Asked Questions

Common questions about Na3MnF6, answered from cross-validated data.

What is Na3MnF6?

Na3MnF6 is a metastable, semimetallic fluoride compound containing sodium and manganese.

More questions
What is the band gap of Na3MnF6?
Na3MnF6 has a DFT-computed band gap of 0.09 eV across 5 reported structures.
Is Na3MnF6 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Na3MnF6 thermodynamically stable?
Na3MnF6 has a lowest energy above hull of 0.159 eV/atom (above hull).
How many polymorphs of Na3MnF6 are known?
5 structures of Na3MnF6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Na3MnF6 contain?
Na3MnF6 contains F, Mn, and Na (3 elements).
Where does the data for Na3MnF6 come from?
Na3MnF6 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique fluoride phase, Na3MnF6 occupies a distinct space in materials research. Without direct structural siblings in this specific chemical group, it serves as a primary example of how manganese-based fluorides can exhibit unconventional electronic properties compared to more common, stable ionic fluoride insulators.

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

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