F12Ga2Na6

F12Ga2Na6 is a metastable, insulating fluoride compound composed of sodium, gallium, and fluorine.

FGaNa
Crystal structure of F12Ga2Na6 (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

About F12Ga2Na6

F12Ga2Na6 is a complex fluoride compound characterized by its wide-band-gap insulating electronic profile. As a metastable material, it represents a unique structural arrangement within the broader landscape of sodium-gallium fluorides, where the interplay of its constituent elements dictates its specific chemical behavior.

Its significance lies in its role as a specialized inorganic phase, offering insights into the stability and bonding environments of multi-component fluoride systems. While data on this compound is limited to a few structural configurations, its insulating nature makes it a subject of interest for fundamental materials research.

At a glance

Key Properties

Cross-validated computational properties for F12Ga2Na6, aggregated across 2 databases.

Band Gap

5.36 eV
Range across DFT structures

Energy Above Hull

0.041 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

3
2 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for F12Ga2Na6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fm-3m (No. 225)cubic5.360.0409-4.8003.05
2.71
3.01
Intellectual Property

Patent Landscape

2 patents reference F12Ga2Na6 or close compositional variants.

PatentTitleAssigneeGranted
8248032Charging system for prioritizing load consumption in a notebook computer
8263193Vacuum treatment method
Reference

Frequently Asked Questions

Common questions about F12Ga2Na6, answered from cross-validated data.

What is F12Ga2Na6?

F12Ga2Na6 is a metastable, insulating fluoride compound composed of sodium, gallium, and fluorine.

More questions
What is the band gap of F12Ga2Na6?
F12Ga2Na6 has a DFT-computed band gap of 5.36 eV across 3 reported structures.
Is F12Ga2Na6 a metal, semiconductor, or insulator?
With a wide band gap up to 5.36 eV it is an insulator / wide-band-gap material.
Is F12Ga2Na6 thermodynamically stable?
F12Ga2Na6 has a lowest energy above hull of 0.041 eV/atom (metastable).
What is the crystal structure of F12Ga2Na6?
The lowest-energy reported polymorph of F12Ga2Na6 is cubic symmetry, space group Fm-3m (No. 225).
What is the density of F12Ga2Na6?
The computed density of the ground-state structure of F12Ga2Na6 is 3.05 g/cm³.
How many polymorphs of F12Ga2Na6 are known?
3 structures of F12Ga2Na6 are reported across 2 databases, spanning 1 distinct space group.
What elements does F12Ga2Na6 contain?
F12Ga2Na6 contains F, Ga, and Na (3 elements).
Where does the data for F12Ga2Na6 come from?
F12Ga2Na6 data is cross-referenced from materials_project, omat24.
Comparison

How It Compares

As a singular entry in its current classification, F12Ga2Na6 serves as a primary reference point for understanding metastable, insulating sodium-gallium fluorides. It occupies a distinct niche in the materials database, providing a baseline for future studies into the stability limits of similar complex fluoride compositions.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).

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