Al4F18K4O4

Al4F18K4O4 is a semiconducting inorganic compound containing aluminum, fluorine, potassium, and oxygen that exists in a metastable state.

AlFKO
Crystal structure of Al4F18K4O4 (monoclinic, P21/c (No. 14))
Ground-state structure · Materials Project
Overview

About Al4F18K4O4

Al4F18K4O4 is a complex inorganic compound composed of aluminum, fluorine, potassium, and oxygen. As a semiconducting material, it represents a specialized chemical system that bridges traditional ionic and covalent bonding characteristics within its crystal lattice.

Due to its position relative to the thermodynamic ground state, this compound is considered metastable. Its existence within material databases highlights the ongoing scientific interest in exploring synthetic pathways for complex oxyfluoride frameworks.

At a glance

Key Properties

Cross-validated computational properties for Al4F18K4O4, aggregated across 2 databases.

Band Gap

0.19 eV
Range across DFT structures

Energy Above Hull

0.280 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

3
2 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Al4F18K4O4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/c (No. 14)monoclinic0.190.2801-5.1462.39
2.54
2.54
Intellectual Property

Patent Landscape

3 patents reference Al4F18K4O4 or close compositional variants.

PatentTitleAssigneeGranted
8248032Charging system for prioritizing load consumption in a notebook computer
8263193Vacuum treatment method
8268035Process for producing refractory metal alloy powders
Reference

Frequently Asked Questions

Common questions about Al4F18K4O4, answered from cross-validated data.

What is Al4F18K4O4?

Al4F18K4O4 is a semiconducting inorganic compound containing aluminum, fluorine, potassium, and oxygen that exists in a metastable state.

More questions
What is the band gap of Al4F18K4O4?
Al4F18K4O4 has a DFT-computed band gap of 0.19 eV across 3 reported structures.
Is Al4F18K4O4 a metal, semiconductor, or insulator?
With a band gap up to 0.19 eV it is a semiconductor.
Is Al4F18K4O4 thermodynamically stable?
Al4F18K4O4 has a lowest energy above hull of 0.280 eV/atom (above hull).
What is the crystal structure of Al4F18K4O4?
The lowest-energy reported polymorph of Al4F18K4O4 is monoclinic symmetry, space group P21/c (No. 14).
What is the density of Al4F18K4O4?
The computed density of the ground-state structure of Al4F18K4O4 is 2.39 g/cm³.
How many polymorphs of Al4F18K4O4 are known?
3 structures of Al4F18K4O4 are reported across 2 databases, spanning 1 distinct space group.
What elements does Al4F18K4O4 contain?
Al4F18K4O4 contains Al, F, K, and O (4 elements).
Where does the data for Al4F18K4O4 come from?
Al4F18K4O4 data is cross-referenced from materials_project, omat24.
Comparison

How It Compares

As a unique inorganic phase, Al4F18K4O4 occupies a distinct niche in materials research. Without direct structural analogs in its immediate class, it serves as an important reference point for understanding how aluminum-fluorine-oxygen networks can be stabilized in the presence of alkali metal cations.

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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