K2NiF6

K2NiF6 is a stable, semiconducting inorganic fluoride compound used primarily in specialized chemical synthesis.

FKNi
Crystal structure of K2NiF6
Ground-state structure · Materials Project
Overview

About K2NiF6

K2NiF6 is a complex fluoride characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a robust structural arrangement of potassium, nickel, and fluorine atoms.

This compound is of significant interest in materials science due to its stable configuration and unique electronic properties. It serves as a specialized reagent in inorganic chemistry, particularly in processes requiring strong fluorinating agents or specific nickel oxidation states.

At a glance

Key Properties

Cross-validated computational properties for K2NiF6, aggregated across 3 databases.

Band Gap

2.36 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where K2NiF6 is used.

Fluorinating agentInorganic chemical synthesisOxidizing agent
Reference

Frequently Asked Questions

Common questions about K2NiF6, answered from cross-validated data.

What is K2NiF6?

K2NiF6 is a stable, semiconducting inorganic fluoride compound used primarily in specialized chemical synthesis.

More questions
What is K2NiF6 used for?
K2NiF6 is used in fluorinating agent, inorganic chemical synthesis, and oxidizing agent.
What is the band gap of K2NiF6?
K2NiF6 has a DFT-computed band gap of 2.36 eV across 5 reported structures.
Is K2NiF6 a metal, semiconductor, or insulator?
With a band gap up to 2.36 eV it is a semiconductor.
Is K2NiF6 thermodynamically stable?
Yes — K2NiF6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of K2NiF6 are known?
5 structures of K2NiF6 are reported across 3 databases, spanning 1 distinct space group.
What elements does K2NiF6 contain?
K2NiF6 contains F, K, and Ni (3 elements).
Where does the data for K2NiF6 come from?
K2NiF6 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct fluoride compound, K2NiF6 occupies a specialized niche in inorganic chemistry. While it shares the general characteristics of transition metal fluorides, its specific stoichiometry and stable electronic profile distinguish it from more common binary or ternary fluoride salts.

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

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