K2NaCl3
K2NaCl3 is a wide-band-gap insulating ternary halide compound that is considered thermodynamically stable and potentially synthesizable.
About K2NaCl3
K2NaCl3 is a ternary halide compound characterized by its wide-band-gap insulating electronic structure. Its status as a near-hull material suggests that it is thermodynamically stable enough to be synthesized and explored for potential applications in solid-state chemistry and materials science.
Given its structural diversity, with multiple reported configurations across various databases, this compound serves as an interesting subject for studying alkali metal halide interactions. Its insulating nature and stability profile position it as a candidate for specialized dielectric or ionic transport studies.
Key Properties
Cross-validated computational properties for K2NaCl3, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Applications
Where K2NaCl3 is used.
Frequently Asked Questions
Common questions about K2NaCl3, answered from cross-validated data.
What is K2NaCl3?
K2NaCl3 is a wide-band-gap insulating ternary halide compound that is considered thermodynamically stable and potentially synthesizable.
What is K2NaCl3 used for?
What is the band gap of K2NaCl3?
Is K2NaCl3 a metal, semiconductor, or insulator?
Is K2NaCl3 thermodynamically stable?
How many polymorphs of K2NaCl3 are known?
What elements does K2NaCl3 contain?
Where does the data for K2NaCl3 come from?
How It Compares
As a ternary alkali halide, K2NaCl3 represents a distinct structural arrangement within the broader family of halide salts. While it does not share a direct class with more common binary halides, it occupies a unique niche as a multi-component system that bridges the gap between simpler alkali chloride structures.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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