As24Ba24Zn12
As24Ba24Zn12 is a thermodynamically stable, semiconducting ternary compound containing arsenic, barium, and zinc.
About As24Ba24Zn12
As24Ba24Zn12 is a complex ternary compound composed of arsenic, barium, and zinc. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement that maintains integrity under standard conditions.
This material exhibits semiconducting electronic character, making it an interesting candidate for specialized electronic and optoelectronic applications. Its unique composition allows for structural diversity, as evidenced by its presence in multiple reported structural configurations.
Key Properties
Cross-validated computational properties for As24Ba24Zn12, 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 As24Ba24Zn12 is used.
Frequently Asked Questions
Common questions about As24Ba24Zn12, answered from cross-validated data.
What is As24Ba24Zn12?
As24Ba24Zn12 is a thermodynamically stable, semiconducting ternary compound containing arsenic, barium, and zinc.
What is As24Ba24Zn12 used for?
What is the band gap of As24Ba24Zn12?
Is As24Ba24Zn12 a metal, semiconductor, or insulator?
Is As24Ba24Zn12 thermodynamically stable?
How many polymorphs of As24Ba24Zn12 are known?
What elements does As24Ba24Zn12 contain?
Where does the data for As24Ba24Zn12 come from?
How It Compares
As a unique ternary phase, As24Ba24Zn12 serves as a distinct example of how heavy alkaline earth metals and pnictogens can combine with transition metals to form stable, semiconducting architectures in the solid state.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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