Zr2SeN2
Zr2SeN2 is a thermodynamically stable semiconducting ternary compound composed of zirconium, selenium, and nitrogen.
About Zr2SeN2
Zr2SeN2 is a distinct inorganic compound characterized by its semiconducting electronic nature. Its position on the convex hull confirms that it is a thermodynamically stable phase, making it a robust candidate for structural and functional analysis in solid-state chemistry.
Given its unique combination of zirconium, selenium, and nitrogen, this material is of significant interest for researchers investigating new ternary systems. Its stability suggests potential for integration into specialized electronic or optoelectronic device architectures where stable semiconducting behavior is required.
Key Properties
Cross-validated computational properties for Zr2SeN2, 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 Zr2SeN2 is used.
Frequently Asked Questions
Common questions about Zr2SeN2, answered from cross-validated data.
What is Zr2SeN2?
Zr2SeN2 is a thermodynamically stable semiconducting ternary compound composed of zirconium, selenium, and nitrogen.
What is Zr2SeN2 used for?
What is the band gap of Zr2SeN2?
Is Zr2SeN2 a metal, semiconductor, or insulator?
Is Zr2SeN2 thermodynamically stable?
How many polymorphs of Zr2SeN2 are known?
What elements does Zr2SeN2 contain?
Where does the data for Zr2SeN2 come from?
How It Compares
As a member of the ternary zirconium-selenium-nitrogen system, Zr2SeN2 occupies a unique niche in materials space. It serves as a foundational example of stable, complex chalcogenide-nitride chemistry, providing a benchmark for exploring the electronic and structural diversity within this specific chemical family.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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