Zr2SN2
Zr2SN2 is a thermodynamically stable, semiconducting zirconium-based nitride-sulfide compound.

About Zr2SN2
Zr2SN2 is a distinct inorganic compound composed of zirconium, sulfur, and nitrogen. As a thermodynamically stable material residing on the convex hull, it represents a robust phase within its chemical system, offering structural integrity that is highly valued in materials science research.
This compound exhibits semiconducting electronic character, positioning it as a candidate for specialized electronic and optoelectronic applications. Its presence across multiple structural databases underscores its significance as a well-characterized material of interest for fundamental studies in solid-state chemistry.
Key Properties
Cross-validated computational properties for Zr2SN2, 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 Zr2SN2 is used.
Frequently Asked Questions
Common questions about Zr2SN2, answered from cross-validated data.
What is Zr2SN2?
Zr2SN2 is a thermodynamically stable, semiconducting zirconium-based nitride-sulfide compound.
What is Zr2SN2 used for?
What is the band gap of Zr2SN2?
Is Zr2SN2 a metal, semiconductor, or insulator?
Is Zr2SN2 thermodynamically stable?
How many polymorphs of Zr2SN2 are known?
What elements does Zr2SN2 contain?
Where does the data for Zr2SN2 come from?
How It Compares
As a unique nitride-sulfide, Zr2SN2 occupies a specialized niche in materials design. Without direct structural siblings in its immediate class, it stands as a primary reference point for exploring the interplay between transition metals, chalcogens, and pnictogens in stable lattice configurations.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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