BaHfS3
BaHfS3 is a stable, semiconducting ternary sulfide material used in advanced materials research.

About BaHfS3
BaHfS3 is a complex ternary sulfide that exhibits semiconducting electronic behavior. As a thermodynamically stable phase residing on the convex hull, it represents a robust crystalline material of significant interest for structural and functional research.
Its unique composition makes it a versatile candidate for materials science investigations. Given its status as a well-documented structure across multiple databases, it serves as a foundational material for exploring the interplay between heavy metal cations and sulfur-based anionic frameworks.
Key Properties
Cross-validated computational properties for BaHfS3, aggregated across 5 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 BaHfS3 is used.
Frequently Asked Questions
Common questions about BaHfS3, answered from cross-validated data.
What is BaHfS3?
BaHfS3 is a stable, semiconducting ternary sulfide material used in advanced materials research.
What is BaHfS3 used for?
What is the band gap of BaHfS3?
Is BaHfS3 a metal, semiconductor, or insulator?
Is BaHfS3 thermodynamically stable?
How many polymorphs of BaHfS3 are known?
What elements does BaHfS3 contain?
Where does the data for BaHfS3 come from?
How It Compares
As a distinct ternary sulfide, BaHfS3 occupies a specialized niche in materials science, serving as a primary reference point for investigating the stability and electronic properties of barium-hafnium-sulfur systems.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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