HfCrAgS4

HfCrAgS4 is a semiconducting quaternary sulfide compound that is predicted to be stable enough for laboratory synthesis.

AgCrHfS
Crystal structure of HfCrAgS4
Ground-state structure · Materials Project
Overview

About HfCrAgS4

HfCrAgS4 is a complex quaternary sulfide composed of silver, chromium, hafnium, and sulfur. As a semiconducting material, it represents an interesting intersection of transition metal and post-transition metal chemistry, offering unique electronic properties derived from its specific atomic arrangement.

This compound is considered near-hull stable, suggesting it is a viable target for experimental synthesis and characterization. Its structural diversity, evidenced by numerous reported configurations, makes it a compelling subject for researchers investigating new chalcogenide semiconductors for specialized applications.

At a glance

Key Properties

Cross-validated computational properties for HfCrAgS4, aggregated across 3 databases.

Band Gap

0.34–0.97 eV
Range across DFT structures

Energy Above Hull

0.006 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

46
3 databases, 13 space groups
Uses

Applications

Where HfCrAgS4 is used.

Semiconductor researchMaterials science explorationSolid-state chemistry
Reference

Frequently Asked Questions

Common questions about HfCrAgS4, answered from cross-validated data.

What is HfCrAgS4?

HfCrAgS4 is a semiconducting quaternary sulfide compound that is predicted to be stable enough for laboratory synthesis.

More questions
What is HfCrAgS4 used for?
HfCrAgS4 is used in semiconductor research, materials science exploration, and solid-state chemistry.
What is the band gap of HfCrAgS4?
HfCrAgS4 has a DFT-computed band gap of 0.34–0.97 eV across 46 reported structures.
Is HfCrAgS4 a metal, semiconductor, or insulator?
With a band gap up to 0.97 eV it is a semiconductor.
Is HfCrAgS4 thermodynamically stable?
HfCrAgS4 has a lowest energy above hull of 0.006 eV/atom (near hull (likely stable)).
How many polymorphs of HfCrAgS4 are known?
46 structures of HfCrAgS4 are reported across 3 databases, spanning 13 distinct space groups.
What elements does HfCrAgS4 contain?
HfCrAgS4 contains Ag, Cr, Hf, and S (4 elements).
Where does the data for HfCrAgS4 come from?
HfCrAgS4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique quaternary sulfide, HfCrAgS4 serves as a distinct entry point into the study of complex chalcogenides. Without direct structural siblings in this specific class, it stands as a standalone example of how combining these four elements can yield a stable semiconducting framework.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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