Os4S4Sb4

Os4S4Sb4 is a thermodynamically stable semiconducting compound containing osmium, sulfur, and antimony.

OsSSb
Crystal structure of Os4S4Sb4 (monoclinic, P21/c (No. 14))
Ground-state structure · Materials Project
Overview

About Os4S4Sb4

Os4S4Sb4 is a complex ternary compound composed of osmium, sulfur, and antimony. As a thermodynamically stable phase located on the convex hull, it represents a robust crystalline configuration that has been identified across multiple structural databases.

This material exhibits semiconducting electronic character, making it a subject of interest for fundamental studies in solid-state physics. Its unique elemental combination suggests potential for specialized electronic or optoelectronic applications where specific band structures are required.

At a glance

Key Properties

Cross-validated computational properties for Os4S4Sb4, aggregated across 3 databases.

Band Gap

1.12 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Os4S4Sb4, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P21/c (No. 14)monoclinic1.120.0000-6.98010.04
9.93
9.93
P21/c (No. 14)
6.61
Uses

Applications

Where Os4S4Sb4 is used.

Semiconductor researchMaterials science explorationSolid-state physics studies
Reference

Frequently Asked Questions

Common questions about Os4S4Sb4, answered from cross-validated data.

What is Os4S4Sb4?

Os4S4Sb4 is a thermodynamically stable semiconducting compound containing osmium, sulfur, and antimony.

More questions
What is Os4S4Sb4 used for?
Os4S4Sb4 is used in semiconductor research, materials science exploration, and solid-state physics studies.
What is the band gap of Os4S4Sb4?
Os4S4Sb4 has a DFT-computed band gap of 1.12 eV across 5 reported structures.
Is Os4S4Sb4 a metal, semiconductor, or insulator?
With a band gap up to 1.12 eV it is a semiconductor.
Is Os4S4Sb4 thermodynamically stable?
Yes — Os4S4Sb4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Os4S4Sb4?
The lowest-energy reported polymorph of Os4S4Sb4 is monoclinic symmetry, space group P21/c (No. 14).
What is the density of Os4S4Sb4?
The computed density of the ground-state structure of Os4S4Sb4 is 10.04 g/cm³.
How many polymorphs of Os4S4Sb4 are known?
5 structures of Os4S4Sb4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Os4S4Sb4 contain?
Os4S4Sb4 contains Os, S, and Sb (3 elements).
Where does the data for Os4S4Sb4 come from?
Os4S4Sb4 data is cross-referenced from materials_project, omat24, aflow.
Comparison

How It Compares

As a distinct ternary phase, Os4S4Sb4 occupies a unique position in materials space. Without direct structural siblings, it serves as a primary example of how heavy transition metals can integrate with chalcogens and pnictogens to form stable, semiconducting architectures.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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