Co8S8Sb8

Co8S8Sb8 is a thermodynamically stable, semiconducting ternary compound consisting of cobalt, sulfur, and antimony.

CoSSb
Crystal structure of Co8S8Sb8 (orthorhombic, Pbca (No. 61))
Ground-state structure · Materials Project
Overview

About Co8S8Sb8

Co8S8Sb8 is a complex ternary compound composed of cobalt, sulfur, and antimony. Its position on the convex hull indicates that it is a thermodynamically stable material, making it a subject of interest for researchers investigating stable multi-element systems.

As a semiconducting material, this compound offers unique electronic properties that distinguish it from simple binary sulfides or antimonides. With multiple reported structures across various databases, it represents a significant, albeit specialized, entry in the landscape of inorganic materials.

At a glance

Key Properties

Cross-validated computational properties for Co8S8Sb8, aggregated across 4 databases.

Band Gap

0.24–0.55 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

13
4 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Co8S8Sb8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Pbca (No. 61)orthorhombic0.370.0000-16.0297.02
Pmn21 (No. 31)orthorhombic0.000.0097-16.0196.93
P213 (No. 198)cubic0.550.0105-16.0187.20
Pbca (No. 61)orthorhombic0.240.0443-15.9846.95
No. 0unknown0.87
No. 0unknown3.43
6.94
Pbca (No. 61)
Pbca (No. 61)
Pbca (No. 61)
Pbca (No. 61)
Pbca (No. 61)
Uses

Applications

Where Co8S8Sb8 is used.

Semiconductor researchMaterials science explorationSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about Co8S8Sb8, answered from cross-validated data.

What is Co8S8Sb8?

Co8S8Sb8 is a thermodynamically stable, semiconducting ternary compound consisting of cobalt, sulfur, and antimony.

More questions
What is Co8S8Sb8 used for?
Co8S8Sb8 is used in semiconductor research, materials science exploration, and solid-state chemistry studies.
What is the band gap of Co8S8Sb8?
Co8S8Sb8 has a DFT-computed band gap of 0.24–0.55 eV across 13 reported structures.
Is Co8S8Sb8 a metal, semiconductor, or insulator?
With a band gap up to 0.55 eV it is a semiconductor.
Is Co8S8Sb8 thermodynamically stable?
Yes — Co8S8Sb8 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Co8S8Sb8?
The lowest-energy reported polymorph of Co8S8Sb8 is orthorhombic symmetry, space group Pbca (No. 61).
What is the density of Co8S8Sb8?
The computed density of the ground-state structure of Co8S8Sb8 is 7.02 g/cm³.
How many polymorphs of Co8S8Sb8 are known?
13 structures of Co8S8Sb8 are reported across 4 databases, spanning 4 distinct space groups.
What elements does Co8S8Sb8 contain?
Co8S8Sb8 contains Co, S, and Sb (3 elements).
Where does the data for Co8S8Sb8 come from?
Co8S8Sb8 data is cross-referenced from materials_project, cod, omat24, aflow.
Comparison

How It Compares

As a unique ternary system, Co8S8Sb8 stands as an independent structural entity within the broader field of cobalt-based chalcogenides and pnictides. Its stability and semiconducting nature provide a distinct baseline for future exploration of complex quaternary or doped derivatives in this chemical space.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
  • 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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