SbOsSe

SbOsSe is a thermodynamically stable semiconducting compound studied for its potential role in thermoelectric and solid-state applications.

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

About SbOsSe

SbOsSe is a semiconducting compound belonging to the broader family of chalcogenide-based materials often investigated for thermoelectric applications. Its status as a thermodynamically stable phase on the convex hull suggests a robust structural framework, making it a subject of interest for fundamental materials research. The material is characterized by its distinct elemental composition, which influences its electronic behavior and potential for energy conversion technologies. Given its presence in multiple structural databases, it represents a well-documented candidate for further experimental exploration in solid-state physics.

At a glance

Key Properties

Cross-validated computational properties for SbOsSe, 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

8
3 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for SbOsSe, 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)monoclinic1.120.0000-6.68410.54
P1 (No. 1)Triclinic12.85
Cmme (No. 67)Orthorhombic7.76
Cmme (No. 67)Orthorhombic10.48
P21/c (No. 14)
P1 (No. 1)Triclinic7.93
P-1 (No. 2)Triclinic10.41
P-1 (No. 2)Triclinic10.01
Uses

Applications

Where SbOsSe is used.

Thermoelectric researchSolid-state device developmentFundamental materials science
Reference

Frequently Asked Questions

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

What is SbOsSe?

SbOsSe is a thermodynamically stable semiconducting compound studied for its potential role in thermoelectric and solid-state applications.

More questions
What is SbOsSe used for?
SbOsSe is used in thermoelectric research, solid-state device development, and fundamental materials science.
What is the band gap of SbOsSe?
SbOsSe has a DFT-computed band gap of 1.12 eV across 8 reported structures.
Is SbOsSe a metal, semiconductor, or insulator?
With a band gap up to 1.12 eV it is a semiconductor.
Is SbOsSe thermodynamically stable?
Yes — SbOsSe sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of SbOsSe?
The lowest-energy reported polymorph of SbOsSe is monoclinic symmetry, space group P21/c (No. 14).
What is the density of SbOsSe?
The computed density of the ground-state structure of SbOsSe is 10.54 g/cm³.
How many polymorphs of SbOsSe are known?
8 structures of SbOsSe are reported across 3 databases, spanning 4 distinct space groups.
What elements does SbOsSe contain?
SbOsSe contains Os, Sb, and Se (3 elements).
Where does the data for SbOsSe come from?
SbOsSe data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the bismuth chalcogenide thermoelectrics class.

Within the context of bismuth chalcogenide-related thermoelectrics, SbOsSe occupies a unique niche compared to more traditional, highly studied members like Bi2Te3 or Sb2Se3. While compounds such as Bi2Te3 are industry standards for cooling and power generation, SbOsSe offers a different elemental combination that may provide alternative pathways for tuning electronic and thermal transport properties compared to binary or ternary systems like AgSbTe2 or Ge2Sb2Te5.

Explore

Related Compounds

Other Bismuth Chalcogenide Thermoelectrics in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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