Co2Sb2O7

Co2Sb2O7 is a semiconducting cobalt antimony oxide being explored for its potential utility in electrochemical oxygen-evolution catalysis.

Crystal structure of Co2Sb2O7 (cubic, Fd-3m (No. 227))
Ground-state structure · Materials Project
Overview

About Co2Sb2O7

Co2Sb2O7 is a complex oxide material characterized by its semiconducting electronic structure. As a member of the oxide oxygen-evolution catalyst family, it is studied for its potential to facilitate electrochemical water splitting reactions, which are essential for sustainable hydrogen production technologies.

Despite its interest in catalytic research, the compound is identified as being above the thermodynamic hull, suggesting it is a metastable phase. Its structural diversity is highlighted by multiple reported configurations across materials databases, reflecting the complex interplay between cobalt and antimony in oxygen-rich coordination environments.

At a glance

Key Properties

Cross-validated computational properties for Co2Sb2O7, aggregated across 3 databases.

Band Gap

0.77 eV
Range across DFT structures

Energy Above Hull

0.140 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Co2Sb2O7, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fd-3m (No. 227)cubic0.770.1397-6.7785.98
Fd-3m (No. 227)Cubic5.98
Fd-3m (No. 227)Cubic6.52
Fd-3m (No. 227)Cubic6.22
Fd-3m (No. 227)
Uses

Applications

Where Co2Sb2O7 is used.

Oxygen-evolution catalysisElectrochemical water splitting research
Reference

Frequently Asked Questions

Common questions about Co2Sb2O7, answered from cross-validated data.

What is Co2Sb2O7?

Co2Sb2O7 is a semiconducting cobalt antimony oxide being explored for its potential utility in electrochemical oxygen-evolution catalysis.

More questions
What is Co2Sb2O7 used for?
Co2Sb2O7 is used in oxygen-evolution catalysis and electrochemical water splitting research.
What is the band gap of Co2Sb2O7?
Co2Sb2O7 has a DFT-computed band gap of 0.77 eV across 5 reported structures.
Is Co2Sb2O7 a metal, semiconductor, or insulator?
With a band gap up to 0.77 eV it is a semiconductor.
Is Co2Sb2O7 thermodynamically stable?
Co2Sb2O7 has a lowest energy above hull of 0.140 eV/atom (above hull).
What is the crystal structure of Co2Sb2O7?
The lowest-energy reported polymorph of Co2Sb2O7 is cubic symmetry, space group Fd-3m (No. 227).
What is the density of Co2Sb2O7?
The computed density of the ground-state structure of Co2Sb2O7 is 5.98 g/cm³.
How many polymorphs of Co2Sb2O7 are known?
5 structures of Co2Sb2O7 are reported across 3 databases, spanning 1 distinct space group.
What elements does Co2Sb2O7 contain?
Co2Sb2O7 contains Co, O, and Sb (3 elements).
Where does the data for Co2Sb2O7 come from?
Co2Sb2O7 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the diverse landscape of oxygen-evolution catalysts, Co2Sb2O7 occupies a distinct niche compared to more conventional materials like NiO or LiCoO2. While many of its class members, such as LaMnO3 or BiFeO3, are widely utilized for their robust perovskite-based frameworks, Co2Sb2O7 represents a more specialized, metastable oxide structure that offers different electronic pathways for catalytic activity.

Explore

Related Compounds

Other Oxide Oxygen-Evolution Catalysts 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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