K2CoO3

K2CoO3 is a metastable semiconducting oxide studied for its potential applications in oxygen-evolution catalysis.

Crystal structure of K2CoO3 (orthorhombic, Cmce (No. 64))
Ground-state structure · Materials Project
Overview

About K2CoO3

K2CoO3 is a complex oxide within the oxygen-evolution catalyst family, characterized by its semiconducting electronic nature. As a metastable phase, it represents a unique structural configuration that offers distinct pathways for electrochemical activity in energy conversion systems.

Its utility is primarily centered on its potential for catalytic oxygen production, where its specific atomic arrangement influences reaction kinetics. Researchers study this compound to understand how metastable oxides can be leveraged to improve the efficiency of water-splitting technologies.

At a glance

Key Properties

Cross-validated computational properties for K2CoO3, aggregated across 3 databases.

Band Gap

0.13 eV
Range across DFT structures

Energy Above Hull

0.059 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for K2CoO3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Cmce (No. 64)orthorhombic0.130.0594-5.4712.86
Cmce (No. 64)Orthorhombic2.86
Cmce (No. 64)Orthorhombic3.19
Cmce (No. 64)Orthorhombic3.05
Cmce (No. 64)
Uses

Applications

Where K2CoO3 is used.

Oxygen-evolution catalysisElectrochemical energy conversionWater-splitting research
Reference

Frequently Asked Questions

Common questions about K2CoO3, answered from cross-validated data.

What is K2CoO3?

K2CoO3 is a metastable semiconducting oxide studied for its potential applications in oxygen-evolution catalysis.

More questions
What is K2CoO3 used for?
K2CoO3 is used in oxygen-evolution catalysis, electrochemical energy conversion, and water-splitting research.
What is the band gap of K2CoO3?
K2CoO3 has a DFT-computed band gap of 0.13 eV across 5 reported structures.
Is K2CoO3 a metal, semiconductor, or insulator?
With a band gap up to 0.13 eV it is a semiconductor.
Is K2CoO3 thermodynamically stable?
K2CoO3 has a lowest energy above hull of 0.059 eV/atom (metastable).
What is the crystal structure of K2CoO3?
The lowest-energy reported polymorph of K2CoO3 is orthorhombic symmetry, space group Cmce (No. 64).
What is the density of K2CoO3?
The computed density of the ground-state structure of K2CoO3 is 2.86 g/cm³.
How many polymorphs of K2CoO3 are known?
5 structures of K2CoO3 are reported across 3 databases, spanning 1 distinct space group.
What elements does K2CoO3 contain?
K2CoO3 contains Co, K, and O (3 elements).
Where does the data for K2CoO3 come from?
K2CoO3 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

Within the oxide oxygen-evolution catalysts class.

Within the broad class of oxygen-evolution catalysts, K2CoO3 stands out as a metastable alternative to more conventional, highly stable materials like LiCoO2 or LaMnO3. While many of its class members, such as NiO or LiMn2O4, are recognized for their robust structural integrity, K2CoO3 provides a different electronic landscape that researchers explore to overcome limitations inherent in more common perovskite or spinel-based catalysts.

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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