Na2CuO2

Na2CuO2 is a metastable semimetallic oxide compound composed of sodium, copper, and oxygen.

CuNaO
Crystal structure of Na2CuO2
Ground-state structure · Materials Project
Overview

About Na2CuO2

Na2CuO2 is a complex oxide containing copper and sodium that exhibits near-zero-gap electronic behavior. Its semimetallic character makes it an intriguing subject for fundamental studies into the electronic structure of transition metal oxides.

As a metastable phase, this compound demonstrates significant structural flexibility, evidenced by its presence in multiple distinct crystallographic configurations across various materials databases. This structural variety highlights its potential for nuanced phase transitions under different synthesis conditions.

At a glance

Key Properties

Cross-validated computational properties for Na2CuO2, aggregated across 3 databases.

Band Gap

0.07 eV
Range across DFT structures

Energy Above Hull

0.048 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

16
3 databases, 5 space groups
Reference

Frequently Asked Questions

Common questions about Na2CuO2, answered from cross-validated data.

What is Na2CuO2?

Na2CuO2 is a metastable semimetallic oxide compound composed of sodium, copper, and oxygen.

More questions
What is the band gap of Na2CuO2?
Na2CuO2 has a DFT-computed band gap of 0.07 eV across 16 reported structures.
Is Na2CuO2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Na2CuO2 thermodynamically stable?
Na2CuO2 has a lowest energy above hull of 0.048 eV/atom (metastable).
How many polymorphs of Na2CuO2 are known?
16 structures of Na2CuO2 are reported across 3 databases, spanning 5 distinct space groups.
What elements does Na2CuO2 contain?
Na2CuO2 contains Cu, Na, and O (3 elements).
Where does the data for Na2CuO2 come from?
Na2CuO2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique oxide phase, Na2CuO2 occupies a specialized niche in materials science, serving as a critical reference point for understanding the interplay between alkali metal cations and copper-oxygen frameworks in metastable systems.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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