Na2ZrO3

sodium zirconate

Sodium zirconate is a stable insulating oxide used primarily in carbon capture and gas purification applications.

Crystal structure of Na2ZrO3
Ground-state structure · Materials Project
Overview

About sodium zirconate

Sodium zirconate is a thermodynamically stable member of the perovskite oxide family, characterized by its wide-band-gap insulating electronic structure. Its robust chemical framework makes it a subject of interest for advanced materials engineering where structural integrity is paramount.

This compound is primarily utilized for its chemical reactivity with carbon dioxide, positioning it as a functional material for environmental remediation and gas separation technologies. Its stable nature ensures reliable performance in demanding thermal environments.

At a glance

Key Properties

Cross-validated computational properties for sodium zirconate, aggregated across 2 databases.

Band Gap

4.35 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
1 DFT source

Structures

2
2 databases, 1 space group
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Na2ZrO3.

Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where sodium zirconate is used.

CO2 captureGas separationCeramic materials
Reference

Frequently Asked Questions

Common questions about sodium zirconate, answered from cross-validated data.

What is Na2ZrO3?

Sodium zirconate is a stable insulating oxide used primarily in carbon capture and gas purification applications.

More questions
What is Na2ZrO3 used for?
sodium zirconate (Na2ZrO3) is used in cO2 capture, gas separation, and ceramic materials.
What is the band gap of Na2ZrO3?
sodium zirconate (Na2ZrO3) has a DFT-computed band gap of 4.35 eV across 2 reported structures.
Is Na2ZrO3 a metal, semiconductor, or insulator?
With a wide band gap up to 4.35 eV it is an insulator / wide-band-gap material.
Is Na2ZrO3 thermodynamically stable?
Yes — sodium zirconate (Na2ZrO3) sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Na2ZrO3 are known?
2 structures of Na2ZrO3 are reported across 2 databases, spanning 1 distinct space group.
How is Na2ZrO3 synthesized?
Literature-reported routes for Na2ZrO3 include sol gel, solid state (10 procedures documented).
What elements does Na2ZrO3 contain?
sodium zirconate (Na2ZrO3) contains Na, O, and Zr (3 elements).
Where does the data for Na2ZrO3 come from?
Na2ZrO3 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the perovskite oxides class.

Unlike the transition metal-based perovskites such as LaNiO3 or LaMnO3, which are frequently studied for their complex magnetic and metallic properties, sodium zirconate is distinguished by its insulating character and specific role in chemical absorption processes rather than electronic or catalytic applications common to its siblings like BaTiO3.

Explore

Related Compounds

Other Perovskite Oxides in the database.

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

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