Na3VO3

Na3VO3 is a metastable semiconducting oxide compound composed of sodium, vanadium, and oxygen.

NaOV
Crystal structure of Na3VO3
Ground-state structure · Materials Project
Overview

About Na3VO3

Na3VO3 is a complex oxide featuring sodium, vanadium, and oxygen. As a semiconducting material, it exhibits electronic properties that make it a subject of interest for fundamental solid-state studies.

Despite its metastable nature, the compound has been documented across multiple structural databases, reflecting its intricate coordination chemistry. Its existence in various configurations highlights the flexibility of vanadium-based anionic frameworks.

At a glance

Key Properties

Cross-validated computational properties for Na3VO3, aggregated across 3 databases.

Band Gap

0.19–0.70 eV
Range across DFT structures

Energy Above Hull

0.066 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

20
3 databases, 3 space groups
Reference

Frequently Asked Questions

Common questions about Na3VO3, answered from cross-validated data.

What is Na3VO3?

Na3VO3 is a metastable semiconducting oxide compound composed of sodium, vanadium, and oxygen.

More questions
What is the band gap of Na3VO3?
Na3VO3 has a DFT-computed band gap of 0.19–0.70 eV across 20 reported structures.
Is Na3VO3 a metal, semiconductor, or insulator?
With a band gap up to 0.70 eV it is a semiconductor.
Is Na3VO3 thermodynamically stable?
Na3VO3 has a lowest energy above hull of 0.066 eV/atom (metastable).
How many polymorphs of Na3VO3 are known?
20 structures of Na3VO3 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Na3VO3 contain?
Na3VO3 contains Na, O, and V (3 elements).
Where does the data for Na3VO3 come from?
Na3VO3 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique oxide in its structural class, Na3VO3 serves as a specialized example of how alkali metal-vanadate systems can adopt diverse metastable configurations, providing a distinct case study for researchers investigating non-equilibrium phase stability.

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

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