Na5VO5

Na5VO5 is a semiconducting sodium vanadium oxide that is considered a viable candidate for experimental synthesis due to its near-hull thermodynamic stability.

NaOV
Crystal structure of Na5VO5
Ground-state structure · Materials Project
Overview

About Na5VO5

Na5VO5 is a sodium-rich vanadium oxide characterized by its semiconducting electronic nature. As a material located near the thermodynamic hull, it represents a promising candidate for experimental synthesis and structural characterization within the broader family of alkali metal vanadates.

Its structural complexity is highlighted by its presence across multiple materials databases, suggesting a rich landscape of possible configurations. This compound serves as a valuable subject for researchers investigating the interplay between alkali metal coordination and vanadium oxidation states in solid-state systems.

At a glance

Key Properties

Cross-validated computational properties for Na5VO5, aggregated across 3 databases.

Band Gap

2.28–2.46 eV
Range across DFT structures

Energy Above Hull

0.002 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

6
3 databases, 2 space groups
Uses

Applications

Where Na5VO5 is used.

Solid-state materials researchSemiconductor device developmentFundamental crystallographic studies
Reference

Frequently Asked Questions

Common questions about Na5VO5, answered from cross-validated data.

What is Na5VO5?

Na5VO5 is a semiconducting sodium vanadium oxide that is considered a viable candidate for experimental synthesis due to its near-hull thermodynamic stability.

More questions
What is Na5VO5 used for?
Na5VO5 is used in solid-state materials research, semiconductor device development, and fundamental crystallographic studies.
What is the band gap of Na5VO5?
Na5VO5 has a DFT-computed band gap of 2.28–2.46 eV across 6 reported structures.
Is Na5VO5 a metal, semiconductor, or insulator?
With a band gap up to 2.46 eV it is a semiconductor.
Is Na5VO5 thermodynamically stable?
Na5VO5 has a lowest energy above hull of 0.002 eV/atom (near hull (likely stable)).
How many polymorphs of Na5VO5 are known?
6 structures of Na5VO5 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Na5VO5 contain?
Na5VO5 contains Na, O, and V (3 elements).
Where does the data for Na5VO5 come from?
Na5VO5 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique entry in the landscape of sodium vanadium oxides, Na5VO5 provides a distinct structural profile that differentiates it from more common, highly stable vanadium-based phases. Its position near the thermodynamic stability limit makes it a compelling subject for targeted synthesis efforts aimed at exploring new semiconducting materials.

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

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