NaLi3V4O12

NaLi3V4O12 is a stable, wide-gap insulating oxide containing sodium, lithium, and vanadium that is considered a promising candidate for synthesis.

LiNaOV
Crystal structure of NaLi3V4O12
Ground-state structure · Materials Project
Overview

About NaLi3V4O12

NaLi3V4O12 is a complex oxide featuring lithium, sodium, and vanadium. As a wide-gap insulating material, it exhibits electronic characteristics typical of stable dielectric or ionic-conducting frameworks.

Its position near the thermodynamic hull suggests it is a viable candidate for experimental synthesis. The compound is of interest to researchers investigating novel multi-cation oxide systems for potential energy storage or solid-state electrolyte roles.

At a glance

Key Properties

Cross-validated computational properties for NaLi3V4O12, aggregated across 3 databases.

Band Gap

3.03 eV
Range across DFT structures

Energy Above Hull

0.022 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where NaLi3V4O12 is used.

Solid-state electrolyte researchAdvanced dielectric materialsEnergy storage material development
Reference

Frequently Asked Questions

Common questions about NaLi3V4O12, answered from cross-validated data.

What is NaLi3V4O12?

NaLi3V4O12 is a stable, wide-gap insulating oxide containing sodium, lithium, and vanadium that is considered a promising candidate for synthesis.

More questions
What is NaLi3V4O12 used for?
NaLi3V4O12 is used in solid-state electrolyte research, advanced dielectric materials, and energy storage material development.
What is the band gap of NaLi3V4O12?
NaLi3V4O12 has a DFT-computed band gap of 3.03 eV across 5 reported structures.
Is NaLi3V4O12 a metal, semiconductor, or insulator?
With a wide band gap up to 3.03 eV it is an insulator / wide-band-gap material.
Is NaLi3V4O12 thermodynamically stable?
NaLi3V4O12 has a lowest energy above hull of 0.022 eV/atom (near hull (likely stable)).
How many polymorphs of NaLi3V4O12 are known?
5 structures of NaLi3V4O12 are reported across 3 databases, spanning 1 distinct space group.
What elements does NaLi3V4O12 contain?
NaLi3V4O12 contains Li, Na, O, and V (4 elements).
Where does the data for NaLi3V4O12 come from?
NaLi3V4O12 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique multi-cation vanadium oxide, NaLi3V4O12 occupies a specialized niche in materials science. Without direct structural siblings in this specific class, it serves as a distinct example of how balancing alkali metal ratios with transition metal oxides can yield stable, insulating crystalline architectures.

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

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