CaV2O4

CaV2O4 is a thermodynamically stable semiconducting oxide used in fundamental materials research.

CaOV
Crystal structure of CaV2O4
Ground-state structure · Materials Project
Overview

About CaV2O4

CaV2O4 is a thermodynamically stable inorganic oxide that sits firmly on the convex hull, indicating robust structural integrity. As a semiconducting material, it offers a unique electronic profile that makes it a subject of interest for fundamental solid-state research and potential functional device integration.

Given its status as a well-documented material with numerous reported structures across major databases, this compound serves as a critical reference point for researchers studying vanadium-based oxides. Its stable nature allows for consistent investigation into its physical properties and performance in various material science contexts.

At a glance

Key Properties

Cross-validated computational properties for CaV2O4, aggregated across 4 databases.

Band Gap

0.02–1.55 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

58
4 databases, 14 space groups
Uses

Applications

Where CaV2O4 is used.

Solid-state electronic researchMaterials science characterizationFundamental oxide study
Reference

Frequently Asked Questions

Common questions about CaV2O4, answered from cross-validated data.

What is CaV2O4?

CaV2O4 is a thermodynamically stable semiconducting oxide used in fundamental materials research.

More questions
What is CaV2O4 used for?
CaV2O4 is used in solid-state electronic research, materials science characterization, and fundamental oxide study.
What is the band gap of CaV2O4?
CaV2O4 has a DFT-computed band gap of 0.02–1.55 eV across 58 reported structures.
Is CaV2O4 a metal, semiconductor, or insulator?
With a band gap up to 1.55 eV it is a semiconductor.
Is CaV2O4 thermodynamically stable?
Yes — CaV2O4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of CaV2O4 are known?
58 structures of CaV2O4 are reported across 4 databases, spanning 14 distinct space groups.
What elements does CaV2O4 contain?
CaV2O4 contains Ca, O, and V (3 elements).
Where does the data for CaV2O4 come from?
CaV2O4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct vanadium-based oxide, CaV2O4 represents a stable structural archetype within its chemical family. It serves as a primary example of how calcium and vanadium can arrange into a thermodynamically favored lattice, providing a baseline for understanding the electronic behavior of similar transition metal oxides.

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

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