LiV2CrO6

LiV2CrO6 is a metastable semiconducting oxide composed of lithium, vanadium, chromium, and oxygen.

CrLiOV
Crystal structure of LiV2CrO6
Ground-state structure · Materials Project
Overview

About LiV2CrO6

LiV2CrO6 is a complex oxide containing lithium, vanadium, and chromium. As a metastable compound, it represents a synthetic challenge, often requiring specific processing conditions to stabilize its structure for characterization.

This material exhibits semiconducting electronic behavior, making it a subject of interest for researchers investigating tunable electrical properties in transition metal oxides. Its structural diversity is highlighted by the multiple reported configurations found in materials databases.

At a glance

Key Properties

Cross-validated computational properties for LiV2CrO6, aggregated across 3 databases.

Band Gap

1.05–1.21 eV
Range across DFT structures

Energy Above Hull

0.064 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

13
3 databases, 3 space groups
Reference

Frequently Asked Questions

Common questions about LiV2CrO6, answered from cross-validated data.

What is LiV2CrO6?

LiV2CrO6 is a metastable semiconducting oxide composed of lithium, vanadium, chromium, and oxygen.

More questions
What is the band gap of LiV2CrO6?
LiV2CrO6 has a DFT-computed band gap of 1.05–1.21 eV across 13 reported structures.
Is LiV2CrO6 a metal, semiconductor, or insulator?
With a band gap up to 1.21 eV it is a semiconductor.
Is LiV2CrO6 thermodynamically stable?
LiV2CrO6 has a lowest energy above hull of 0.064 eV/atom (metastable).
How many polymorphs of LiV2CrO6 are known?
13 structures of LiV2CrO6 are reported across 3 databases, spanning 3 distinct space groups.
What elements does LiV2CrO6 contain?
LiV2CrO6 contains Cr, Li, O, and V (4 elements).
Where does the data for LiV2CrO6 come from?
LiV2CrO6 data is cross-referenced from latticegraph.
Comparison

How It Compares

As an unclassified complex oxide, LiV2CrO6 occupies a unique niche in materials science. Without direct structural siblings, it serves as an important case study for understanding how the interplay between lithium, vanadium, and chromium influences the stability and electronic nature of multi-component oxide systems.

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

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