Li4Nb3Cr5O16

Li4Nb3Cr5O16 is a metastable, semiconducting complex oxide composed of lithium, niobium, chromium, and oxygen.

CrLiNbO
Crystal structure of Li4Nb3Cr5O16
Ground-state structure · Materials Project
Overview

About Li4Nb3Cr5O16

Li4Nb3Cr5O16 is a complex oxide featuring a multi-metal cationic framework. As a semiconducting material, it represents a specialized composition within the broader landscape of lithium-based transition metal oxides, characterized by a delicate balance of niobium and chromium ions. Its metastable nature suggests that its synthesis and structural integrity are highly sensitive to processing conditions, making it a subject of interest for fundamental materials study. The compound exists in several distinct structural configurations, reflecting the flexibility of its atomic arrangement. This structural diversity is a key feature for researchers investigating how stoichiometry and lattice geometry influence electronic behavior in complex oxide systems. Its role as a semiconducting phase positions it within the ongoing exploration of functional materials that bridge the gap between insulating oxides and metallic conductors.

At a glance

Key Properties

Cross-validated computational properties for Li4Nb3Cr5O16, aggregated across 3 databases.

Band Gap

0.20 eV
Range across DFT structures

Energy Above Hull

0.066 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where Li4Nb3Cr5O16 is used.

Fundamental materials researchSolid-state chemistry studiesExploratory electronic materials development
Reference

Frequently Asked Questions

Common questions about Li4Nb3Cr5O16, answered from cross-validated data.

What is Li4Nb3Cr5O16?

Li4Nb3Cr5O16 is a metastable, semiconducting complex oxide composed of lithium, niobium, chromium, and oxygen.

More questions
What is Li4Nb3Cr5O16 used for?
Li4Nb3Cr5O16 is used in fundamental materials research, solid-state chemistry studies, and exploratory electronic materials development.
What is the band gap of Li4Nb3Cr5O16?
Li4Nb3Cr5O16 has a DFT-computed band gap of 0.20 eV across 5 reported structures.
Is Li4Nb3Cr5O16 a metal, semiconductor, or insulator?
With a band gap up to 0.20 eV it is a semiconductor.
Is Li4Nb3Cr5O16 thermodynamically stable?
Li4Nb3Cr5O16 has a lowest energy above hull of 0.066 eV/atom (metastable).
How many polymorphs of Li4Nb3Cr5O16 are known?
5 structures of Li4Nb3Cr5O16 are reported across 3 databases, spanning 1 distinct space group.
What elements does Li4Nb3Cr5O16 contain?
Li4Nb3Cr5O16 contains Cr, Li, Nb, and O (4 elements).
Where does the data for Li4Nb3Cr5O16 come from?
Li4Nb3Cr5O16 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique complex oxide, Li4Nb3Cr5O16 occupies a specialized niche in materials science. Unlike simpler binary or ternary oxides, this quaternary system leverages the interplay between niobium and chromium to tune its electronic properties, serving as a distinct example of how multi-component design can yield metastable phases with tailored semiconducting characteristics.

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

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