Li3CrFe3O8

Li3CrFe3O8 is a metastable semiconducting oxide composed of lithium, chromium, and iron.

CrFeLiO
Crystal structure of Li3CrFe3O8
Ground-state structure · Materials Project
Overview

About Li3CrFe3O8

Li3CrFe3O8 is a complex oxide containing lithium, chromium, and iron. As a semiconducting material, it represents a unique intersection of transition metal chemistry and lithium-ion coordination, offering a distinct electronic profile for investigation in solid-state physics.

Because it exists in a metastable state, this compound is of significant interest for researchers studying phase transitions and synthetic pathways. Its structural complexity suggests a high degree of sensitivity to processing conditions, making it a subject of interest for those exploring novel oxide architectures.

At a glance

Key Properties

Cross-validated computational properties for Li3CrFe3O8, aggregated across 2 databases.

Band Gap

0.62 eV
Range across DFT structures

Energy Above Hull

0.063 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

13
2 databases, 4 space groups
Uses

Applications

Where Li3CrFe3O8 is used.

Solid-state chemistry researchFundamental materials science studiesAdvanced oxide synthesis investigations
Reference

Frequently Asked Questions

Common questions about Li3CrFe3O8, answered from cross-validated data.

What is Li3CrFe3O8?

Li3CrFe3O8 is a metastable semiconducting oxide composed of lithium, chromium, and iron.

More questions
What is Li3CrFe3O8 used for?
Li3CrFe3O8 is used in solid-state chemistry research, fundamental materials science studies, and advanced oxide synthesis investigations.
What is the band gap of Li3CrFe3O8?
Li3CrFe3O8 has a DFT-computed band gap of 0.62 eV across 13 reported structures.
Is Li3CrFe3O8 a metal, semiconductor, or insulator?
With a band gap up to 0.62 eV it is a semiconductor.
Is Li3CrFe3O8 thermodynamically stable?
Li3CrFe3O8 has a lowest energy above hull of 0.063 eV/atom (metastable).
How many polymorphs of Li3CrFe3O8 are known?
13 structures of Li3CrFe3O8 are reported across 2 databases, spanning 4 distinct space groups.
What elements does Li3CrFe3O8 contain?
Li3CrFe3O8 contains Cr, Fe, Li, and O (4 elements).
Where does the data for Li3CrFe3O8 come from?
Li3CrFe3O8 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique oxide phase, Li3CrFe3O8 serves as a specialized example of ternary transition metal lithium oxides. While it lacks direct structural siblings in this context, it functions as a critical case study for understanding how the incorporation of chromium into iron-based oxide lattices influences overall thermodynamic stability and electronic behavior.

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

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