Li2MnCr3O8

Li2MnCr3O8 is a metastable, semiconducting layered oxide containing lithium, manganese, and chromium used in materials science research.

Crystal structure of Li2MnCr3O8
Ground-state structure · Materials Project
Overview

About Li2MnCr3O8

Li2MnCr3O8 is a complex layered lithium transition-metal oxide characterized by its semiconducting electronic nature. As a metastable phase, it represents a unique structural arrangement within the broader family of lithium-based oxide materials, offering distinct coordination environments for its constituent transition metals.

Its significance lies in its potential for structural tuning and electrochemical exploration. By incorporating both manganese and chromium into the lithium-oxide framework, researchers utilize this compound to study ion mobility and structural stability, which are critical factors for the development of next-generation energy storage systems.

At a glance

Key Properties

Cross-validated computational properties for Li2MnCr3O8, aggregated across 3 databases.

Band Gap

0.09–0.97 eV
Range across DFT structures

Energy Above Hull

0.067 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

28
3 databases, 8 space groups
Uses

Applications

Where Li2MnCr3O8 is used.

Energy storage researchBattery electrode material developmentSolid-state ionics
Reference

Frequently Asked Questions

Common questions about Li2MnCr3O8, answered from cross-validated data.

What is Li2MnCr3O8?

Li2MnCr3O8 is a metastable, semiconducting layered oxide containing lithium, manganese, and chromium used in materials science research.

More questions
What is Li2MnCr3O8 used for?
Li2MnCr3O8 is used in energy storage research, battery electrode material development, and solid-state ionics.
What is the band gap of Li2MnCr3O8?
Li2MnCr3O8 has a DFT-computed band gap of 0.09–0.97 eV across 28 reported structures.
Is Li2MnCr3O8 a metal, semiconductor, or insulator?
With a band gap up to 0.97 eV it is a semiconductor.
Is Li2MnCr3O8 thermodynamically stable?
Li2MnCr3O8 has a lowest energy above hull of 0.067 eV/atom (metastable).
How many polymorphs of Li2MnCr3O8 are known?
28 structures of Li2MnCr3O8 are reported across 3 databases, spanning 8 distinct space groups.
What elements does Li2MnCr3O8 contain?
Li2MnCr3O8 contains Cr, Li, Mn, and O (4 elements).
Where does the data for Li2MnCr3O8 come from?
Li2MnCr3O8 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the layered lithium transition-metal oxides class.

Within the diverse class of layered lithium transition-metal oxides, Li2MnCr3O8 occupies a specialized niche compared to more conventional materials like LiCoO2 or LiMn2O4. While compounds such as LiNiO2 are widely recognized for their commercial utility in high-energy batteries, Li2MnCr3O8 is studied primarily for its complex multi-metal cation arrangement, which offers a different approach to managing structural stability and electronic behavior than the simpler binary transition-metal systems.

Explore

Related Compounds

Other Layered Lithium Transition-Metal Oxides in the database.

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

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