Li2Mn3O6

Li2Mn3O6 is a metastable semiconducting lithium manganese oxide used in advanced materials research for energy storage.

Crystal structure of Li2Mn3O6
Ground-state structure · Materials Project
Overview

About Li2Mn3O6

Li2Mn3O6 belongs to the family of layered lithium transition-metal oxides, characterized by its semiconducting electronic structure. As a metastable phase, it represents a complex arrangement of lithium, manganese, and oxygen atoms that offers unique insights into structural diversity within lithium-based materials.

This compound is primarily of interest in materials science research, particularly for its potential applications in electrochemical energy storage systems. Its structural configuration is the subject of ongoing investigation to understand how metastable oxides can be stabilized and utilized in next-generation battery technologies.

At a glance

Key Properties

Cross-validated computational properties for Li2Mn3O6, aggregated across 4 databases.

Band Gap

0.05–0.86 eV
Range across DFT structures

Energy Above Hull

0.031 eV/atom
Best (lowest) across sources

Stability

Metastable
3 DFT sources

Structures

15
4 databases, 4 space groups
Uses

Applications

Where Li2Mn3O6 is used.

Electrochemical energy storage researchBattery electrode material development
Reference

Frequently Asked Questions

Common questions about Li2Mn3O6, answered from cross-validated data.

What is Li2Mn3O6?

Li2Mn3O6 is a metastable semiconducting lithium manganese oxide used in advanced materials research for energy storage.

More questions
What is Li2Mn3O6 used for?
Li2Mn3O6 is used in electrochemical energy storage research and battery electrode material development.
What is the band gap of Li2Mn3O6?
Li2Mn3O6 has a DFT-computed band gap of 0.05–0.86 eV across 15 reported structures.
Is Li2Mn3O6 a metal, semiconductor, or insulator?
With a band gap up to 0.86 eV it is a semiconductor.
Is Li2Mn3O6 thermodynamically stable?
Li2Mn3O6 has a lowest energy above hull of 0.031 eV/atom (metastable).
How many polymorphs of Li2Mn3O6 are known?
15 structures of Li2Mn3O6 are reported across 4 databases, spanning 4 distinct space groups.
What elements does Li2Mn3O6 contain?
Li2Mn3O6 contains Li, Mn, and O (3 elements).
Where does the data for Li2Mn3O6 come from?
Li2Mn3O6 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the layered lithium transition-metal oxides class.

Compared to well-established cathode materials like LiCoO2 and LiNiO2, Li2Mn3O6 is a metastable phase that highlights the structural complexity inherent in manganese-rich lithium oxides. Unlike the highly stable and widely commercialized LiMn2O4, this compound occupies a more niche position in the landscape of transition-metal oxides, serving as a critical subject for fundamental studies into phase stability and electrochemical behavior.

Explore

Related Compounds

Other Layered Lithium Transition-Metal Oxides in the database.

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

Analyze Li2Mn3O6 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →