Li4MnCo3O8

This complex oxide is a lithium-based material primarily investigated for its potential role as a cathode component in energy storage systems. It is designed to facilitate the reversible movement of ions during charge and discharge cycles in advanced battery technologies.

Crystal structure of Li4MnCo3O8 (triclinic, P-1 (No. 2))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li4MnCo3O8, aggregated across 2 databases.

Band Gap

0.03–1.55 eV
Range across DFT structures

Energy Above Hull

0.058 eV/atom
Best (lowest) across sources

Stability

Metastable
1 DFT source

Structures

35
2 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Li4MnCo3O8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic0.490.0580-6.6534.49
P-1 (No. 2)triclinic0.450.0605-6.6504.46
P-1 (No. 2)triclinic0.030.0691-6.6424.46
P-1 (No. 2)triclinic0.670.0760-6.6354.37
C2/m (No. 12)monoclinic0.430.0760-6.6354.35
P2/m (No. 10)monoclinic0.720.0779-6.6334.44
P2/m (No. 10)monoclinic0.400.0790-6.6324.40
P-1 (No. 2)triclinic0.520.0792-6.6324.35
C2/m (No. 12)monoclinic0.280.0814-6.6294.45
P2/m (No. 10)monoclinic0.000.0842-6.6264.48
P-1 (No. 2)triclinic0.440.0883-6.6224.37
R-3m (No. 166)trigonal0.000.0899-6.6214.43
Uses

Applications

Where Li4MnCo3O8 is used.

Lithium-ion battery researchElectrode material developmentEnergy storage device fabrication
Reference

Frequently Asked Questions

Common questions about Li4MnCo3O8, answered from cross-validated data.

What is Li4MnCo3O8?

This complex oxide is a lithium-based material primarily investigated for its potential role as a cathode component in energy storage systems. It is designed to facilitate the reversible movement of ions during charge and discharge cycles in advanced battery technologies.

More questions
What is Li4MnCo3O8 used for?
Li4MnCo3O8 is used in lithium-ion battery research, electrode material development, and energy storage device fabrication.
What is the band gap of Li4MnCo3O8?
Li4MnCo3O8 has a DFT-computed band gap of 0.03–1.55 eV across 35 reported structures.
Is Li4MnCo3O8 a metal, semiconductor, or insulator?
With a band gap up to 1.55 eV it is a semiconductor.
Is Li4MnCo3O8 thermodynamically stable?
Li4MnCo3O8 has a lowest energy above hull of 0.058 eV/atom (metastable).
What is the crystal structure of Li4MnCo3O8?
The lowest-energy reported polymorph of Li4MnCo3O8 is triclinic symmetry, space group P-1 (No. 2).
What is the density of Li4MnCo3O8?
The computed density of the ground-state structure of Li4MnCo3O8 is 4.49 g/cm³.
How many polymorphs of Li4MnCo3O8 are known?
35 structures of Li4MnCo3O8 are reported across 2 databases, spanning 4 distinct space groups.
What elements does Li4MnCo3O8 contain?
Li4MnCo3O8 contains Co, Li, Mn, and O (4 elements).
Where does the data for Li4MnCo3O8 come from?
Li4MnCo3O8 data is cross-referenced from materials_project.
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Related Compounds

Other Layered Lithium Transition-Metal Oxides in the database.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).

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