Li4CoNi3O8

This material is a complex lithium-based transition metal oxide often investigated for its potential role in energy storage technologies. It is primarily studied as a cathode material candidate to improve the performance and stability of rechargeable battery systems.

Crystal structure of Li4CoNi3O8 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li4CoNi3O8, aggregated across 3 databases.

Band Gap

0.07 eV
Range across DFT structures

Energy Above Hull

0.010 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

5
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Li4CoNi3O8, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2/m (No. 12)monoclinic0.070.0099-6.0394.70
R-3 (No. 148)
C2/m (No. 12)Monoclinic4.93
C2/m (No. 12)Monoclinic4.70
C2/m (No. 12)Monoclinic5.04
Uses

Applications

Where Li4CoNi3O8 is used.

Lithium-ion battery researchEnergy storage material developmentElectrochemical cell studies
Reference

Frequently Asked Questions

Common questions about Li4CoNi3O8, answered from cross-validated data.

What is Li4CoNi3O8?

This material is a complex lithium-based transition metal oxide often investigated for its potential role in energy storage technologies. It is primarily studied as a cathode material candidate to improve the performance and stability of rechargeable battery systems.

More questions
What is Li4CoNi3O8 used for?
Li4CoNi3O8 is used in lithium-ion battery research, energy storage material development, and electrochemical cell studies.
What is the band gap of Li4CoNi3O8?
Li4CoNi3O8 has a DFT-computed band gap of 0.07 eV across 5 reported structures.
Is Li4CoNi3O8 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Li4CoNi3O8 thermodynamically stable?
Li4CoNi3O8 has a lowest energy above hull of 0.010 eV/atom (near hull (likely stable)).
What is the crystal structure of Li4CoNi3O8?
The lowest-energy reported polymorph of Li4CoNi3O8 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Li4CoNi3O8?
The computed density of the ground-state structure of Li4CoNi3O8 is 4.70 g/cm³.
How many polymorphs of Li4CoNi3O8 are known?
5 structures of Li4CoNi3O8 are reported across 3 databases, spanning 2 distinct space groups.
What elements does Li4CoNi3O8 contain?
Li4CoNi3O8 contains Co, Li, Ni, and O (4 elements).
Where does the data for Li4CoNi3O8 come from?
Li4CoNi3O8 data is cross-referenced from materials_project, jarvis, mpaloe.
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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).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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