Li4Fe3CoO8

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

Crystal structure of Li4Fe3CoO8 (monoclinic, C2/m (No. 12))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li4Fe3CoO8, aggregated across 3 databases.

Band Gap

0.25–1.80 eV
Range across DFT structures

Energy Above Hull

0.012 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
2 DFT sources

Structures

15
3 databases, 4 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Li4Fe3CoO8, 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)monoclinic1.800.0117-6.8694.33
R-3m (No. 166)trigonal1.660.0163-6.8644.34
C2/m (No. 12)monoclinic0.250.0265-6.8544.26
C2/c (No. 15)monoclinic0.340.0297-6.8514.26
P1 (No. 1)triclinic1.250.0746-6.8063.43
C2/m (No. 12)
P1 (No. 1)
P1 (No. 1)Triclinic3.43
P1 (No. 1)Triclinic3.63
P1 (No. 1)Triclinic3.55
C2/m (No. 12)Monoclinic4.33
P1 (No. 1)
Uses

Applications

Where Li4Fe3CoO8 is used.

Rechargeable battery researchCathode material developmentElectrochemical energy storage
Reference

Frequently Asked Questions

Common questions about Li4Fe3CoO8, answered from cross-validated data.

What is Li4Fe3CoO8?

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

More questions
What is Li4Fe3CoO8 used for?
Li4Fe3CoO8 is used in rechargeable battery research, cathode material development, and electrochemical energy storage.
What is the band gap of Li4Fe3CoO8?
Li4Fe3CoO8 has a DFT-computed band gap of 0.25–1.80 eV across 15 reported structures.
Is Li4Fe3CoO8 a metal, semiconductor, or insulator?
With a band gap up to 1.80 eV it is a semiconductor.
Is Li4Fe3CoO8 thermodynamically stable?
Li4Fe3CoO8 has a lowest energy above hull of 0.012 eV/atom (near hull (likely stable)).
What is the crystal structure of Li4Fe3CoO8?
The lowest-energy reported polymorph of Li4Fe3CoO8 is monoclinic symmetry, space group C2/m (No. 12).
What is the density of Li4Fe3CoO8?
The computed density of the ground-state structure of Li4Fe3CoO8 is 4.33 g/cm³.
How many polymorphs of Li4Fe3CoO8 are known?
15 structures of Li4Fe3CoO8 are reported across 3 databases, spanning 4 distinct space groups.
What elements does Li4Fe3CoO8 contain?
Li4Fe3CoO8 contains Co, Fe, Li, and O (4 elements).
Where does the data for Li4Fe3CoO8 come from?
Li4Fe3CoO8 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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