LiV3CoO10

LiV3CoO10 is a semiconducting, metastable layered lithium transition-metal oxide used in electrochemical research.

Crystal structure of LiV3CoO10 (monoclinic, C2 (No. 5))
Ground-state structure · Materials Project
Overview

About LiV3CoO10

LiV3CoO10 belongs to the family of layered lithium transition-metal oxides, characterized by its semiconducting electronic structure. This material is recognized as a metastable phase, making it a subject of significant interest for researchers investigating complex intercalation chemistries and structural transformations within oxide frameworks. Its unique stoichiometry involving vanadium and cobalt allows for diverse electrochemical behaviors that are critical for developing next-generation energy storage systems. By leveraging its layered architecture, scientists aim to optimize ion mobility and structural integrity for high-performance battery applications.

At a glance

Key Properties

Cross-validated computational properties for LiV3CoO10, aggregated across 3 databases.

Band Gap

0.67 eV
Range across DFT structures

Energy Above Hull

0.093 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for LiV3CoO10, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
C2 (No. 5)monoclinic0.670.0935-7.7273.12
C2 (No. 5)
C2 (No. 5)Monoclinic3.37
C2 (No. 5)Monoclinic3.12
C2 (No. 5)Monoclinic3.17
Uses

Applications

Where LiV3CoO10 is used.

Battery electrode researchEnergy storage material developmentIntercalation chemistry studies
Reference

Frequently Asked Questions

Common questions about LiV3CoO10, answered from cross-validated data.

What is LiV3CoO10?

LiV3CoO10 is a semiconducting, metastable layered lithium transition-metal oxide used in electrochemical research.

More questions
What is LiV3CoO10 used for?
LiV3CoO10 is used in battery electrode research, energy storage material development, and intercalation chemistry studies.
What is the band gap of LiV3CoO10?
LiV3CoO10 has a DFT-computed band gap of 0.67 eV across 5 reported structures.
Is LiV3CoO10 a metal, semiconductor, or insulator?
With a band gap up to 0.67 eV it is a semiconductor.
Is LiV3CoO10 thermodynamically stable?
LiV3CoO10 has a lowest energy above hull of 0.093 eV/atom (metastable).
What is the crystal structure of LiV3CoO10?
The lowest-energy reported polymorph of LiV3CoO10 is monoclinic symmetry, space group C2 (No. 5).
What is the density of LiV3CoO10?
The computed density of the ground-state structure of LiV3CoO10 is 3.12 g/cm³.
How many polymorphs of LiV3CoO10 are known?
5 structures of LiV3CoO10 are reported across 3 databases, spanning 1 distinct space group.
What elements does LiV3CoO10 contain?
LiV3CoO10 contains Co, Li, O, and V (4 elements).
Where does the data for LiV3CoO10 come from?
LiV3CoO10 data is cross-referenced from materials_project, jarvis, mpaloe.
Comparison

How It Compares

Within the layered lithium transition-metal oxides class.

Unlike the highly stable and commercially ubiquitous LiCoO2 or the spinel-structured LiMn2O4, LiV3CoO10 occupies a more specialized niche as a metastable layered oxide. While siblings like LiNiO2 are primarily focused on high-capacity cathode performance, this vanadium-containing compound offers a different electronic profile that challenges conventional design paradigms for transition-metal oxide electrodes.

Explore

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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