Li14Co2S9

This material is a lithium-based sulfide compound primarily investigated for its potential as a solid-state electrolyte in advanced battery technologies. Its unique structural properties facilitate the movement of lithium ions, making it a subject of research for developing safer and more efficient energy storage systems.

CoLiS
Crystal structure of Li14Co2S9 (trigonal, P-3 (No. 147))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Li14Co2S9, aggregated across 3 databases.

Band Gap

0.61 eV
Range across DFT structures

Energy Above Hull

0.069 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 Li14Co2S9, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-3 (No. 147)trigonal0.610.0692-4.4362.02
P-3 (No. 147)
P-3 (No. 147)Trigonal2.02
P-3 (No. 147)Trigonal2.03
P-3 (No. 147)Trigonal2.06
Uses

Applications

Where Li14Co2S9 is used.

Solid-state batteriesEnergy storage researchElectrochemical devices
Reference

Frequently Asked Questions

Common questions about Li14Co2S9, answered from cross-validated data.

What is Li14Co2S9?

This material is a lithium-based sulfide compound primarily investigated for its potential as a solid-state electrolyte in advanced battery technologies. Its unique structural properties facilitate the movement of lithium ions, making it a subject of research for developing safer and more efficient energy storage systems.

More questions
What is Li14Co2S9 used for?
Li14Co2S9 is used in solid-state batteries, energy storage research, and electrochemical devices.
What is the band gap of Li14Co2S9?
Li14Co2S9 has a DFT-computed band gap of 0.61 eV across 5 reported structures.
Is Li14Co2S9 a metal, semiconductor, or insulator?
With a band gap up to 0.61 eV it is a semiconductor.
Is Li14Co2S9 thermodynamically stable?
Li14Co2S9 has a lowest energy above hull of 0.069 eV/atom (metastable).
What is the crystal structure of Li14Co2S9?
The lowest-energy reported polymorph of Li14Co2S9 is trigonal symmetry, space group P-3 (No. 147).
What is the density of Li14Co2S9?
The computed density of the ground-state structure of Li14Co2S9 is 2.02 g/cm³.
How many polymorphs of Li14Co2S9 are known?
5 structures of Li14Co2S9 are reported across 3 databases, spanning 1 distinct space group.
What elements does Li14Co2S9 contain?
Li14Co2S9 contains Co, Li, and S (3 elements).
Where does the data for Li14Co2S9 come from?
Li14Co2S9 data is cross-referenced from materials_project, jarvis, mpaloe.
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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