Li2CuSiO4

Li2CuSiO4 is a metastable, semiconducting silicate compound known for its diverse structural configurations.

CuLiOSi
Crystal structure of Li2CuSiO4
Ground-state structure · Materials Project
Overview

About Li2CuSiO4

Li2CuSiO4 is a complex silicate compound characterized by its semiconducting electronic nature. As a metastable phase, it represents a unique structural arrangement within the lithium-copper-silicon-oxygen system, offering researchers a distinct platform to investigate ion mobility and structural stability.

Its significance lies in the diverse structural configurations it can adopt, with numerous reported variations documented in materials databases. This structural flexibility makes it a subject of interest for fundamental studies in solid-state chemistry and potential electrochemical applications.

At a glance

Key Properties

Cross-validated computational properties for Li2CuSiO4, aggregated across 3 databases.

Band Gap

0.04–0.66 eV
Range across DFT structures

Energy Above Hull

0.054 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

60
3 databases, 9 space groups
Uses

Applications

Where Li2CuSiO4 is used.

Energy storage researchSolid-state chemistry studiesElectrochemical material development
Reference

Frequently Asked Questions

Common questions about Li2CuSiO4, answered from cross-validated data.

What is Li2CuSiO4?

Li2CuSiO4 is a metastable, semiconducting silicate compound known for its diverse structural configurations.

More questions
What is Li2CuSiO4 used for?
Li2CuSiO4 is used in energy storage research, solid-state chemistry studies, and electrochemical material development.
What is the band gap of Li2CuSiO4?
Li2CuSiO4 has a DFT-computed band gap of 0.04–0.66 eV across 60 reported structures.
Is Li2CuSiO4 a metal, semiconductor, or insulator?
With a band gap up to 0.66 eV it is a semiconductor.
Is Li2CuSiO4 thermodynamically stable?
Li2CuSiO4 has a lowest energy above hull of 0.054 eV/atom (metastable).
How many polymorphs of Li2CuSiO4 are known?
60 structures of Li2CuSiO4 are reported across 3 databases, spanning 9 distinct space groups.
What elements does Li2CuSiO4 contain?
Li2CuSiO4 contains Cu, Li, O, and Si (4 elements).
Where does the data for Li2CuSiO4 come from?
Li2CuSiO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a metastable silicate, this compound serves as a specialized example of complex lithium-based polyanionic materials. Within its class, it is notable for the high degree of structural polymorphism observed, distinguishing it as a versatile candidate for exploring how copper and lithium coordination environments influence overall material stability.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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