Ga6I2Li8O24Si6

This compound is a complex inorganic material featuring a framework composed of gallium, silicon, and oxygen with lithium and iodine ions integrated into its structure. It is primarily studied in academic research for its unique crystalline architecture and potential properties related to ion transport or structural chemistry.

GaILiOSi
Crystal structure of Ga6I2Li8O24Si6 (cubic, P-43n (No. 218))
Ground-state structure · Materials Project
Overview

Key Properties

Cross-validated computational properties for Ga6I2Li8O24Si6, aggregated across 3 databases.

Band Gap

3.63 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

4
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for Ga6I2Li8O24Si6, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-43n (No. 218)cubic3.630.0000-6.7663.30
2.80
2.28
P-43n (No. 218)
Uses

Applications

Where Ga6I2Li8O24Si6 is used.

Materials science researchSolid-state chemistry studiesCrystallographic analysis
Reference

Frequently Asked Questions

Common questions about Ga6I2Li8O24Si6, answered from cross-validated data.

What is Ga6I2Li8O24Si6?

This compound is a complex inorganic material featuring a framework composed of gallium, silicon, and oxygen with lithium and iodine ions integrated into its structure. It is primarily studied in academic research for its unique crystalline architecture and potential properties related to ion transport or structural chemistry.

More questions
What is Ga6I2Li8O24Si6 used for?
Ga6I2Li8O24Si6 is used in materials science research, solid-state chemistry studies, and crystallographic analysis.
What is the band gap of Ga6I2Li8O24Si6?
Ga6I2Li8O24Si6 has a DFT-computed band gap of 3.63 eV across 4 reported structures.
Is Ga6I2Li8O24Si6 a metal, semiconductor, or insulator?
With a wide band gap up to 3.63 eV it is an insulator / wide-band-gap material.
Is Ga6I2Li8O24Si6 thermodynamically stable?
Yes — Ga6I2Li8O24Si6 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
What is the crystal structure of Ga6I2Li8O24Si6?
The lowest-energy reported polymorph of Ga6I2Li8O24Si6 is cubic symmetry, space group P-43n (No. 218).
What is the density of Ga6I2Li8O24Si6?
The computed density of the ground-state structure of Ga6I2Li8O24Si6 is 3.30 g/cm³.
How many polymorphs of Ga6I2Li8O24Si6 are known?
4 structures of Ga6I2Li8O24Si6 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ga6I2Li8O24Si6 contain?
Ga6I2Li8O24Si6 contains Ga, I, Li, O, and Si (5 elements).
Where does the data for Ga6I2Li8O24Si6 come from?
Ga6I2Li8O24Si6 data is cross-referenced from materials_project, omat24, aflow.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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