GaI2

GaI2 is a stable, semiconducting gallium iodide compound recognized for its diverse structural configurations.

GaI
Crystal structure of GaI2
Ground-state structure · Materials Project
Overview

About GaI2

GaI2 is a distinct gallium-iodine compound characterized by its semiconducting electronic nature. As a thermodynamically stable phase residing on the convex hull, it represents a well-defined structural arrangement within the gallium halide family.

The compound is notable for its significant data richness, supported by a wide array of reported structural configurations across multiple databases. This depth of characterization makes it a valuable subject for fundamental studies in inorganic material science and coordination chemistry.

At a glance

Key Properties

Cross-validated computational properties for GaI2, aggregated across 4 databases.

Band Gap

2.47 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

39
4 databases, 13 space groups
Reference

Frequently Asked Questions

Common questions about GaI2, answered from cross-validated data.

What is GaI2?

GaI2 is a stable, semiconducting gallium iodide compound recognized for its diverse structural configurations.

More questions
What is the band gap of GaI2?
GaI2 has a DFT-computed band gap of 2.47 eV across 39 reported structures.
Is GaI2 a metal, semiconductor, or insulator?
With a band gap up to 2.47 eV it is a semiconductor.
Is GaI2 thermodynamically stable?
Yes — GaI2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of GaI2 are known?
39 structures of GaI2 are reported across 4 databases, spanning 13 distinct space groups.
What elements does GaI2 contain?
GaI2 contains Ga and I (2 elements).
Where does the data for GaI2 come from?
GaI2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique inorganic phase, GaI2 serves as a foundational reference point for understanding the structural diversity and bonding behavior of gallium-based halides.

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

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