In2O3

Indium oxide · Indium(III) oxide

Indium oxide is a stable, semiconducting metal oxide widely used for its transparency and electrical conductivity in electronic and sensing technologies.

Crystal structure of In2O3 (trigonal, R-3c (No. 167))
Ground-state structure · Materials Project
Overview

About Indium oxide

Indium oxide is a prominent member of the wide-bandgap oxide semiconductor family, characterized by its robust thermodynamic stability on the convex hull. Its unique electronic properties make it a foundational material in modern optoelectronics, where it serves as a critical component for transparent electrodes and various thin-film applications.

Beyond its role in conductive films, this material is widely utilized in chemical sensing due to its high sensitivity to atmospheric changes. Its structural versatility, evidenced by a vast array of reported experimental and theoretical configurations, underscores its reliability and importance in industrial material science.

At a glance

Key Properties

Cross-validated computational properties for Indium oxide, aggregated across 6 databases.

Band Gap

0.11–5.45 eV
Range across DFT structures · ground state: wide gap

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

Stable
4 DFT sources

Structures

111
6 databases, 24 space groups
Validation

Cross-Source DFT Agreement

How well independent DFT databases agree on the thermodynamics of In2O3. Tight agreement means computed properties can be trusted without re-running calculations.

Agreement Score

1.00 / 1.00
Trust tier: high

Hull Spread

0.000 eV
EAH spread across sources

Sources Compared

3
jarvis, materials_project, oqmd

Space Group Consensus

Mixed (most: I213 (No. 199))
Crystallography

Reported Structures

Lowest-energy structures reported for In2O3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
R-3c (No. 167)trigonal1.200.0000-1.703—
——1.190.0000-1.844—
Ia-3 (No. 206)cubic0.930.0000-6.0677.00
Pbcn (No. 60)orthorhombic0.830.0041-1.699—
——1.430.0129-1.831—
R-3c (No. 167)trigonal0.960.0207-6.0467.19
——1.270.0263-1.818—
——1.380.0299-1.814—
Pbca (No. 61)orthorhombic0.880.0311-6.0357.32
Pbcn (No. 60)orthorhombic0.760.0378-6.0297.43
——1.090.0480-1.796—
——1.000.0813-1.763—
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting In2O3.

Sol Gel
Procedure available · ceder_sol_gel
Sol Gel
Procedure available · ceder_sol_gel
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where Indium oxide is used.

Transparent conductive coatingsGas sensorsLiquid crystal displaysPhotovoltaic devicesThin-film transistors
Intellectual Property

Patent Landscape

6 patents reference In2O3 or close compositional variants.

PatentTitleAssigneeGranted
7700510Opto-ceramics made from In2O3 or oxides Y, Lu, Sc, Yb, In, Gd, and La, optical elements made therefrom, and ma——
8466077Sputtering target for forming ZrO2-In2O3 based protective film for optical storage medium——
9885109ITO ceramic sputtering targets with reduced In2O3 contents and method of producing it——
7157111MOCVD selective deposition of C-axis oriented PB5GE3O11 thin films on In2O3 oxides——
9214519In2O3—SnO2—ZnO sputtering target——
6235260Method for producing In2O3--SnO2 precursor sol——
Reference

Frequently Asked Questions

Common questions about Indium oxide, answered from cross-validated data.

What is In2O3?

Indium oxide is a stable, semiconducting metal oxide widely used for its transparency and electrical conductivity in electronic and sensing technologies.

More questions
What is In2O3 used for?
Indium oxide (In2O3) is used in transparent conductive coatings, gas sensors, liquid crystal displays, photovoltaic devices, and thin-film transistors.
What is the band gap of In2O3?
Indium oxide (In2O3) has a DFT-computed band gap of 0.11–5.45 eV across 111 reported structures. Standard DFT underestimates band gaps, so the measured gap is typically larger.
Is In2O3 a metal, semiconductor, or insulator?
DFT predicts a wide band gap of up to 5.45 eV (an insulator or wide-band-gap material).
Is In2O3 thermodynamically stable?
Yes — Indium oxide (In2O3) sits on the convex hull (energy above hull 0 eV/atom), i.e. stable.
What is the crystal structure of In2O3?
The reference structure of Indium oxide (In2O3) is trigonal symmetry, space group R-3c (No. 167).
How many polymorphs of In2O3 are known?
111 structures of In2O3 are reported across 6 databases, spanning 24 distinct space groups.
How is In2O3 synthesized?
Literature-reported routes for In2O3 include sol gel, solid state (10 procedures documented).
What elements does In2O3 contain?
Indium oxide (In2O3) contains In and O (2 elements).
Where does the data for In2O3 come from?
In2O3 data is cross-referenced from jarvis, oqmd, materials_project.
Reading

Related Research

Comparison

How It Compares

Within the wide-bandgap oxide semiconductors class.

Within the class of wide-bandgap oxides, In2O3 is distinguished by its superior electrical conductivity compared to insulators like Al2O3, positioning it as a functional counterpart to SnO2 and ZnO in transparent electronic applications.

Explore

Related Compounds

Other Wide-Bandgap Oxide Semiconductors in the database.

Data sources & attribution
  • jarvis — Data from JARVIS (jarvis.nist.gov), NIST. Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020). (LicenseRef-US-Gov-PD)
  • oqmd — Data from the OQMD (oqmd.org). Cite: Saal et al., JOM 65, 1501 (2013); Kirklin et al., npj Comp. Mater. 1, 15010 (2015). (CC-BY-4.0)
  • materials_project — Data from the Materials Project (materialsproject.org). Cite: Jain et al., APL Materials 1, 011002 (2013). (CC-BY-4.0)

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