AgAuO3

AgAuO3 is a metastable semiconducting oxide containing both silver and gold that is primarily studied for its unique electronic characteristics.

AgAuO
Crystal structure of AgAuO3 (cubic, Fd-3m (No. 227))
Ground-state structure · Materials Project
Overview

About AgAuO3

AgAuO3 is a ternary oxide compound featuring both silver and gold cations. As a semiconducting material, it exhibits electronic properties that bridge the gap between traditional metallic oxides and more complex transition metal systems, making it a subject of interest for fundamental materials science studies.

Due to its metastable nature, this compound requires specific synthesis conditions to stabilize its structure. Its existence in multiple reported configurations across various databases highlights the complexity of its phase space and the ongoing efforts to characterize its potential utility in specialized electronic applications.

At a glance

Key Properties

Cross-validated computational properties for AgAuO3, aggregated across 3 databases.

Band Gap

0.24 eV
Range across DFT structures

Energy Above Hull

0.059 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

6
3 databases, 2 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for AgAuO3, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fd-3m (No. 227)cubic0.240.0594-4.5498.57
Cmcm (No. 63)orthorhombic0.000.4187-4.1907.96
Fd-3m (No. 227)Cubic8.57
Fd-3m (No. 227)Cubic9.33
Fd-3m (No. 227)
Fd-3m (No. 227)Cubic8.97
Uses

Applications

Where AgAuO3 is used.

Fundamental materials researchElectronic property studiesTernary oxide synthesis development
Reference

Frequently Asked Questions

Common questions about AgAuO3, answered from cross-validated data.

What is AgAuO3?

AgAuO3 is a metastable semiconducting oxide containing both silver and gold that is primarily studied for its unique electronic characteristics.

More questions
What is AgAuO3 used for?
AgAuO3 is used in fundamental materials research, electronic property studies, and ternary oxide synthesis development.
What is the band gap of AgAuO3?
AgAuO3 has a DFT-computed band gap of 0.24 eV across 6 reported structures.
Is AgAuO3 a metal, semiconductor, or insulator?
With a band gap up to 0.24 eV it is a semiconductor.
Is AgAuO3 thermodynamically stable?
AgAuO3 has a lowest energy above hull of 0.059 eV/atom (metastable).
What is the crystal structure of AgAuO3?
The lowest-energy reported polymorph of AgAuO3 is cubic symmetry, space group Fd-3m (No. 227).
What is the density of AgAuO3?
The computed density of the ground-state structure of AgAuO3 is 8.57 g/cm³.
How many polymorphs of AgAuO3 are known?
6 structures of AgAuO3 are reported across 3 databases, spanning 2 distinct space groups.
What elements does AgAuO3 contain?
AgAuO3 contains Ag, Au, and O (3 elements).
Where does the data for AgAuO3 come from?
AgAuO3 data is cross-referenced from materials_project, mpaloe, jarvis.
Comparison

How It Compares

As a unique ternary oxide, AgAuO3 occupies a distinct niche in materials science where the combination of noble metals in an oxide framework creates unconventional electronic behavior. It serves as a benchmark for understanding the interplay between silver and gold within oxygen-coordinated lattices, offering insights into how metastability influences the functional properties of complex oxides.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • mpaloe — Data from mpaloe.
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).

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