Ag1Au1Cu2

Ag1Au1Cu2 is a semiconducting ternary alloy of silver, gold, and copper that exists in a metastable state.

AgAuCu
Crystal structure of Ag1Au1Cu2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Ag1Au1Cu2

Ag1Au1Cu2 is a complex ternary metallic compound incorporating silver, gold, and copper. As a semiconducting material, it represents a unique intersection of noble and transition metals, offering an intriguing electronic profile for fundamental materials research.

Despite its status as a metastable phase that sits above the thermodynamic hull, the compound has been documented in numerous structural configurations. This structural diversity highlights the intricate phase space of silver-gold-copper alloys and their potential for specialized electronic applications.

At a glance

Key Properties

Cross-validated computational properties for Ag1Au1Cu2, aggregated across 2 databases.

Band Gap

0.13 eV
Range across DFT structures

Energy Above Hull

1.691 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 17 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Ag1Au1Cu2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.131.6907-1.9241.24
Cm (No. 8)
I4/mmm (No. 139)
I-4m2 (No. 119)
C2/m (No. 12)
P4mm (No. 99)
P2/m (No. 10)
P4/mmm (No. 123)
P4/mmm (No. 123)
P4/mmm (No. 123)
F-43m (No. 216)
P4mm (No. 99)
Uses

Applications

Where Ag1Au1Cu2 is used.

Fundamental materials researchAlloy phase stability studies
Reference

Frequently Asked Questions

Common questions about Ag1Au1Cu2, answered from cross-validated data.

What is Ag1Au1Cu2?

Ag1Au1Cu2 is a semiconducting ternary alloy of silver, gold, and copper that exists in a metastable state.

More questions
What is Ag1Au1Cu2 used for?
Ag1Au1Cu2 is used in fundamental materials research and alloy phase stability studies.
What is the band gap of Ag1Au1Cu2?
Ag1Au1Cu2 has a DFT-computed band gap of 0.13 eV across 27 reported structures.
Is Ag1Au1Cu2 a metal, semiconductor, or insulator?
With a band gap up to 0.13 eV it is a semiconductor.
Is Ag1Au1Cu2 thermodynamically stable?
Ag1Au1Cu2 has a lowest energy above hull of 1.691 eV/atom (above hull).
What is the crystal structure of Ag1Au1Cu2?
The lowest-energy reported polymorph of Ag1Au1Cu2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Ag1Au1Cu2?
The computed density of the ground-state structure of Ag1Au1Cu2 is 1.24 g/cm³.
How many polymorphs of Ag1Au1Cu2 are known?
27 structures of Ag1Au1Cu2 are reported across 2 databases, spanning 17 distinct space groups.
What elements does Ag1Au1Cu2 contain?
Ag1Au1Cu2 contains Ag, Au, and Cu (3 elements).
Where does the data for Ag1Au1Cu2 come from?
Ag1Au1Cu2 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a ternary alloy, Ag1Au1Cu2 occupies a distinct niche in materials science where the mixing of noble metals creates complex, often metastable, crystalline arrangements that differ significantly from simple binary systems.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).

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