Cu1Nb1Rh2

Cu1Nb1Rh2 is a semiconducting ternary intermetallic alloy containing copper, niobium, and rhodium.

Crystal structure of Cu1Nb1Rh2 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Cu1Nb1Rh2

Cu1Nb1Rh2 is a complex intermetallic compound categorized within the platinum-group alloy catalysts. As a semiconducting material, it represents a specialized electronic configuration that distinguishes it from the more common metallic conductors found in this class.

Due to its position above the thermodynamic hull, this compound is considered metastable, reflecting the intricate synthesis challenges associated with its formation. Its existence in structural databases highlights its role as a subject of interest in exploratory materials science research.

At a glance

Key Properties

Cross-validated computational properties for Cu1Nb1Rh2, aggregated across 2 databases.

Band Gap

0.17 eV
Range across DFT structures

Energy Above Hull

2.942 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 16 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Cu1Nb1Rh2, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.172.9423-4.6450.88
Cm (No. 8)
C2/m (No. 12)
P4/mmm (No. 123)
P4mm (No. 99)
P4/mmm (No. 123)
F-43m (No. 216)
Pmmm (No. 47)
R3m (No. 160)
Pm (No. 6)
P2/m (No. 10)
I4/mmm (No. 139)
Uses

Applications

Where Cu1Nb1Rh2 is used.

Catalysis researchMaterials science explorationIntermetallic compound studies
Reference

Frequently Asked Questions

Common questions about Cu1Nb1Rh2, answered from cross-validated data.

What is Cu1Nb1Rh2?

Cu1Nb1Rh2 is a semiconducting ternary intermetallic alloy containing copper, niobium, and rhodium.

More questions
What is Cu1Nb1Rh2 used for?
Cu1Nb1Rh2 is used in catalysis research, materials science exploration, and intermetallic compound studies.
What is the band gap of Cu1Nb1Rh2?
Cu1Nb1Rh2 has a DFT-computed band gap of 0.17 eV across 27 reported structures.
Is Cu1Nb1Rh2 a metal, semiconductor, or insulator?
With a band gap up to 0.17 eV it is a semiconductor.
Is Cu1Nb1Rh2 thermodynamically stable?
Cu1Nb1Rh2 has a lowest energy above hull of 2.942 eV/atom (above hull).
What is the crystal structure of Cu1Nb1Rh2?
The lowest-energy reported polymorph of Cu1Nb1Rh2 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Cu1Nb1Rh2?
The computed density of the ground-state structure of Cu1Nb1Rh2 is 0.88 g/cm³.
How many polymorphs of Cu1Nb1Rh2 are known?
27 structures of Cu1Nb1Rh2 are reported across 2 databases, spanning 16 distinct space groups.
What elements does Cu1Nb1Rh2 contain?
Cu1Nb1Rh2 contains Cu, Nb, and Rh (3 elements).
Where does the data for Cu1Nb1Rh2 come from?
Cu1Nb1Rh2 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

Within the platinum-group alloy catalysts class.

Within the diverse landscape of platinum-group alloys, Cu1Nb1Rh2 occupies a unique niche compared to more stable, binary-heavy counterparts like LaRh or GeRu. While many members of this class are characterized by high thermodynamic stability, Cu1Nb1Rh2 stands out as a more elusive, complex ternary phase that challenges standard predictive models for catalyst design.

Explore

Related Compounds

Other Platinum-Group Alloy Catalysts in the database.

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).

Analyze Cu1Nb1Rh2 in the Lattice Graph platform

Polymorph comparison, confidence scoring, supply-chain risk, and patent monitoring — across 53 integrated data sources.

Explore the Platform →