Cd1Cu2Y1

Cd1Cu2Y1 is a semiconducting ternary compound of cadmium, copper, and yttrium that is generally considered thermodynamically unstable.

CdCuY
Crystal structure of Cd1Cu2Y1 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Cd1Cu2Y1

Cd1Cu2Y1 is a ternary intermetallic compound composed of cadmium, copper, and yttrium. It exhibits semiconducting electronic behavior, positioning it as an interesting subject for fundamental research into complex alloy systems.

Due to its position above the thermodynamic hull, this material is considered likely unstable under standard conditions. Despite this, the compound has been documented across multiple structural configurations, highlighting the diverse ways these elements can arrange themselves at the atomic scale.

At a glance

Key Properties

Cross-validated computational properties for Cd1Cu2Y1, aggregated across 2 databases.

Band Gap

0.38 eV
Range across DFT structures

Energy Above Hull

1.970 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

26
2 databases, 15 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Cd1Cu2Y1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.381.9701-2.1790.54
Pmm2 (No. 25)
Cm (No. 8)
F-43m (No. 216)
Fm-3m (No. 225)
I-4m2 (No. 119)
P4/mmm (No. 123)
Pmmm (No. 47)
Pmmm (No. 47)
R3m (No. 160)
Imm2 (No. 44)
Cmm2 (No. 35)
Intellectual Property

Patent Landscape

1 patent reference Cd1Cu2Y1 or close compositional variants.

PatentTitleAssigneeGranted
8248032Charging system for prioritizing load consumption in a notebook computer
Reference

Frequently Asked Questions

Common questions about Cd1Cu2Y1, answered from cross-validated data.

What is Cd1Cu2Y1?

Cd1Cu2Y1 is a semiconducting ternary compound of cadmium, copper, and yttrium that is generally considered thermodynamically unstable.

More questions
What is the band gap of Cd1Cu2Y1?
Cd1Cu2Y1 has a DFT-computed band gap of 0.38 eV across 26 reported structures.
Is Cd1Cu2Y1 a metal, semiconductor, or insulator?
With a band gap up to 0.38 eV it is a semiconductor.
Is Cd1Cu2Y1 thermodynamically stable?
Cd1Cu2Y1 has a lowest energy above hull of 1.970 eV/atom (above hull).
What is the crystal structure of Cd1Cu2Y1?
The lowest-energy reported polymorph of Cd1Cu2Y1 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Cd1Cu2Y1?
The computed density of the ground-state structure of Cd1Cu2Y1 is 0.54 g/cm³.
How many polymorphs of Cd1Cu2Y1 are known?
26 structures of Cd1Cu2Y1 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Cd1Cu2Y1 contain?
Cd1Cu2Y1 contains Cd, Cu, and Y (3 elements).
Where does the data for Cd1Cu2Y1 come from?
Cd1Cu2Y1 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a unique ternary phase, Cd1Cu2Y1 serves as a distinct case study for the interplay between cadmium, copper, and yttrium. While it lacks direct siblings in this specific dataset, its existence within a broad range of reported structures underscores the complexity of phase formation in systems involving these transition and post-transition metals.

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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