Ca2Cd1Hg1

Ca2Cd1Hg1 is a semiconducting ternary intermetallic compound that is considered likely to be synthesizable due to its favorable thermodynamic stability.

CaCdHg
Crystal structure of Ca2Cd1Hg1
Ground-state structure · Materials Project
Overview

About Ca2Cd1Hg1

Ca2Cd1Hg1 is a ternary intermetallic compound characterized by its semiconducting electronic nature. As a material positioned near the thermodynamic hull, it is considered a promising candidate for experimental synthesis and further structural investigation.

Its unique composition of calcium, cadmium, and mercury places it in a specialized category of complex metallic phases. The material is of significant interest to researchers studying the interplay of heavy post-transition metals and alkaline earth elements in crystalline lattices.

At a glance

Key Properties

Cross-validated computational properties for Ca2Cd1Hg1, aggregated across 2 databases.

Band Gap

0.37 eV
Range across DFT structures

Energy Above Hull

0.003 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
1 DFT source

Structures

28
2 databases, 17 space groups
Uses

Applications

Where Ca2Cd1Hg1 is used.

Materials science researchSolid-state physics studiesFundamental crystallographic analysis
Reference

Frequently Asked Questions

Common questions about Ca2Cd1Hg1, answered from cross-validated data.

What is Ca2Cd1Hg1?

Ca2Cd1Hg1 is a semiconducting ternary intermetallic compound that is considered likely to be synthesizable due to its favorable thermodynamic stability.

More questions
What is Ca2Cd1Hg1 used for?
Ca2Cd1Hg1 is used in materials science research, solid-state physics studies, and fundamental crystallographic analysis.
What is the band gap of Ca2Cd1Hg1?
Ca2Cd1Hg1 has a DFT-computed band gap of 0.37 eV across 28 reported structures.
Is Ca2Cd1Hg1 a metal, semiconductor, or insulator?
With a band gap up to 0.37 eV it is a semiconductor.
Is Ca2Cd1Hg1 thermodynamically stable?
Ca2Cd1Hg1 has a lowest energy above hull of 0.003 eV/atom (near hull (likely stable)).
How many polymorphs of Ca2Cd1Hg1 are known?
28 structures of Ca2Cd1Hg1 are reported across 2 databases, spanning 17 distinct space groups.
What elements does Ca2Cd1Hg1 contain?
Ca2Cd1Hg1 contains Ca, Cd, and Hg (3 elements).
Where does the data for Ca2Cd1Hg1 come from?
Ca2Cd1Hg1 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary phase, Ca2Cd1Hg1 represents a distinct structural arrangement within its chemical family. While it currently stands as a singular entry without direct siblings in this specific dataset, its near-hull stability suggests it may serve as a foundational reference point for future studies into similar calcium-based intermetallic semiconductors.

Data sources & attribution
  • latticegraph — Lattice Graph Materials Intelligence Platform

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