Ba2Cd1Ge1

Ba2Cd1Ge1 is a semimetallic ternary compound composed of barium, cadmium, and germanium that exhibits significant structural diversity.

BaCdGe
Crystal structure of Ba2Cd1Ge1
Ground-state structure · Materials Project
Overview

About Ba2Cd1Ge1

Ba2Cd1Ge1 is a complex ternary intermetallic compound composed of barium, cadmium, and germanium. Its electronic structure is characterized as a near-zero-gap semimetal, placing it in a unique position between metallic conductors and semiconducting materials.

As a material that sits above the thermodynamic hull, this compound is considered metastable, which presents interesting challenges and opportunities for synthesis and structural characterization. With numerous reported structural variations, it remains a subject of interest for fundamental solid-state chemistry research.

At a glance

Key Properties

Cross-validated computational properties for Ba2Cd1Ge1, aggregated across 2 databases.

Band Gap

0.07 eV
Range across DFT structures

Energy Above Hull

1.504 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 17 space groups
Reference

Frequently Asked Questions

Common questions about Ba2Cd1Ge1, answered from cross-validated data.

What is Ba2Cd1Ge1?

Ba2Cd1Ge1 is a semimetallic ternary compound composed of barium, cadmium, and germanium that exhibits significant structural diversity.

More questions
What is the band gap of Ba2Cd1Ge1?
Ba2Cd1Ge1 has a DFT-computed band gap of 0.07 eV across 27 reported structures.
Is Ba2Cd1Ge1 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Ba2Cd1Ge1 thermodynamically stable?
Ba2Cd1Ge1 has a lowest energy above hull of 1.504 eV/atom (above hull).
How many polymorphs of Ba2Cd1Ge1 are known?
27 structures of Ba2Cd1Ge1 are reported across 2 databases, spanning 17 distinct space groups.
What elements does Ba2Cd1Ge1 contain?
Ba2Cd1Ge1 contains Ba, Cd, and Ge (3 elements).
Where does the data for Ba2Cd1Ge1 come from?
Ba2Cd1Ge1 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary phase within the barium-cadmium-germanium system, Ba2Cd1Ge1 serves as a distinct example of how these elements can arrange into diverse structural motifs despite its metastable nature.

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

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