Pb1Sr2Zn1

Pb1Sr2Zn1 is a semiconducting ternary intermetallic compound that is considered thermodynamically stable enough to be synthesized.

PbSrZn
Crystal structure of Pb1Sr2Zn1 (cubic, Fm-3m (No. 225))
Ground-state structure · Materials Project
Overview

About Pb1Sr2Zn1

Pb1Sr2Zn1 is a complex intermetallic compound composed of lead, strontium, and zinc. As a semiconducting material, it occupies a unique electronic niche that distinguishes it from purely metallic alloys, making it a subject of interest for fundamental solid-state research.

Because it is classified as a near-hull phase, this compound is considered thermodynamically accessible and likely synthesizable under controlled conditions. Its existence within structural databases highlights its role as a candidate material for exploring new phase spaces in ternary intermetallic systems.

At a glance

Key Properties

Cross-validated computational properties for Pb1Sr2Zn1, aggregated across 2 databases.

Band Gap

0.05–0.15 eV
Range across DFT structures

Energy Above Hull

0.021 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
1 DFT source

Structures

28
2 databases, 15 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Pb1Sr2Zn1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Fm-3m (No. 225)cubic0.050.0207-24.4095.60
Immm (No. 71)orthorhombic0.151.6002-22.8300.41
P4/mmm (No. 123)
Cmmm (No. 65)
P4/mmm (No. 123)
Fm-3m (No. 225)
P4/mmm (No. 123)
P4/mmm (No. 123)
R-3m (No. 166)
P4/mmm (No. 123)
Cmm2 (No. 35)
P4mm (No. 99)
Uses

Applications

Where Pb1Sr2Zn1 is used.

Solid-state researchMaterials discoveryFundamental electronic property studies
Reference

Frequently Asked Questions

Common questions about Pb1Sr2Zn1, answered from cross-validated data.

What is Pb1Sr2Zn1?

Pb1Sr2Zn1 is a semiconducting ternary intermetallic compound that is considered thermodynamically stable enough to be synthesized.

More questions
What is Pb1Sr2Zn1 used for?
Pb1Sr2Zn1 is used in solid-state research, materials discovery, and fundamental electronic property studies.
What is the band gap of Pb1Sr2Zn1?
Pb1Sr2Zn1 has a DFT-computed band gap of 0.05–0.15 eV across 28 reported structures.
Is Pb1Sr2Zn1 a metal, semiconductor, or insulator?
With a band gap up to 0.15 eV it is a semiconductor.
Is Pb1Sr2Zn1 thermodynamically stable?
Pb1Sr2Zn1 has a lowest energy above hull of 0.021 eV/atom (near hull (likely stable)).
What is the crystal structure of Pb1Sr2Zn1?
The lowest-energy reported polymorph of Pb1Sr2Zn1 is cubic symmetry, space group Fm-3m (No. 225).
What is the density of Pb1Sr2Zn1?
The computed density of the ground-state structure of Pb1Sr2Zn1 is 5.60 g/cm³.
How many polymorphs of Pb1Sr2Zn1 are known?
28 structures of Pb1Sr2Zn1 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Pb1Sr2Zn1 contain?
Pb1Sr2Zn1 contains Pb, Sr, and Zn (3 elements).
Where does the data for Pb1Sr2Zn1 come from?
Pb1Sr2Zn1 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a unique ternary intermetallic, Pb1Sr2Zn1 serves as a foundational example of how heavy metal and alkaline earth combinations can yield stable semiconducting phases, providing a benchmark for future studies into similar multi-element structural architectures.

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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