Sr2ZrO4

Sr2ZrO4 is a metastable semiconducting perovskite oxide used primarily in fundamental materials science research.

Crystal structure of Sr2ZrO4
Ground-state structure · Materials Project
Overview

About Sr2ZrO4

Sr2ZrO4 is a complex perovskite oxide that exists in a metastable state. Its electronic character is defined as semiconducting, making it a subject of interest for researchers investigating the interplay between structural geometry and electronic behavior in oxide systems.

Because it is a member of the broader perovskite family, this compound serves as a model for understanding phase stability and structural transitions. It is primarily utilized in fundamental materials science research to explore the limits of oxide synthesis and the potential for tuning electronic properties through chemical substitution.

At a glance

Key Properties

Cross-validated computational properties for Sr2ZrO4, aggregated across 3 databases.

Band Gap

2.77 eV
Range across DFT structures

Energy Above Hull

0.035 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting Sr2ZrO4.

Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where Sr2ZrO4 is used.

Fundamental materials science researchOxide phase stability studiesElectronic property tuning investigations
Reference

Frequently Asked Questions

Common questions about Sr2ZrO4, answered from cross-validated data.

What is Sr2ZrO4?

Sr2ZrO4 is a metastable semiconducting perovskite oxide used primarily in fundamental materials science research.

More questions
What is Sr2ZrO4 used for?
Sr2ZrO4 is used in fundamental materials science research, oxide phase stability studies, and electronic property tuning investigations.
What is the band gap of Sr2ZrO4?
Sr2ZrO4 has a DFT-computed band gap of 2.77 eV across 5 reported structures.
Is Sr2ZrO4 a metal, semiconductor, or insulator?
With a band gap up to 2.77 eV it is a semiconductor.
Is Sr2ZrO4 thermodynamically stable?
Sr2ZrO4 has a lowest energy above hull of 0.035 eV/atom (metastable).
How many polymorphs of Sr2ZrO4 are known?
5 structures of Sr2ZrO4 are reported across 3 databases, spanning 1 distinct space group.
How is Sr2ZrO4 synthesized?
Literature-reported routes for Sr2ZrO4 include solid state.
What elements does Sr2ZrO4 contain?
Sr2ZrO4 contains O, Sr, and Zr (3 elements).
Where does the data for Sr2ZrO4 come from?
Sr2ZrO4 data is cross-referenced from latticegraph.
Comparison

How It Compares

Within the perovskite oxides class.

Within the diverse class of perovskite oxides, Sr2ZrO4 occupies a distinct niche compared to well-known, highly stable ferroelectrics like BaTiO3 or the widely studied magnetic perovskites such as LaMnO3 and LaFeO3. Unlike these archetypal materials, Sr2ZrO4 is characterized by its metastable nature, which differentiates its synthesis and processing requirements from the more robust and thermodynamically favored members of the group.

Explore

Related Compounds

Other Perovskite Oxides in the database.

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

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