La2MgSe4

La2MgSe4 is a metastable semiconducting compound composed of lanthanum, magnesium, and selenium.

LaMgSe
Crystal structure of La2MgSe4
Ground-state structure · Materials Project
Overview

About La2MgSe4

La2MgSe4 is a complex ternary selenide featuring lanthanum, magnesium, and selenium. As a semiconducting material, it represents a unique intersection of rare-earth chemistry and chalcogenide physics, offering distinct electronic properties that differentiate it from simpler binary compounds. Its existence as a metastable phase highlights the intricate synthesis conditions required to stabilize its specific crystalline arrangement. The material is of significant interest to researchers investigating novel semiconductors for specialized optoelectronic or thermoelectric applications. Due to its structural complexity, it serves as a valuable subject for understanding how composition influences electronic behavior in ternary systems.

At a glance

Key Properties

Cross-validated computational properties for La2MgSe4, aggregated across 3 databases.

Band Gap

1.33–2.51 eV
Range across DFT structures

Energy Above Hull

0.049 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

20
3 databases, 5 space groups
Uses

Applications

Where La2MgSe4 is used.

semiconductor researchoptoelectronic material developmentthermoelectric material studies
Reference

Frequently Asked Questions

Common questions about La2MgSe4, answered from cross-validated data.

What is La2MgSe4?

La2MgSe4 is a metastable semiconducting compound composed of lanthanum, magnesium, and selenium.

More questions
What is La2MgSe4 used for?
La2MgSe4 is used in semiconductor research, optoelectronic material development, and thermoelectric material studies.
What is the band gap of La2MgSe4?
La2MgSe4 has a DFT-computed band gap of 1.33–2.51 eV across 20 reported structures.
Is La2MgSe4 a metal, semiconductor, or insulator?
With a band gap up to 2.51 eV it is a semiconductor.
Is La2MgSe4 thermodynamically stable?
La2MgSe4 has a lowest energy above hull of 0.049 eV/atom (metastable).
How many polymorphs of La2MgSe4 are known?
20 structures of La2MgSe4 are reported across 3 databases, spanning 5 distinct space groups.
What elements does La2MgSe4 contain?
La2MgSe4 contains La, Mg, and Se (3 elements).
Where does the data for La2MgSe4 come from?
La2MgSe4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a ternary selenide, La2MgSe4 occupies a specialized niche within the broader landscape of semiconducting chalcogenides. While many binary selenides are well-characterized, this compound exemplifies the structural diversity possible when incorporating lanthanum and magnesium into a single lattice, providing a unique case study in the stabilization of metastable phases.

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

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