MgSe2

Magnesium diselenide is a stable semiconducting material formed from magnesium and selenium.

MgSe
Crystal structure of MgSe2
Ground-state structure · Materials Project
Overview

About MgSe2

Magnesium diselenide is a semiconducting binary compound composed of magnesium and selenium. As a thermodynamically stable phase residing on the convex hull, it represents a well-defined structural configuration within its chemical system.

Its electronic character makes it an interesting subject for investigation in materials science. The compound is supported by a significant body of structural data, reflecting its importance in understanding magnesium-chalcogenide interactions.

At a glance

Key Properties

Cross-validated computational properties for MgSe2, aggregated across 4 databases.

Band Gap

1.97 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
3 DFT sources

Structures

57
4 databases, 16 space groups
Uses

Applications

Where MgSe2 is used.

Materials science researchSemiconductor development studies
Reference

Frequently Asked Questions

Common questions about MgSe2, answered from cross-validated data.

What is MgSe2?

Magnesium diselenide is a stable semiconducting material formed from magnesium and selenium.

More questions
What is MgSe2 used for?
MgSe2 is used in materials science research and semiconductor development studies.
What is the band gap of MgSe2?
MgSe2 has a DFT-computed band gap of 1.97 eV across 57 reported structures.
Is MgSe2 a metal, semiconductor, or insulator?
With a band gap up to 1.97 eV it is a semiconductor.
Is MgSe2 thermodynamically stable?
Yes — MgSe2 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of MgSe2 are known?
57 structures of MgSe2 are reported across 4 databases, spanning 16 distinct space groups.
What elements does MgSe2 contain?
MgSe2 contains Mg and Se (2 elements).
Where does the data for MgSe2 come from?
MgSe2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct binary phase, magnesium diselenide serves as a fundamental reference point for studying magnesium-based chalcogenides. It occupies a stable position in the phase space, providing a baseline for comparing the electronic and structural trends of similar alkaline earth metal selenides.

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

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