MgSb2

MgSb2 is a metallic magnesium-antimony compound that exhibits significant structural diversity despite its metastable nature.

MgSb
Crystal structure of MgSb2
Ground-state structure · Materials Project
Overview

About MgSb2

MgSb2 is a metallic binary compound composed of magnesium and antimony. Its electronic character suggests conductive properties typical of intermetallic phases, though it exhibits a complex structural landscape with numerous reported configurations across various databases.

Due to its position relative to the thermodynamic hull, this material is considered metastable under standard conditions. Its study is primarily driven by the rich structural polymorphism observed, which provides valuable insights into the phase stability of magnesium-based pnictides.

At a glance

Key Properties

Cross-validated computational properties for MgSb2, aggregated across 4 databases.

Band Gap

Metallic / not reported

Energy Above Hull

0.104 eV/atom
Best (lowest) across sources

Stability

Above hull
3 DFT sources

Structures

54
4 databases, 13 space groups
Synthesis

Synthesis Routes

Literature-extracted synthesis procedures targeting MgSb2.

Solid State
Procedure available · ceder_solid_state
Uses

Applications

Where MgSb2 is used.

Materials science researchFundamental phase stability studiesIntermetallic structural analysis
Reference

Frequently Asked Questions

Common questions about MgSb2, answered from cross-validated data.

What is MgSb2?

MgSb2 is a metallic magnesium-antimony compound that exhibits significant structural diversity despite its metastable nature.

More questions
What is MgSb2 used for?
MgSb2 is used in materials science research, fundamental phase stability studies, and intermetallic structural analysis.
What is the band gap of MgSb2?
MgSb2 is computed to be metallic (no band gap) in the reported DFT structures.
Is MgSb2 a metal, semiconductor, or insulator?
Computed band structures report no gap, so it is metallic.
Is MgSb2 thermodynamically stable?
MgSb2 has a lowest energy above hull of 0.104 eV/atom (above hull).
How many polymorphs of MgSb2 are known?
54 structures of MgSb2 are reported across 4 databases, spanning 13 distinct space groups.
How is MgSb2 synthesized?
Literature-reported routes for MgSb2 include solid state.
What elements does MgSb2 contain?
MgSb2 contains Mg and Sb (2 elements).
Where does the data for MgSb2 come from?
MgSb2 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a member of the magnesium-antimony system, MgSb2 represents a distinct structural arrangement compared to more stable, stoichiometry-optimized phases. While many binary intermetallics in this family are synthesized for thermoelectric or semiconductor applications, MgSb2 serves as a critical case study for understanding the limits of phase formation and structural complexity in non-equilibrium metallic systems.

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

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