Hg1Mg2Sn1

Hg1Mg2Sn1 is a semiconducting ternary intermetallic compound composed of mercury, magnesium, and tin that is primarily studied for its structural complexity.

HgMgSn
Crystal structure of Hg1Mg2Sn1 (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About Hg1Mg2Sn1

Hg1Mg2Sn1 is a complex ternary intermetallic compound composed of mercury, magnesium, and tin. It exhibits semiconducting electronic behavior, positioning it as a material of interest for specialized electronic research and solid-state physics investigations.

Despite its existence in multiple structural configurations across databases, this compound is characterized as being thermodynamically above the hull. This suggests that while it can be synthesized or modeled, it may face challenges regarding long-term phase stability under standard conditions.

At a glance

Key Properties

Cross-validated computational properties for Hg1Mg2Sn1, aggregated across 2 databases.

Band Gap

0.40 eV
Range across DFT structures

Energy Above Hull

1.157 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

27
2 databases, 17 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for Hg1Mg2Sn1, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic0.401.1565-0.9000.56
Imm2 (No. 44)
Cmmm (No. 65)
P2/m (No. 10)
Immm (No. 71)
C2/m (No. 12)
P4/mmm (No. 123)
Cm (No. 8)
Pmm2 (No. 25)
Cmmm (No. 65)
F-43m (No. 216)
R-3m (No. 166)
Uses

Applications

Where Hg1Mg2Sn1 is used.

Solid-state physics researchSemiconductor material studiesCrystallographic modeling
Reference

Frequently Asked Questions

Common questions about Hg1Mg2Sn1, answered from cross-validated data.

What is Hg1Mg2Sn1?

Hg1Mg2Sn1 is a semiconducting ternary intermetallic compound composed of mercury, magnesium, and tin that is primarily studied for its structural complexity.

More questions
What is Hg1Mg2Sn1 used for?
Hg1Mg2Sn1 is used in solid-state physics research, semiconductor material studies, and crystallographic modeling.
What is the band gap of Hg1Mg2Sn1?
Hg1Mg2Sn1 has a DFT-computed band gap of 0.40 eV across 27 reported structures.
Is Hg1Mg2Sn1 a metal, semiconductor, or insulator?
With a band gap up to 0.40 eV it is a semiconductor.
Is Hg1Mg2Sn1 thermodynamically stable?
Hg1Mg2Sn1 has a lowest energy above hull of 1.157 eV/atom (above hull).
What is the crystal structure of Hg1Mg2Sn1?
The lowest-energy reported polymorph of Hg1Mg2Sn1 is orthorhombic symmetry, space group Immm (No. 71).
What is the density of Hg1Mg2Sn1?
The computed density of the ground-state structure of Hg1Mg2Sn1 is 0.56 g/cm³.
How many polymorphs of Hg1Mg2Sn1 are known?
27 structures of Hg1Mg2Sn1 are reported across 2 databases, spanning 17 distinct space groups.
What elements does Hg1Mg2Sn1 contain?
Hg1Mg2Sn1 contains Hg, Mg, and Sn (3 elements).
Where does the data for Hg1Mg2Sn1 come from?
Hg1Mg2Sn1 data is cross-referenced from materials_project, aflow.
Comparison

How It Compares

As a unique ternary intermetallic, Hg1Mg2Sn1 represents a distinct composition within the broader landscape of mercury-magnesium-tin systems. Without direct structural siblings in this specific class to compare against, it serves as a primary case study for understanding the interplay between heavy metal components and alkaline earth elements in semiconducting crystalline frameworks.

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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