BiIn2Na

BiIn2Na is a semiconducting intermetallic compound containing bismuth, indium, and sodium that is currently recognized as a metastable phase.

BiInNa
Crystal structure of BiIn2Na (orthorhombic, Immm (No. 71))
Ground-state structure · Materials Project
Overview

About BiIn2Na

BiIn2Na is a complex intermetallic compound composed of bismuth, indium, and sodium. As a semiconducting material, it represents a specialized electronic configuration that distinguishes it from typical metallic alloys, making it a subject of interest for fundamental solid-state research.

Despite its existence in multiple structural databases, the compound is characterized by its position above the thermodynamic hull. This suggests it may be metastable or difficult to synthesize under standard conditions, highlighting the importance of precise processing techniques in stabilizing such phases.

At a glance

Key Properties

Cross-validated computational properties for BiIn2Na, aggregated across 3 databases.

Band Gap

1.24 eV
Range across DFT structures

Energy Above Hull

0.864 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

5
3 databases, 1 space group
Crystallography

Reported Structures

Lowest-energy structures reported for BiIn2Na, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
Immm (No. 71)orthorhombic1.240.8640-1.9650.60
6.86
5.64
Reference

Frequently Asked Questions

Common questions about BiIn2Na, answered from cross-validated data.

What is BiIn2Na?

BiIn2Na is a semiconducting intermetallic compound containing bismuth, indium, and sodium that is currently recognized as a metastable phase.

More questions
What is the band gap of BiIn2Na?
BiIn2Na has a DFT-computed band gap of 1.24 eV across 5 reported structures.
Is BiIn2Na a metal, semiconductor, or insulator?
With a band gap up to 1.24 eV it is a semiconductor.
Is BiIn2Na thermodynamically stable?
BiIn2Na has a lowest energy above hull of 0.864 eV/atom (above hull).
What is the crystal structure of BiIn2Na?
The lowest-energy reported polymorph of BiIn2Na is orthorhombic symmetry, space group Immm (No. 71).
What is the density of BiIn2Na?
The computed density of the ground-state structure of BiIn2Na is 0.60 g/cm³.
How many polymorphs of BiIn2Na are known?
5 structures of BiIn2Na are reported across 3 databases, spanning 1 distinct space group.
What elements does BiIn2Na contain?
BiIn2Na contains Bi, In, and Na (3 elements).
Where does the data for BiIn2Na come from?
BiIn2Na data is cross-referenced from materials_project, omat24, alexandria.
Comparison

How It Compares

As a unique ternary phase, BiIn2Na occupies a niche position in materials science where its semiconducting nature sets it apart from more common metallic conductors found in similar chemical spaces.

Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
  • alexandria — Data from alexandria.

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