BaNa2Sr

BaNa2Sr is a semiconducting intermetallic compound containing barium, sodium, and strontium that is currently of interest for its structural complexity.

BaNaSr
Crystal structure of BaNa2Sr
Ground-state structure · Materials Project
Overview

About BaNa2Sr

BaNa2Sr is a complex intermetallic compound composed of barium, sodium, and strontium. As a semiconducting material, it represents a specialized niche in inorganic chemistry where the arrangement of alkaline earth and alkali metals creates distinct electronic environments.

Because it exists above the thermodynamic hull, this compound is considered metastable or unstable under standard conditions. Its existence across multiple structural configurations in database records highlights its significance as a subject of ongoing theoretical and experimental investigation in materials science.

At a glance

Key Properties

Cross-validated computational properties for BaNa2Sr, aggregated across 3 databases.

Band Gap

0.25 eV
Range across DFT structures

Energy Above Hull

0.982 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

4
3 databases, 1 space group
Reference

Frequently Asked Questions

Common questions about BaNa2Sr, answered from cross-validated data.

What is BaNa2Sr?

BaNa2Sr is a semiconducting intermetallic compound containing barium, sodium, and strontium that is currently of interest for its structural complexity.

More questions
What is the band gap of BaNa2Sr?
BaNa2Sr has a DFT-computed band gap of 0.25 eV across 4 reported structures.
Is BaNa2Sr a metal, semiconductor, or insulator?
With a band gap up to 0.25 eV it is a semiconductor.
Is BaNa2Sr thermodynamically stable?
BaNa2Sr has a lowest energy above hull of 0.982 eV/atom (above hull).
How many polymorphs of BaNa2Sr are known?
4 structures of BaNa2Sr are reported across 3 databases, spanning 1 distinct space group.
What elements does BaNa2Sr contain?
BaNa2Sr contains Ba, Na, and Sr (3 elements).
Where does the data for BaNa2Sr come from?
BaNa2Sr data is cross-referenced from latticegraph.
Comparison

How It Compares

As an unclassified intermetallic phase, BaNa2Sr serves as an intriguing case study for the structural diversity of alkali-alkaline earth systems, demonstrating how complex atomic packing can emerge even in materials that are not thermodynamically favored at ground state.

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

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