Ba4Ca4Sn4

Ba4Ca4Sn4 is a stable, semiconducting ternary intermetallic compound composed of barium, calcium, and tin.

BaCaSn
Crystal structure of Ba4Ca4Sn4
Ground-state structure · Materials Project
Overview

About Ba4Ca4Sn4

Ba4Ca4Sn4 is a complex intermetallic compound composed of barium, calcium, and tin. As a thermodynamically stable phase located on the convex hull, it represents a robust structural arrangement of these elements that maintains integrity under standard conditions.

This material exhibits semiconducting electronic character, making it an interesting candidate for electronic and optoelectronic research. Its existence across multiple structural databases highlights its significance as a well-defined phase in the ternary system.

At a glance

Key Properties

Cross-validated computational properties for Ba4Ca4Sn4, aggregated across 3 databases.

Band Gap

0.24 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

3
3 databases, 1 space group
Uses

Applications

Where Ba4Ca4Sn4 is used.

Semiconductor researchMaterials science explorationSolid-state chemistry
Reference

Frequently Asked Questions

Common questions about Ba4Ca4Sn4, answered from cross-validated data.

What is Ba4Ca4Sn4?

Ba4Ca4Sn4 is a stable, semiconducting ternary intermetallic compound composed of barium, calcium, and tin.

More questions
What is Ba4Ca4Sn4 used for?
Ba4Ca4Sn4 is used in semiconductor research, materials science exploration, and solid-state chemistry.
What is the band gap of Ba4Ca4Sn4?
Ba4Ca4Sn4 has a DFT-computed band gap of 0.24 eV across 3 reported structures.
Is Ba4Ca4Sn4 a metal, semiconductor, or insulator?
With a band gap up to 0.24 eV it is a semiconductor.
Is Ba4Ca4Sn4 thermodynamically stable?
Yes — Ba4Ca4Sn4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Ba4Ca4Sn4 are known?
3 structures of Ba4Ca4Sn4 are reported across 3 databases, spanning 1 distinct space group.
What elements does Ba4Ca4Sn4 contain?
Ba4Ca4Sn4 contains Ba, Ca, and Sn (3 elements).
Where does the data for Ba4Ca4Sn4 come from?
Ba4Ca4Sn4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique ternary intermetallic, Ba4Ca4Sn4 serves as a foundational example of stable phase formation within the barium-calcium-tin system, providing a benchmark for understanding how alkaline earth metals and tin interact to produce semiconducting behavior.

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

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