Ca1Na2Sr1

Ca1Na2Sr1 is a semiconducting intermetallic compound containing calcium, sodium, and strontium that is considered thermodynamically metastable.

CaNaSr
Crystal structure of Ca1Na2Sr1
Ground-state structure · Materials Project
Overview

About Ca1Na2Sr1

Ca1Na2Sr1 is a semiconducting intermetallic compound composed of calcium, sodium, and strontium. Its electronic structure suggests potential utility in specialized electronic applications where specific semiconducting behaviors are required for device integration.

Despite its complex structural profile, the compound is characterized as being above the thermodynamic hull. This indicates that it is likely metastable, posing unique challenges for synthesis and long-term stability in practical material science research.

At a glance

Key Properties

Cross-validated computational properties for Ca1Na2Sr1, aggregated across 2 databases.

Band Gap

0.37 eV
Range across DFT structures

Energy Above Hull

0.955 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

26
2 databases, 15 space groups
Reference

Frequently Asked Questions

Common questions about Ca1Na2Sr1, answered from cross-validated data.

What is Ca1Na2Sr1?

Ca1Na2Sr1 is a semiconducting intermetallic compound containing calcium, sodium, and strontium that is considered thermodynamically metastable.

More questions
What is the band gap of Ca1Na2Sr1?
Ca1Na2Sr1 has a DFT-computed band gap of 0.37 eV across 26 reported structures.
Is Ca1Na2Sr1 a metal, semiconductor, or insulator?
With a band gap up to 0.37 eV it is a semiconductor.
Is Ca1Na2Sr1 thermodynamically stable?
Ca1Na2Sr1 has a lowest energy above hull of 0.955 eV/atom (above hull).
How many polymorphs of Ca1Na2Sr1 are known?
26 structures of Ca1Na2Sr1 are reported across 2 databases, spanning 15 distinct space groups.
What elements does Ca1Na2Sr1 contain?
Ca1Na2Sr1 contains Ca, Na, and Sr (3 elements).
Where does the data for Ca1Na2Sr1 come from?
Ca1Na2Sr1 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique intermetallic phase, Ca1Na2Sr1 represents a distinct composition within the alkaline earth and alkali metal alloy space. It serves as a focal point for studying how these specific elemental combinations influence semiconducting behavior in metastable systems.

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

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