Ca2SnS4

Ca2SnS4 is a thermodynamically stable semiconducting sulfide material used in solid-state research.

CaSSn
Crystal structure of Ca2SnS4
Ground-state structure · Materials Project
Overview

About Ca2SnS4

Ca2SnS4 is a ternary sulfide compound that exhibits semiconducting electronic behavior. As a thermodynamically stable phase located on the convex hull, it represents a robust crystalline material of interest for fundamental solid-state chemistry studies.

With a high degree of structural data available across multiple databases, this compound serves as a significant reference point for researchers investigating complex chalcogenide systems. Its stable configuration makes it a compelling candidate for further exploration in optoelectronic and energy-related applications.

At a glance

Key Properties

Cross-validated computational properties for Ca2SnS4, aggregated across 3 databases.

Band Gap

0.86–2.44 eV
Range across DFT structures

Energy Above Hull

0.000 eV/atom
Best (lowest) across sources

Stability

On hull (stable)
2 DFT sources

Structures

81
3 databases, 16 space groups
Uses

Applications

Where Ca2SnS4 is used.

Semiconductor researchSolid-state chemistryOptoelectronic material development
Reference

Frequently Asked Questions

Common questions about Ca2SnS4, answered from cross-validated data.

What is Ca2SnS4?

Ca2SnS4 is a thermodynamically stable semiconducting sulfide material used in solid-state research.

More questions
What is Ca2SnS4 used for?
Ca2SnS4 is used in semiconductor research, solid-state chemistry, and optoelectronic material development.
What is the band gap of Ca2SnS4?
Ca2SnS4 has a DFT-computed band gap of 0.86–2.44 eV across 81 reported structures.
Is Ca2SnS4 a metal, semiconductor, or insulator?
With a band gap up to 2.44 eV it is a semiconductor.
Is Ca2SnS4 thermodynamically stable?
Yes — Ca2SnS4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Ca2SnS4 are known?
81 structures of Ca2SnS4 are reported across 3 databases, spanning 16 distinct space groups.
What elements does Ca2SnS4 contain?
Ca2SnS4 contains Ca, S, and Sn (3 elements).
Where does the data for Ca2SnS4 come from?
Ca2SnS4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a member of the ternary sulfide family, Ca2SnS4 occupies a stable position within the chemical space of calcium-tin-sulfur compounds. It serves as a foundational example of how these elements combine to form ordered, semiconducting frameworks that are thermodynamically favored.

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

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