CaSnF4

CaSnF4 is a metastable, insulating fluoride compound composed of calcium, tin, and fluorine.

CaFSn
Crystal structure of CaSnF4
Ground-state structure · Materials Project
Overview

About CaSnF4

CaSnF4 is a complex fluoride compound characterized by its insulating electronic nature and wide band gap. As a metastable material, it represents a unique structural arrangement of calcium, tin, and fluorine atoms that requires specific conditions for synthesis and stabilization.

This compound is primarily of interest in fundamental materials science, where its structural diversity—evidenced by multiple reported configurations—makes it a subject of study for understanding fluoride-based lattice dynamics. Its role is largely defined by its potential as a specialized inorganic solid.

At a glance

Key Properties

Cross-validated computational properties for CaSnF4, aggregated across 3 databases.

Band Gap

3.50 eV
Range across DFT structures

Energy Above Hull

0.046 eV/atom
Best (lowest) across sources

Stability

Metastable
2 DFT sources

Structures

5
3 databases, 1 space group
Uses

Applications

Where CaSnF4 is used.

Fundamental materials science researchSolid-state chemistry studies
Reference

Frequently Asked Questions

Common questions about CaSnF4, answered from cross-validated data.

What is CaSnF4?

CaSnF4 is a metastable, insulating fluoride compound composed of calcium, tin, and fluorine.

More questions
What is CaSnF4 used for?
CaSnF4 is used in fundamental materials science research and solid-state chemistry studies.
What is the band gap of CaSnF4?
CaSnF4 has a DFT-computed band gap of 3.50 eV across 5 reported structures.
Is CaSnF4 a metal, semiconductor, or insulator?
With a wide band gap up to 3.50 eV it is an insulator / wide-band-gap material.
Is CaSnF4 thermodynamically stable?
CaSnF4 has a lowest energy above hull of 0.046 eV/atom (metastable).
How many polymorphs of CaSnF4 are known?
5 structures of CaSnF4 are reported across 3 databases, spanning 1 distinct space group.
What elements does CaSnF4 contain?
CaSnF4 contains Ca, F, and Sn (3 elements).
Where does the data for CaSnF4 come from?
CaSnF4 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct fluoride compound, CaSnF4 occupies a niche position in materials research. Without direct structural siblings in this specific grouping, it stands as a unique example of how tin and calcium can integrate into a fluoride framework to create a metastable, wide-gap insulating system.

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

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