Ca12O28Si8

Ca12O28Si8 is a stable, wide-band-gap calcium silicate insulator with potential utility in advanced materials science.

CaOSi
Crystal structure of Ca12O28Si8
Ground-state structure · Materials Project
Overview

About Ca12O28Si8

Ca12O28Si8 is a complex calcium silicate compound characterized by its wide-band-gap insulating electronic nature. As a material that resides near the thermodynamic hull, it is considered a promising candidate for experimental synthesis and structural characterization.

Its unique atomic arrangement positions it as a significant subject for researchers investigating stable, non-conductive oxide frameworks. The compound's stability profile suggests it could serve as a foundational building block in specialized ceramic or dielectric material development.

At a glance

Key Properties

Cross-validated computational properties for Ca12O28Si8, aggregated across 3 databases.

Band Gap

4.43–4.66 eV
Range across DFT structures

Energy Above Hull

0.002 eV/atom
Best (lowest) across sources

Stability

Near hull (likely stable)
1 DFT source

Structures

5
3 databases, 3 space groups
Uses

Applications

Where Ca12O28Si8 is used.

Dielectric material researchCeramic precursor studiesInsulating oxide framework development
Reference

Frequently Asked Questions

Common questions about Ca12O28Si8, answered from cross-validated data.

What is Ca12O28Si8?

Ca12O28Si8 is a stable, wide-band-gap calcium silicate insulator with potential utility in advanced materials science.

More questions
What is Ca12O28Si8 used for?
Ca12O28Si8 is used in dielectric material research, ceramic precursor studies, and insulating oxide framework development.
What is the band gap of Ca12O28Si8?
Ca12O28Si8 has a DFT-computed band gap of 4.43–4.66 eV across 5 reported structures.
Is Ca12O28Si8 a metal, semiconductor, or insulator?
With a wide band gap up to 4.66 eV it is an insulator / wide-band-gap material.
Is Ca12O28Si8 thermodynamically stable?
Ca12O28Si8 has a lowest energy above hull of 0.002 eV/atom (near hull (likely stable)).
How many polymorphs of Ca12O28Si8 are known?
5 structures of Ca12O28Si8 are reported across 3 databases, spanning 3 distinct space groups.
What elements does Ca12O28Si8 contain?
Ca12O28Si8 contains Ca, O, and Si (3 elements).
Where does the data for Ca12O28Si8 come from?
Ca12O28Si8 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a distinct calcium silicate, Ca12O28Si8 represents a specialized structural configuration within the broader family of calcium-based oxides. It serves as a critical reference point for understanding how specific stoichiometric ratios influence the stability of complex insulating silicate frameworks.

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

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