O18Si18Th18

O18Si18Th18 is a semiconducting thorium silicate compound characterized by its metastable structural nature.

OSiTh
Overview

About O18Si18Th18

O18Si18Th18 is a complex inorganic compound composed of oxygen, silicon, and thorium. As a semiconducting material, it represents a specialized arrangement of these elements that has been identified in a limited number of structural configurations within computational databases. Its electronic properties suggest potential interest for researchers investigating the intersection of actinide chemistry and silicate frameworks. Given its position relative to the thermodynamic hull, it is considered a metastable phase that requires specific conditions for formation or stabilization. This compound serves as a subject of study for understanding the structural diversity of thorium-bearing silicates and their theoretical electronic behaviors in advanced material systems.

At a glance

Key Properties

Cross-validated computational properties for O18Si18Th18, aggregated across 3 databases.

Band Gap

0.63 eV
Range across DFT structures

Energy Above Hull

0.963 eV/atom
Best (lowest) across sources

Stability

Above hull
1 DFT source

Structures

4
3 databases, 2 space groups
Reference

Frequently Asked Questions

Common questions about O18Si18Th18, answered from cross-validated data.

What is O18Si18Th18?

O18Si18Th18 is a semiconducting thorium silicate compound characterized by its metastable structural nature.

More questions
What is the band gap of O18Si18Th18?
O18Si18Th18 has a DFT-computed band gap of 0.63 eV across 4 reported structures.
Is O18Si18Th18 a metal, semiconductor, or insulator?
With a band gap up to 0.63 eV it is a semiconductor.
Is O18Si18Th18 thermodynamically stable?
O18Si18Th18 has a lowest energy above hull of 0.963 eV/atom (above hull).
How many polymorphs of O18Si18Th18 are known?
4 structures of O18Si18Th18 are reported across 3 databases, spanning 2 distinct space groups.
What elements does O18Si18Th18 contain?
O18Si18Th18 contains O, Si, and Th (3 elements).
Where does the data for O18Si18Th18 come from?
O18Si18Th18 data is cross-referenced from latticegraph.
Comparison

How It Compares

As a unique thorium-silicate arrangement, this compound occupies a niche position in materials informatics. Unlike more common, naturally occurring silicate minerals, this phase is characterized by its synthetic or theoretical nature and its status as a metastable structure, providing a distinct data point for exploring the limits of thorium-based chemical bonding.

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

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