O40P8Ti8Tl8
O40P8Ti8Tl8 is a stable, semiconducting transition-metal phosphate compound characterized by its complex crystalline framework.
About O40P8Ti8Tl8
O40P8Ti8Tl8 is a complex transition-metal phosphate that exists as a thermodynamically stable phase on the convex hull. Its semiconducting electronic character makes it an intriguing subject for fundamental studies in solid-state chemistry and materials design.
As part of the broader family of phosphate-based frameworks, this compound leverages the structural versatility of the phosphate anion combined with titanium and thallium. Its stability suggests potential for robust performance in specialized electronic or electrochemical environments.
Key Properties
Cross-validated computational properties for O40P8Ti8Tl8, aggregated across 3 databases.
Band GapEnergy needed to move an electron from the valence band to the conduction band. Lower or zero values tend to behave more metallic; larger gaps are more insulating or semiconducting.
Energy Above HullThermodynamic distance from the most stable set of competing phases. 0 eV/atom is on the convex hull; small positive values may still be experimentally accessible.
StabilityA plain-language summary of the best reported energy-above-hull result. It reflects whether the lowest-energy structure is on, near, or far from the stability hull.
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
Applications
Where O40P8Ti8Tl8 is used.
Frequently Asked Questions
Common questions about O40P8Ti8Tl8, answered from cross-validated data.
What is O40P8Ti8Tl8?
O40P8Ti8Tl8 is a stable, semiconducting transition-metal phosphate compound characterized by its complex crystalline framework.
What is O40P8Ti8Tl8 used for?
What is the band gap of O40P8Ti8Tl8?
Is O40P8Ti8Tl8 a metal, semiconductor, or insulator?
Is O40P8Ti8Tl8 thermodynamically stable?
How many polymorphs of O40P8Ti8Tl8 are known?
What elements does O40P8Ti8Tl8 contain?
Where does the data for O40P8Ti8Tl8 come from?
How It Compares
Within the transition-metal phosphates class.
Unlike the widely utilized lithium-ion battery cathode materials such as LiFePO4 or LiMnPO4, which are optimized for ion mobility and redox activity, O40P8Ti8Tl8 represents a more structurally rigid and complex arrangement within the transition-metal phosphate class, sharing more architectural commonalities with the pyrophosphate family like TiP2O7.
Related Compounds
Other Transition-Metal Phosphates in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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