Cs4O28P8Ti4
Cs4O28P8Ti4 is a metastable, semiconducting transition-metal phosphate characterized by a complex arrangement of titanium, phosphorus, and oxygen atoms.
About Cs4O28P8Ti4
Cs4O28P8Ti4 is a complex transition-metal phosphate featuring a framework of titanium, phosphorus, and oxygen, stabilized by cesium cations. As a semiconducting material, it represents a specialized niche within the broader family of phosphate-based compounds, offering unique electronic properties derived from its intricate crystal structure.
This material is classified as metastable, indicating that its formation and persistence are highly dependent on specific synthesis conditions. Its structural complexity makes it an intriguing subject for fundamental research into how cation size and coordination environments influence the stability and electronic behavior of transition-metal phosphates.
Key Properties
Cross-validated computational properties for Cs4O28P8Ti4, 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 Cs4O28P8Ti4 is used.
Frequently Asked Questions
Common questions about Cs4O28P8Ti4, answered from cross-validated data.
What is Cs4O28P8Ti4?
Cs4O28P8Ti4 is a metastable, semiconducting transition-metal phosphate characterized by a complex arrangement of titanium, phosphorus, and oxygen atoms.
What is Cs4O28P8Ti4 used for?
What is the band gap of Cs4O28P8Ti4?
Is Cs4O28P8Ti4 a metal, semiconductor, or insulator?
Is Cs4O28P8Ti4 thermodynamically stable?
How many polymorphs of Cs4O28P8Ti4 are known?
What elements does Cs4O28P8Ti4 contain?
Where does the data for Cs4O28P8Ti4 come from?
How It Compares
Within the transition-metal phosphates class.
Unlike the well-characterized olivine-structured battery materials such as LiFePO4, LiMnPO4, and LiCoPO4, which are primarily valued for their electrochemical performance, Cs4O28P8Ti4 occupies a more specialized structural space. While compounds like TiP2O7 are frequently studied for their catalytic or ionic conductivity properties, this cesium-containing variant highlights the diversity of titanium-phosphate architectures that can be achieved through varying the alkali metal framework.
Related Compounds
Other Transition-Metal Phosphates in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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