H12K24O48P12
H12K24O48P12 is a stable, insulating phosphate compound known for its structural diversity and potential applications in materials science.
About H12K24O48P12
H12K24O48P12 is a complex phosphate-based inorganic compound characterized by its wide-band-gap insulating electronic profile. Its position on the thermodynamic convex hull indicates high stability, making it a robust candidate for structural and chemical investigations within its class.
This material is recognized for its structural diversity, with multiple reported configurations documented across major databases. Its insulating nature and stable atomic arrangement suggest potential utility in specialized dielectric applications or as a precursor in advanced materials synthesis.
Key Properties
Cross-validated computational properties for H12K24O48P12, aggregated across 4 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.
Reported Structures
Lowest-energy structures reported for H12K24O48P12, ranked by energy above hull.
| Space GroupSymmetry classification of the crystal arrangement. The number is the international space-group index. | Crystal SystemBroad lattice family, such as cubic, tetragonal, monoclinic, or triclinic, derived from unit-cell symmetry. | Band Gap (eV)Electronic gap calculated for this specific reported structure, measured in electronvolts. | E above hull (eV/atom)Thermodynamic distance from the convex hull for this structure, normalized per atom. Lower is generally more stable. | E/atom (eV)Computed total energy normalized per atom. Use energy above hull, not this value alone, when comparing stability. | Density (g/cm³)Mass per relaxed crystal volume, reported in grams per cubic centimeter. |
|---|---|---|---|---|---|
| Pna21 (No. 33) | orthorhombic | 4.67 | 0.0000 | -6.249 | 2.40 |
| Pna21 (No. 33) | — | — | — | — | — |
| No. 0 | unknown | — | — | — | 0.63 |
| — | — | — | — | — | 2.39 |
Applications
Where H12K24O48P12 is used.
Frequently Asked Questions
Common questions about H12K24O48P12, answered from cross-validated data.
What is H12K24O48P12?
H12K24O48P12 is a stable, insulating phosphate compound known for its structural diversity and potential applications in materials science.
What is H12K24O48P12 used for?
What is the band gap of H12K24O48P12?
Is H12K24O48P12 a metal, semiconductor, or insulator?
Is H12K24O48P12 thermodynamically stable?
What is the crystal structure of H12K24O48P12?
What is the density of H12K24O48P12?
How many polymorphs of H12K24O48P12 are known?
What elements does H12K24O48P12 contain?
Where does the data for H12K24O48P12 come from?
How It Compares
As a stable, wide-band-gap insulator, H12K24O48P12 serves as a foundational example of how complex phosphate frameworks can achieve thermodynamic stability. It represents a distinct structural archetype within its class, providing a benchmark for the electronic and physical properties expected of highly ordered, insulating crystalline phosphates.
Data sources & attribution
- materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
- aflow — Data from AFLOW. Cite: Curtarolo et al., Comp. Mater. Sci. 58, 218 (2012).
- cod — Data from the Crystallography Open Database. Cite: Grazulis et al., Nucleic Acids Res. 40, D420 (2012).
- omat24 — Data from OMat24 (Meta FAIR). Cite: Barroso-Luque et al., arXiv 2410.12771 (2024).
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