Al4P4
Al4P4 has a DFT band gap of 1.63–2.82 eV across 13 reported structures in 7 space groups. Cross-validated across 5 computational databases.
At a glance
Key Properties
Cross-validated computational properties for Al4P4, aggregated across 5 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.
1.63–2.82 eV
Range across DFT structures
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.
0.000 eV/atom
Best (lowest) across sources
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.
On hull (stable)
3 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
13
5 databases, 7 space groups
Synthesis
Synthesis Routes
Literature-extracted synthesis procedures targeting Al4P4.
Solid State
Procedure available · ceder_solid_state
Reference
Frequently Asked Questions
Common questions about Al4P4, answered from cross-validated data.
What is the band gap of Al4P4?
Al4P4 has a DFT-computed band gap of 1.63–2.82 eV across 13 reported structures.
More questions
Is Al4P4 a metal, semiconductor, or insulator?
With a band gap up to 2.82 eV it is a semiconductor.
Is Al4P4 thermodynamically stable?
Yes — Al4P4 sits on the convex hull (energy above hull 0 eV/atom), i.e. on hull (stable).
How many polymorphs of Al4P4 are known?
13 structures of Al4P4 are reported across 5 databases, spanning 7 distinct space groups.
How is Al4P4 synthesized?
Literature-reported routes for Al4P4 include solid state.
What elements does Al4P4 contain?
Al4P4 contains Al and P (2 elements).
Where does the data for Al4P4 come from?
Al4P4 data is cross-referenced from latticegraph.
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Related Compounds
Other III-V Semiconductors in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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