Cu4Se6Sn2
Cu4Se6Sn2 has a DFT band gap of 0.02–0.09 eV across 13 reported structures in 4 space groups. Cross-validated across 4 computational databases.
At a glance
Key Properties
Cross-validated computational properties for Cu4Se6Sn2, 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.
0.02–0.09 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.
0.013 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.
Near hull (likely stable)
2 DFT sources
StructuresCount of reported calculated crystal structures for this formula, including alternate polymorphs, source databases, and observed space groups.
13
4 databases, 4 space groups
Reference
Frequently Asked Questions
Common questions about Cu4Se6Sn2, answered from cross-validated data.
What is the band gap of Cu4Se6Sn2?
Cu4Se6Sn2 has a DFT-computed band gap of 0.02–0.09 eV across 13 reported structures.
More questions
Is Cu4Se6Sn2 a metal, semiconductor, or insulator?
With a near-zero band gap it behaves as a (semi)metal.
Is Cu4Se6Sn2 thermodynamically stable?
Cu4Se6Sn2 has a lowest energy above hull of 0.013 eV/atom (near hull (likely stable)).
How many polymorphs of Cu4Se6Sn2 are known?
13 structures of Cu4Se6Sn2 are reported across 4 databases, spanning 4 distinct space groups.
What elements does Cu4Se6Sn2 contain?
Cu4Se6Sn2 contains Cu, Se, and Sn (3 elements).
Where does the data for Cu4Se6Sn2 come from?
Cu4Se6Sn2 data is cross-referenced from latticegraph.
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Related Compounds
Other Chalcogenide Photovoltaic Absorbers in the database.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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