BiRbS4Si
BiRbS4Si is a stable, semiconducting quaternary sulfide compound composed of bismuth, rubidium, sulfur, and silicon.
About BiRbS4Si
BiRbS4Si is a quaternary sulfide compound that exhibits semiconducting electronic behavior. As a material situated on the convex hull, it possesses thermodynamic stability, making it a significant candidate for structural and electronic characterization within complex chalcogenide systems.
This compound represents an interesting intersection of bismuth, rubidium, sulfur, and silicon chemistry. Its stable configuration suggests potential utility in specialized optoelectronic or solid-state applications where precise control over electronic properties is required.
Key Properties
Cross-validated computational properties for BiRbS4Si, 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.
Cross-Source DFT Agreement
How well independent DFT databases agree on the thermodynamics of BiRbS4Si. Tight agreement means computed properties can be trusted without re-running calculations.
Agreement ScoreA normalized confidence score summarizing how closely independent DFT databases agree. Higher scores mean tighter cross-source agreement.
Hull SpreadDifference between the highest and lowest energy-above-hull values reported by comparable sources. Smaller spread means less thermodynamic disagreement.
Sources ComparedNumber and names of computational sources with comparable entries for this formula.
Space Group ConsensusWhether independent sources predict the same crystal symmetry for the lowest-energy structure.
Applications
Where BiRbS4Si is used.
Frequently Asked Questions
Common questions about BiRbS4Si, answered from cross-validated data.
What is BiRbS4Si?
BiRbS4Si is a stable, semiconducting quaternary sulfide compound composed of bismuth, rubidium, sulfur, and silicon.
What is BiRbS4Si used for?
What is the band gap of BiRbS4Si?
Is BiRbS4Si a metal, semiconductor, or insulator?
Is BiRbS4Si thermodynamically stable?
How many polymorphs of BiRbS4Si are known?
What elements does BiRbS4Si contain?
Where does the data for BiRbS4Si come from?
How It Compares
As a unique quaternary sulfide, BiRbS4Si serves as a distinct entry point for exploring the chemical space of complex chalcogenides, offering a stable framework that contrasts with more volatile or metastable compositions in the broader class of quaternary sulfides.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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