CaBiB
CaBiB is a semimetallic ternary compound of calcium, bismuth, and boron that exists in a metastable state.

About CaBiB
CaBiB is a ternary inorganic compound composed of calcium, bismuth, and boron. Its electronic character is defined as near-zero-gap, placing it in the semimetallic regime, which makes it an intriguing subject for fundamental studies in condensed matter physics.
Due to its position above the thermodynamic hull, this material is considered likely unstable under standard conditions. Despite this, it remains a notable subject of interest within structural databases, where multiple distinct configurations have been documented for further investigation.
Key Properties
Cross-validated computational properties for CaBiB, 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.
Frequently Asked Questions
Common questions about CaBiB, answered from cross-validated data.
What is CaBiB?
CaBiB is a semimetallic ternary compound of calcium, bismuth, and boron that exists in a metastable state.
What is the band gap of CaBiB?
Is CaBiB a metal, semiconductor, or insulator?
Is CaBiB thermodynamically stable?
How many polymorphs of CaBiB are known?
What elements does CaBiB contain?
Where does the data for CaBiB come from?
How It Compares
As a unique ternary phase, CaBiB occupies a specialized niche in materials science. Without direct structural siblings in its immediate class, it serves as a distinct case study for understanding the complex interplay between heavy elements like bismuth and lighter metalloids like boron in unstable crystalline frameworks.
Data sources & attribution
- latticegraph — Lattice Graph Materials Intelligence Platform
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