Na2LiBiCl6 is a halide double perovskite ceramic compound combining sodium, lithium, and bismuth chlorides, representing an emerging class of lead-free inorganic materials. This compound is primarily of research interest as a potential scintillator, radiation detector, or photovoltaic absorber material, with development focused on replacing toxic lead-based perovskites in optoelectronic and radiation-sensing applications. The bismuth-based halide perovskite family offers promise for gamma-ray detection, X-ray imaging, and next-generation photovoltaic devices, though Na2LiBiCl6 remains in the experimental stage with ongoing investigation of its structural stability and performance optimization.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 2.867 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 3.460 | eV | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 3.710 | - | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.1493 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.416 | eV/atom | DFT · OptB88vdW |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data