NaBi3Cl2O4 is a bismuth-containing chloride oxide ceramic compound, a mixed-valent sodium bismuth chloride belonging to the broader family of halide perovskites and bismuth-based ceramics. This is primarily a research material studied for its structural and electronic properties rather than an established industrial ceramic. The compound is of interest in materials science for potential applications in photovoltaic devices, scintillators, and solid-state chemistry exploration, where bismuth halides are being investigated as lead-free alternatives to traditional perovskites and as functional ceramics with unique optical or radiation-detection capabilities.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 6.967 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 2.378 | eV | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞) | 5.525 | - | DFT · OptB88vdW | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -1.510 | 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