MoBr3 is a molybdenum tribromide compound belonging to the metal halide family, characterized as a layered crystalline material with weak interlayer bonding. This is primarily a research material being investigated for two-dimensional (2D) material applications and electronic device components, rather than an established engineering material in widespread industrial use. The material's notable feature is its layered structure that can be exfoliated into thin sheets, making it of interest for nanoelectronics, heterostructure fabrication, and emerging quantum device research where tunable electronic properties are sought.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Exfoliation Energy(Eexf) | 95.03 | meV/atom | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 4.977 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.5580 | eV | DFT · OptB88vdW | ||
Dielectric Constant (Relative Permittivity)(εr)2 entries | 19.74 | - | DFT · OptB88vdW | ||
| ↳ | 5.230 | - | DFT · PBE | ||
Electronic Dielectric Tensor(ε∞) | Matrix (redacted) | - | DFT · PBE | ||
Total Dielectric Tensor(ε) | Matrix (redacted) | - | DFT · PBE | ||
Electron Effective Mass(m*e) | 2.490 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 1.317 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 4.199 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.000 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.000682 | W/(m·K²) | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 0.00118 | W/(m·K²) | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Seebeck Coefficient(S)2 entries | -383.8 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 312.6 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.00400 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf)2 entries | -0.5615 | eV/atom | DFT · OptB88vdW | ||
| ↳ | -0.7350 | eV/atom | Measured |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data