YbMgNiH4 is an experimental metal hydride compound combining ytterbium, magnesium, nickel, and hydrogen. This material belongs to the ternary hydride family, which is primarily of research interest for hydrogen storage applications and fundamental studies of metal-hydrogen interactions. Though not yet commercialized, compounds in this family are investigated for energy storage systems and as model materials for understanding how hydride phases behave under pressure and thermal cycling.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 59.60 | GPa | DFT · OptB88vdW | ||
Poisson's Ratio(ν) | 0.2600 | - | DFT · OptB88vdW | ||
Shear Modulus(G) | 34.26 | GPa | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 6.038 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 1.960 | eV | DFT · OptB88vdW | ||
| ↳ | 2.282 | eV | DFT · TBmBJ | ||
Dielectric Constant (Relative Permittivity)(εr) | 45.95 | - | DFT · OptB88vdW | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.717 | - | DFT · OptB88vdW | ||
| ↳ | 6.168 | - | DFT · TBmBJ | ||
Electron Effective Mass(m*e) | 1.140 | me | DFT · OptB88vdW · 27°C | ||
Hole Effective Mass(m*h) | 2.010 | me | DFT · OptB88vdW · 27°C | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Piezoelectric Modulus(eij) | 0.02506 | C/m² | DFT · OptB88vdW | ||
Thermoelectric Power Factor(PF)2 entries | 0.00190 | 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 | -324.9 | μV/K | DFT · OptB88vdW · n-type · 1e20 cm⁻³ · 327°C | ||
| ↳ | 374.9 | μV/K | DFT · OptB88vdW · p-type · 1e20 cm⁻³ · 327°C | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 16.97 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.01400 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -0.4960 | 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