Nd2Ti2S2O5 is an advanced ceramic compound containing neodymium, titanium, sulfur, and oxygen elements, representing a mixed-valence oxysulfide material. This is a research-phase compound primarily of academic and exploratory interest rather than established commercial production, belonging to the family of rare-earth titanium compounds that show potential for functional ceramics applications. Materials in this chemical family are investigated for their unique electronic, optical, and catalytic properties, with potential relevance to advanced ceramics, photocatalysis, and solid-state chemistry applications where rare-earth dopants and mixed anion systems offer tailored functionality.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Density(ρ) | 5.033 | kg/m³ | DFT · OptB88vdW |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg)2 entries | 0.7620 | eV | DFT · OptB88vdW | ||
| ↳ | 0.9370 | eV | DFT · TBmBJ | ||
High-Frequency Dielectric Constant (ε∞)(ε∞)2 entries | 7.176 | - | DFT · OptB88vdW | ||
| ↳ | 6.716 | - | DFT · TBmBJ | ||
Magnetic Moment(μB) | 0.000 | µB | DFT · OptB88vdW | ||
Spectroscopic Limited Maximum Efficiency (SLME)(SLME) | 31.25 | % | DFT · TBmBJ |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Energy Above Hull(ΔEhull) | 0.000 | eV/atom | DFT · OptB88vdW | ||
Formation Energy(ΔHf) | -3.072 | 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