ZrNiO2S is a mixed-metal ceramic compound combining zirconium, nickel, oxygen, and sulfur, representing an emerging functional ceramic in the oxysulfide family. This material is primarily of research and development interest for energy storage and catalytic applications, where the combination of transition metal (Ni) and refractory metal (Zr) phases offers potential advantages in electrochemical performance or reaction selectivity compared to single-phase oxides or conventional sulfides. Development of such oxysulfide compositions aims to leverage synergistic effects between oxide and sulfide bonding for enhanced ionic conductivity, electron transport, or surface activity in next-generation battery systems and heterogeneous catalysis.
Compliance & Regulations
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 0.000 | eV | DFT · GLLB-SC | ||
Magnetic Moment(μB) | 0.02384 | μB | DFT |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Formation Energy(ΔHf) | 1.040 | eV/atom | DFT |
Reference data from cited sources. Not verified or certified by MatWorld Inc. Verify against the source before use in design. Terms: engineering data