O4Cl12Mo4 is a molybdenum oxychloride compound classified as a semiconductor, likely a mixed-valence molybdenum oxide-chloride phase. This material represents a research-stage compound being investigated for electronic and catalytic applications, particularly within the broader family of transition metal halides and oxides that exhibit semiconducting behavior. The compound's notable feature is its layered or cluster-based structure combining both oxide and chloride ligands, which can create unique electronic properties and active surface sites compared to simple binary oxides or chlorides alone.
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| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Bulk Modulus(K) | 16.13 | GPa | — | ||
Shear Modulus(G) | 8.340 | GPa | — |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Band Gap(Eg) | 1.046 | eV | — |
| Property | Value | Unit | Conditions | Source | |
|---|---|---|---|---|---|
Formation Energy(ΔHf) | -1.217 | eV/atom | — |