Structure
Basic information
| Pretty formula | Li3H6Ir |
| Full formula | Li12H24Ir4 |
| Tags | Lithium iridium deuteride (3/1/6) |
| Constituent elements | H; Ir; Li; |
| Number of elements | 3 |
| Number of sites | 40 |
| Volume | 345.81602 Å3 |
| Density | 4.20806 g/cm3 |
| Source | Materials Project |
Space group
| Spacegroup Number | 62 |
| Hermann Mauguin | Pnma |
| Hall | -P 2ac 2n |
| Crystal System | Orthorhombic |
Calculated Energies
| Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
|---|---|---|---|---|---|
| -157.82860 eV | -3.94572 eV | -0.54256 eV | 3.04950 eV | 0.00000 eV | 0.00000 eV |