Structure
Basic information
| Pretty formula | Ba(BO2)2 |
| Full formula | Ba6B12O24 |
| Tags | Barium diborate - alpha; Barium diborate - beta; Tribarium bis(cyclo-triborate) |
| Constituent elements | B; Ba; O; |
| Number of elements | 3 |
| Number of sites | 42 |
| Volume | 606.94010 Å3 |
| Density | 3.65978 g/cm3 |
| Source | Materials Project |
Space group
| Spacegroup Number | 161 |
| Hermann Mauguin | R3c |
| Hall | R 3 -2"c |
| Crystal System | Hexagonal |
Calculated Energies
| Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
|---|---|---|---|---|---|
| -323.91494 eV | -7.71226 eV | -3.10986 eV | 4.78520 eV | 0.00000 eV | 0.00109 eV |