Structure
Basic information
| Pretty formula | Ba2Fe3P6HO22 |
| Full formula | Ba2Fe3P6H1O22 |
| Tags | Dibarium triiron(III) hydrogen bis(phosphate) bis(diphosphate) |
| Constituent elements | Ba; Fe; H; O; P; |
| Number of elements | 5 |
| Number of sites | 34 |
| Volume | 449.10391 Å3 |
| Density | 3.62730 g/cm3 |
| Source | Materials Project |
Space group
| Spacegroup Number | 2 |
| Hermann Mauguin | P-1 |
| Hall | -P 1 |
| Crystal System | Triclinic |
Calculated Energies
| Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
|---|---|---|---|---|---|
| -241.42733 eV | -7.10080 eV | -2.69375 eV | 2.53830 eV | 15.00001 eV | 0.00000 eV |