Structure
Basic information
Pretty formula | Ba3(Mo9O14)2 |
Full formula | Ba6Mo36O56 |
Tags | |
Constituent elements | Ba; Mo; O; |
Number of elements | 3 |
Number of sites | 98 |
Volume | 1,498.34314 Å3 |
Density | 5.73383 g/cm3 |
Source | Materials Project |
Space group
Spacegroup Number | 4 |
Hermann Mauguin | P21 |
Hall | P 2yb |
Crystal System | Monoclinic |
Calculated Energies
Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
---|---|---|---|---|---|
-690.55231 eV | -7.04645 eV | -1.81636 eV | 0.79680 eV | 100.00000 eV | 0.23738 eV |