Structure
Basic information
Pretty formula | Na3CuB8H17O23 |
Full formula | Na6Cu2B16H34O46 |
Tags | Hexasodium decahydroxo-24-oxo-16-boratodicuprate |
Constituent elements | B; Cu; H; Na; O; |
Number of elements | 5 |
Number of sites | 104 |
Volume | 963.00572 Å3 |
Density | 2.08342 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 |
---|---|---|---|---|---|
-637.70202 eV | -6.13175 eV | -2.01818 eV | 0.61480 eV | 0.00000 eV | 0.02007 eV |