Structure
Basic information
Pretty formula | H2Ru6C18SO20 |
Full formula | H4Ru12C36S2O40 |
Tags | mu 4 sulfur di mu hydroxo di mu carbonyl 16 carbonyl hexaruthenium |
Constituent elements | C; H; O; Ru; S; |
Number of elements | 5 |
Number of sites | 94 |
Volume | 1,529.85376 Å3 |
Density | 2.55440 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 |
---|---|---|---|---|---|
-728.33626 eV | -7.74826 eV | -1.00503 eV | 1.19520 eV | 0.00169 eV | 0.20005 eV |