Structure
Basic information
Pretty formula | H2CS3 |
Full formula | H32C16S48 |
Tags | Trithiocarbonic acid - alpha |
Constituent elements | C; H; S; |
Number of elements | 3 |
Number of sites | 96 |
Volume | 1,928.36909 Å3 |
Density | 1.51861 g/cm3 |
Source | Materials Project |
Space group
Spacegroup Number | 14 |
Hermann Mauguin | P21/c |
Hall | -P 2ybc |
Crystal System | Monoclinic |
Calculated Energies
Total energy | Energy per atom | Formation energy per atom | Band gap | Total magnetization | Energy above hull |
---|---|---|---|---|---|
-444.48448 eV | -4.63005 eV | -0.28035 eV | 2.01810 eV | 0.00729 eV | 0.18637 eV |