The Materials Project at Berkeley National Labs
Source Website Cite API JSON Python-clientFilter mix-ins: ['Structure', 'Thermodynamics']
Extra filters: ['energy_uncorrected__range', 'band_gap__range', 'is_gap_direct', 'is_magnetic', 'total_magnetization__range', 'is_theoretical']
| ID | Dashboards | Full Formula | Spacegroup | Density |
|---|---|---|---|---|
| mp-1190433 | simmate / provider | Co4 H20 C4 N4 Cl8 O8 | 15 | 2.106 |
| mp-1214820 | simmate / provider | Ca6 Si2 H28 C2 S2 O20 | 173 | 1.673 |
| mp-555080 | simmate / provider | P4 H28 C4 N12 O12 F4 | 14 | 1.640 |
| mp-1196087 | simmate / provider | Li1 H12 Au1 C4 S4 O12 | 82 | 2.125 |
| mp-735514 | simmate / provider | Mn2 H36 C8 N16 Cl8 O8 | 14 | 1.733 |
| mp-1178630 | simmate / provider | Zr6 B1 H42 C12 I13 O12 | 148 | 2.979 |
| mp-1234197 | simmate / provider | Mg1 Zn3 Cu2 H14 S2 O18 | 1 | 2.846 |
| mp-693340 | simmate / provider | Al4 Zn4 P8 H13 N3 O32 | 1 | 2.470 |
| mp-1210852 | simmate / provider | Na2 Ni1 H20 C12 N12 O18 | 2 | 1.767 |
| mp-707774 | simmate / provider | Mg12 B8 H36 S4 O52 F4 | 62 | 2.099 |
| mp-1210735 | simmate / provider | Mg1 H8 C6 S2 N2 O8 | 2 | 1.811 |
| mp-1210571 | simmate / provider | Na4 Cd6 P8 N2 Cl2 O28 | 15 | 3.536 |