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-600233 | simmate / provider | Co4 H56 C12 N4 Cl12 O8 | 62 | 1.714 |
| mp-1197423 | simmate / provider | Ta4 Si8 H144 C48 N16 Cl4 | 14 | 1.356 |
| mp-605173 | simmate / provider | As12 H36 Rh4 C12 Br12 O12 | 14 | 3.187 |
| mp-1200075 | simmate / provider | H26 Pt2 C6 N6 Cl4 O2 | 2 | 2.349 |
| mp-1214013 | simmate / provider | Cr4 H24 C4 N12 Cl4 O12 | 62 | 1.738 |
| mp-1195389 | simmate / provider | P8 H64 Pb4 C24 N8 O24 | 92 | 1.988 |
| mp-707824 | simmate / provider | Gd2 H36 C6 S6 O36 F18 | 176 | 2.020 |
| mp-1235524 | simmate / provider | K2 Ba1 Li1 Co1 N6 O12 | 1 | 2.706 |
| mp-1100964 | simmate / provider | U2 P2 H20 C8 N4 O16 | 2 | 2.272 |
| mp-720230 | simmate / provider | Ba8 Na6 Nd6 P12 O48 F4 | 1 | 4.494 |
| mp-1224735 | simmate / provider | K12 Ag4 As8 C1 Se20 O1 | 1 | 3.655 |
| mp-1238663 | simmate / provider | Mn4 H48 C8 N4 Cl12 O8 | 64 | 1.087 |
