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-605196 | simmate / provider | Cs2 Cu6 As16 H48 C16 I8 O16 | 2 | 3.030 |
| mp-1200379 | simmate / provider | K4 Ba2 Na4 Ti8 Mn1 Si16 O66 | 12 | 2.969 |
| mp-572601 | simmate / provider | Sb4 P4 C12 S12 N12 Cl12 O4 | 217 | 1.953 |
| mp-554761 | simmate / provider | Ba4 H8 C16 S16 N8 O36 F48 | 14 | 2.371 |
| mp-1210262 | simmate / provider | Na4 Ca4 Be4 Al1 Si7 O24 F4 | 82 | 2.848 |
| mp-1218684 | simmate / provider | Sr4 Ca1 Y1 Fe1 Cu4 Pb1 O14 | 119 | 5.778 |
| mp-1196726 | simmate / provider | Cu4 H56 C12 S12 N24 Cl4 O4 | 13 | 1.457 |
| mp-1227599 | simmate / provider | Cd4 H36 C12 S4 Br4 Cl8 O4 | 19 | 2.272 |
| mp-556173 | simmate / provider | Zn1 As2 C6 S12 N12 O6 F12 | 147 | 2.208 |
| mp-1215002 | simmate / provider | Ag4 H16 C4 S4 N10 Cl2 O6 | 2 | 2.576 |
| mp-568259 | simmate / provider | Ta4 Si8 P4 H72 C24 N8 Cl24 | 14 | 1.844 |
| mp-1218668 | simmate / provider | Sr6 Ca1 Y2 Ti1 Cu6 Hg2 O20 | 47 | 5.912 |
