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-720230 | simmate / provider | Ba8 Na6 Nd6 P12 O48 F4 | 1 | 4.494 |
| mp-695698 | simmate / provider | Ca4 Ti2 Al2 Si4 O18 F2 | 2 | 3.369 |
| mp-555028 | simmate / provider | Ag1 Sb1 Te6 S16 O6 F30 | 2 | 2.882 |
| mp-1224735 | simmate / provider | K12 Ag4 As8 C1 Se20 O1 | 1 | 3.655 |
| mp-1209405 | simmate / provider | Sr4 H24 C24 S8 N8 O28 | 14 | 1.932 |
| mp-1197384 | simmate / provider | Co1 H12 Pd1 C4 N4 O12 | 12 | 2.020 |
| mp-772931 | simmate / provider | Na6 Li6 Fe4 P4 C4 O28 | 1 | 2.870 |
| mp-720082 | simmate / provider | K1 Cd6 H4 C12 Cl1 O26 | 1 | 3.190 |
| mp-555189 | simmate / provider | Rb8 Li4 C12 S12 O36 F36 | 14 | 2.300 |
| mp-775171 | simmate / provider | Li4 Mn2 Cr1 Ni3 P6 O24 | 1 | 3.370 |
| mp-759559 | simmate / provider | Na6 Li2 Mn2 B2 P2 O14 | 11 | 2.727 |
| mp-554918 | simmate / provider | Ba1 Y6 Si3 B6 O24 F2 | 156 | 4.348 |