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-1199273 | simmate / provider | Cs6 B6 H6 C18 O6 F54 | 176 | 2.536 |
| mp-723282 | simmate / provider | Cs2 C8 S8 N16 O4 F2 | 72 | 1.816 |
| mp-707729 | simmate / provider | Ba2 H12 C4 S4 N4 O6 | 12 | 2.097 |
| mp-735603 | simmate / provider | Ca2 H32 C8 N16 Cl4 O8 | 14 | 1.113 |
| mp-1214735 | simmate / provider | Ba6 Fe3 Si8 C2 Cl3 O30 | 156 | 4.099 |
| mp-1223599 | simmate / provider | K2 Mg6 Al2 Si6 O22 F2 | 9 | 2.647 |
| mp-651173 | simmate / provider | K6 W2 C8 N8 O2 F2 | 2 | 2.566 |
| mp-1235256 | simmate / provider | Ba1 Li1 Al3 P2 H2 O14 | 8 | 3.153 |
| mp-1178117 | simmate / provider | Li12 Fe3 Co1 P4 C4 O28 | 6 | 2.805 |
| mp-746580 | simmate / provider | Y8 Cu4 H20 S8 O48 F4 | 14 | 3.061 |
| mp-760297 | simmate / provider | Li3 V3 Fe3 P6 H6 O30 | 1 | 3.149 |
| mp-1233113 | simmate / provider | Ba1 Ca1 Al3 P2 H2 O14 | 8 | 3.317 |
