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-759852 | simmate / provider | Li3 V3 Cr3 P6 O24 F6 | 1 | 3.162 |
| mp-1196516 | simmate / provider | P14 H108 Ir4 C36 Cl2 F12 | 2 | 1.576 |
| mp-557227 | simmate / provider | K1 Ca12 Si4 S2 O26 F1 | 166 | 2.976 |
| mp-707443 | simmate / provider | Na7 Al1 H2 C4 O12 F4 | 2 | 2.460 |
| mp-735514 | simmate / provider | Mn2 H36 C8 N16 Cl8 O8 | 14 | 1.733 |
| mp-772652 | simmate / provider | Na2 Li10 Mn4 P4 C4 O28 | 2 | 2.740 |
| mp-861714 | simmate / provider | Li4 V2 Cr2 P4 O16 F4 | 2 | 3.162 |
| mp-555080 | simmate / provider | P4 H28 C4 N12 O12 F4 | 14 | 1.640 |
| mp-1181015 | simmate / provider | Mo6 C14 Br6 N2 Cl6 O14 | 2 | 2.171 |
| mp-1221089 | simmate / provider | Na1 Ca1 Mg1 Al1 Si4 O12 | 5 | 3.191 |
| mp-1234958 | simmate / provider | Mg1 Ti3 Fe2 Co1 P6 O24 | 1 | 3.261 |
| mp-24280 | simmate / provider | Ga1 H36 C12 S6 I3 O6 | 148 | 1.773 |
