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-699429 | simmate / provider | V1 H12 C2 S2 O12 F6 | 12 | 1.756 |
| mp-1182055 | simmate / provider | Co2 H64 C16 S8 N4 O20 | 14 | 1.207 |
| mp-735513 | simmate / provider | Co4 H80 S8 N24 Cl4 O16 | 14 | 1.686 |
| mp-773092 | simmate / provider | Al4 Ni4 H64 N4 O24 F24 | 14 | 2.048 |
| mp-1197686 | simmate / provider | Ga2 Ge4 H10 C2 N2 O12 | 2 | 3.170 |
| mp-776591 | simmate / provider | Li6 Mn3 V3 P6 H6 O30 | 1 | 3.132 |
| mp-1208798 | simmate / provider | U2 H20 C2 Se4 N8 O16 | 2 | 3.285 |
| mp-1203519 | simmate / provider | K2 Mn2 Ga4 P6 H8 O28 | 15 | 3.068 |
| mp-1178079 | simmate / provider | Li12 Mn1 Cr3 P4 C4 O28 | 6 | 2.699 |
| mp-721034 | simmate / provider | Na1 Fe9 Si6 B3 H2 O31 | 8 | 3.445 |
| mp-1232413 | simmate / provider | Na6 Cu2 P4 H12 N2 O26 | 11 | 2.315 |
| mp-720554 | simmate / provider | Li4 P4 H16 N4 O12 F4 | 14 | 2.006 |