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-693612 | simmate / provider | Na4 Ca12 Sm4 P12 O48 F4 | 1 | 3.657 |
| mp-557379 | simmate / provider | P8 H24 C16 N8 Cl8 O4 | 2 | 1.595 |
| mp-1182914 | simmate / provider | Al2 H28 C8 N2 O2 F8 | 2 | 1.089 |
| mp-1197049 | simmate / provider | Cd2 H16 C4 S4 N12 O12 | 14 | 2.077 |
| mp-1199681 | simmate / provider | Al4 Sn4 P4 H72 C24 Cl16 | 62 | 1.376 |
| mp-766416 | simmate / provider | K4 U2 H12 C4 S2 O26 | 2 | 2.931 |
| mp-772498 | simmate / provider | Na6 Li6 Mn4 P4 C4 O28 | 1 | 2.774 |
| mp-849423 | simmate / provider | Li6 Mn3 V3 P6 H6 O30 | 1 | 3.118 |
| mp-1193229 | simmate / provider | Mn1 H12 C8 S2 N2 O2 | 2 | 1.254 |
| mp-1177457 | simmate / provider | Li4 Mn2 Fe3 Sn1 P6 O24 | 1 | 3.366 |
| mp-1233636 | simmate / provider | Sr2 Mg1 Zn2 Sn2 P4 O16 | 1 | 3.865 |
| mp-721789 | simmate / provider | Cu2 H36 C8 N20 Cl4 O4 | 2 | 1.627 |