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-1197884 | simmate / provider | V1 H17 C4 S4 O20 F12 | 2 | 1.933 |
| mp-1234851 | simmate / provider | Mg1 Al2 H4 Pb2 O4 F6 | 2 | 4.449 |
| mp-1235322 | simmate / provider | Ba2 Li1 Sm1 Co1 Cu2 O7 | 25 | 6.212 |
| mp-708992 | simmate / provider | Al2 H40 C4 S4 N2 O28 | 7 | 1.592 |
| mp-540575 | simmate / provider | Zn2 Hg4 H28 C8 N12 O26 | 15 | 2.786 |
| mp-1234075 | simmate / provider | K2 Mg1 Nb2 P2 C2 O14 | 1 | 2.679 |
| mp-723020 | simmate / provider | Al4 Si4 H10 C4 N2 O20 | 9 | 2.050 |
| mp-1211315 | simmate / provider | Na8 H48 C16 S16 N24 O16 | 14 | 1.609 |
| mp-1198531 | simmate / provider | U2 C8 S2 N2 Cl2 O16 | 4 | 2.130 |
| mp-1233346 | simmate / provider | Mg1 Mn3 V1 Cr2 P6 O24 | 1 | 3.175 |
| mp-1233667 | simmate / provider | Mg1 Ti3 Fe2 Co1 P6 O24 | 146 | 3.179 |
| mp-1200644 | simmate / provider | Ca1 H36 W6 C12 S6 O25 | 2 | 2.785 |