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-696878 | simmate / provider | K3 Ca1 P2 H1 O8 | 12 | 2.659 |
| mp-1043764 | simmate / provider | Ti2 Bi2 P6 O24 | 161 | 3.610 |
| mp-776469 | simmate / provider | Li8 Mn8 P16 O56 | 1 | 3.037 |
| mp-697981 | simmate / provider | Cd12 H8 C4 Se4 O32 | 62 | 4.921 |
| mp-1225940 | simmate / provider | K60 Ga18 As38 | 148 | 2.715 |
| mp-1112353 | simmate / provider | Cs3 Sb1 Cl6 | 225 | 2.906 |
| mp-753727 | simmate / provider | Y6 I14 O2 | 186 | 4.289 |
| mp-1199614 | simmate / provider | Cs8 P4 H16 Se12 O8 | 58 | 3.543 |
| mp-1203221 | simmate / provider | As4 Br4 Kr8 O4 F48 | 14 | 3.044 |
| mp-770560 | simmate / provider | Na8 Cr4 C8 S2 O32 | 70 | 2.624 |
| mp-1228693 | simmate / provider | Ba12 Ca12 Mo8 N32 | 19 | 4.640 |
| mp-531782 | simmate / provider | Mg4 Al24 O40 | 8 | 3.500 |