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-866806 | simmate / provider | Tb2 Ag2 H4 C4 S2 O18 | 12 | 3.999 |
| mp-1202041 | simmate / provider | Sr4 P12 H40 C12 N4 O36 | 14 | 2.292 |
| mp-766230 | simmate / provider | Rb4 Na2 Zn4 H10 C8 O28 | 14 | 3.034 |
| mp-720800 | simmate / provider | Mo24 P2 H48 C12 N6 O80 | 166 | 3.138 |
| mp-685130 | simmate / provider | K2 Al4 Fe5 Si5 H4 O24 | 1 | 2.895 |
| mp-1208461 | simmate / provider | U1 Cr4 H48 C14 N30 O22 | 2 | 1.920 |
| mp-720719 | simmate / provider | Ca8 Y8 Si16 H8 C4 O64 | 62 | 3.286 |
| mp-697108 | simmate / provider | K6 H2 Rh2 C10 N10 O2 | 2 | 2.091 |
| mp-977011 | simmate / provider | H3 Pb1 C1 I3 N1 F3 | 6 | 4.074 |
| mp-1233400 | simmate / provider | Mg1 V1 Cr2 Fe3 P6 O24 | 1 | 3.274 |
| mp-1198211 | simmate / provider | Na4 Ni2 Mo12 H52 N4 O60 | 14 | 2.736 |
| mp-722686 | simmate / provider | Si4 H40 C8 N16 O8 F24 | 61 | 1.802 |