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-1247898 | simmate / provider | Al8 P8 H34 N7 O36 F5 | 1 | 2.279 |
| mp-1212156 | simmate / provider | K4 H12 C4 S4 N8 O4 | 14 | 1.371 |
| mp-1233800 | simmate / provider | Ca1 Cu2 B2 H8 Cl2 O8 | 81 | 2.667 |
| mp-1195917 | simmate / provider | Na2 B14 H28 C4 N4 O28 | 2 | 1.790 |
| mp-1203768 | simmate / provider | Ta4 Si4 H132 C44 N20 Cl4 | 14 | 1.436 |
| mp-1234960 | simmate / provider | Sr2 Mg1 Zn2 Sn2 P4 O16 | 2 | 3.916 |
| mp-1234974 | simmate / provider | Ba6 Ca1 Nb2 Ir1 Cl2 O12 | 1 | 4.913 |
| mp-1192972 | simmate / provider | Pb2 C6 S4 N2 O8 F4 | 2 | 2.505 |
| mp-699914 | simmate / provider | Mn8 P4 C44 S4 O32 F36 | 14 | 2.011 |
| mp-1182759 | simmate / provider | Na4 Te1 Mo6 H40 N2 O40 | 2 | 2.506 |
| mp-1234758 | simmate / provider | Cs4 Mg1 Mn4 H16 Cl12 O8 | 3 | 2.581 |
| mp-1199298 | simmate / provider | Cu4 H24 C12 S4 Br12 N12 | 14 | 2.607 |