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-1228200 | simmate / provider | Ba2 Y2 Fe1 Co2 Cu1 O10 | 107 | 5.990 |
| mp-1192921 | simmate / provider | Sn2 H14 C4 Se2 Cl2 O6 | 2 | 2.527 |
| mp-1176585 | simmate / provider | Na10 Li2 Fe4 P4 C4 O28 | 1 | 2.897 |
| mp-680067 | simmate / provider | Ag8 C4 S4 N4 Cl4 O16 | 15 | 3.866 |
| mp-734296 | simmate / provider | K5 Au5 C10 I2 N10 O2 | 2 | 3.549 |
| mp-1173738 | simmate / provider | Na3 Mg4 Sc1 Si8 O22 F2 | 1 | 2.896 |
| mp-554318 | simmate / provider | B2 H22 C8 Br2 N2 F8 | 11 | 1.773 |
| mp-24764 | simmate / provider | Al1 H36 C12 S6 Cl3 O6 | 148 | 1.377 |
| mp-1202938 | simmate / provider | Na4 Gd4 P8 H8 C4 O28 | 14 | 3.558 |
| mp-765988 | simmate / provider | Li2 V2 Fe2 P4 H4 O20 | 1 | 3.085 |
| mp-764571 | simmate / provider | Li4 V2 Fe2 P4 O16 F4 | 2 | 3.151 |
| mp-1227953 | simmate / provider | Ba1 Na2 Sr6 Al6 O2 F32 | 8 | 3.801 |
