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-728403 | simmate / provider | Cr2 P6 H36 C12 S12 O12 | 15 | 1.612 |
| mp-759519 | simmate / provider | Li8 V4 C8 O24 | 43 | 2.190 |
| mp-1190219 | simmate / provider | Li8 H4 N4 | 84 | 1.488 |
| mp-1033562 | simmate / provider | Na1 Hf1 Mg6 O7 | 99 | 4.568 |
| mp-3563 | simmate / provider | Ba5 Nb4 O15 | 164 | 5.981 |
| mp-556514 | simmate / provider | Ni20 Sn4 B8 O40 | 62 | 5.481 |
| mp-779891 | simmate / provider | Li6 Mn5 Fe1 B6 O18 | 6 | 3.191 |
| mp-1112158 | simmate / provider | K2 Y1 Cu1 Cl6 | 225 | 2.656 |
| mp-1426806 | simmate / provider | Ti1 O2 | 166 | 2.446 |
| mp-1954 | simmate / provider | P3 N5 | 44 | 3.511 |
| mp-759793 | simmate / provider | Li4 Ti8 P12 O48 | 33 | 2.847 |
| mp-780300 | simmate / provider | Li4 V2 P8 H24 O36 | 11 | 2.135 |