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-1210452 | simmate / provider | S32 Cl128 | 218 | 1.903 |
| mp-777863 | simmate / provider | Li24 Mn4 V12 P24 O96 | 1 | 3.291 |
| mp-732003 | simmate / provider | K12 Be12 B12 P24 O100 | 212 | 2.462 |
| mp-1247708 | simmate / provider | Ca32 Ti4 Mn28 O96 | 6 | 4.295 |
| mp-600242 | simmate / provider | In4 H96 C24 Br24 N12 | 148 | 2.262 |
| mp-849805 | simmate / provider | B48 H84 C16 S8 I4 | 14 | 1.488 |
| mp-651768 | simmate / provider | Cs8 Xe24 O24 F104 | 205 | 3.673 |
| mp-680713 | simmate / provider | Ho16 B48 O96 | 62 | 5.329 |
| mp-600156 | simmate / provider | H88 Rh4 C12 N24 O32 | 58 | 1.825 |
| mp-652068 | simmate / provider | K16 S32 N16 O64 F32 | 61 | 2.293 |
| mp-684747 | simmate / provider | Bi64 O96 | 1 | 8.749 |
| mp-28634 | simmate / provider | K8 I24 F128 | 14 | 3.455 |