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-729028 | simmate / provider | K4 Cr4 H96 S8 O80 | 205 | 1.854 |
| mp-720461 | simmate / provider | P12 H88 C12 N36 O44 | 14 | 1.495 |
| mp-740722 | simmate / provider | Na24 Ge8 H88 O72 | 61 | 2.229 |
| mp-707209 | simmate / provider | Cs4 H96 Rh4 S8 O80 | 205 | 2.223 |
| mp-721077 | simmate / provider | Cs4 Fe4 H96 Se8 O80 | 205 | 2.200 |
| mp-683970 | simmate / provider | Si64 O128 | 47 | 1.552 |
| mp-1024087 | simmate / provider | Zr63 S128 | 164 | 3.460 |
| mp-1096929 | simmate / provider | Zr64 S127 | 156 | 3.246 |
| mp-695298 | simmate / provider | K22 Nb13 In11 P24 O120 | 1 | 3.335 |
| mp-1196729 | simmate / provider | P2 H60 W24 C18 N6 O80 | 148 | 4.113 |
| mp-680169 | simmate / provider | Na63 S21 Cl3 O84 F18 | 157 | 2.519 |
| mp-1194856 | simmate / provider | P12 H84 C36 S8 O24 F24 | 14 | 1.454 |