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-850003 | simmate / provider | Na8 Ca8 Fe24 P32 O128 | 61 | 3.258 |
| mp-667369 | simmate / provider | Ca16 Zr40 Ti16 O128 | 61 | 4.842 |
| mp-707911 | simmate / provider | Na8 Fe8 P24 H56 O104 | 60 | 2.373 |
| mp-722330 | simmate / provider | Li12 La8 H24 N36 O120 | 198 | 2.436 |
| mp-1197124 | simmate / provider | Cs12 Rh36 C76 O76 | 14 | 3.362 |
| mp-698366 | simmate / provider | Zn8 H80 C32 N32 O48 | 15 | 1.898 |
| mp-707477 | simmate / provider | As10 H120 C40 I30 | 84 | 2.610 |
| mp-1202309 | simmate / provider | Al20 H80 N20 F80 | 138 | 2.250 |
| mp-720269 | simmate / provider | Sr40 Fe18 Co2 Mo20 O120 | 2 | 5.499 |
| mp-721035 | simmate / provider | Cu8 H96 N48 O48 | 58 | 1.431 |
| mp-645316 | simmate / provider | C140 F60 | 2 | 2.030 |
| mp-1199816 | simmate / provider | Cu8 H96 C8 N48 Cl32 O8 | 61 | 1.925 |