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-1194884 | simmate / provider | H84 C96 Xe2 Cl6 O12 | 2 | 1.369 |
| mp-850003 | simmate / provider | Na8 Ca8 Fe24 P32 O128 | 61 | 3.258 |
| mp-698277 | simmate / provider | Co8 H80 C32 N32 O48 | 15 | 1.874 |
| mp-645316 | simmate / provider | C140 F60 | 2 | 2.030 |
| mp-707467 | simmate / provider | Th4 H80 C16 S8 N32 O60 | 15 | 2.205 |
| mp-1205269 | simmate / provider | Na8 B48 S32 I48 O64 | 62 | 2.936 |
| mp-721035 | simmate / provider | Cu8 H96 N48 O48 | 58 | 1.431 |
| mp-686442 | simmate / provider | Ba40 Y20 Cu2 Ru18 O120 | 10 | 6.111 |
| mp-722571 | simmate / provider | Re20 H20 C80 O80 | 2 | 3.000 |
| mp-698365 | simmate / provider | Mg8 H80 C32 N32 O48 | 15 | 1.609 |
| mp-652793 | simmate / provider | Fe8 Co16 Ge8 C84 O84 | 15 | 2.141 |
| mp-722330 | simmate / provider | Li12 La8 H24 N36 O120 | 198 | 2.436 |