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-554559 | simmate / provider | Ni2 H64 C16 S8 N4 O20 | 14 | 1.572 |
| mp-1196356 | simmate / provider | Ni2 H48 C12 S12 N28 O12 | 15 | 1.484 |
| mp-1199814 | simmate / provider | Ni2 H96 C36 S12 N28 O12 | 167 | 1.264 |
| mp-728396 | simmate / provider | Ni2 H48 C4 S4 N12 O28 | 14 | 1.727 |
| mp-695946 | simmate / provider | Ni1 H16 C4 S4 N8 Cl2 | 79 | 1.696 |
| mp-766473 | simmate / provider | Ni1 H36 C12 S6 I4 O6 | 148 | 2.012 |
| mp-1202532 | simmate / provider | Ni2 H48 C12 S12 Br4 N24 | 15 | 1.686 |
| mp-818718 | simmate / provider | Ni1 H44 C12 N8 Cl2 O10 | 2 | 1.386 |
| mp-600212 | simmate / provider | Ni4 H56 C12 N4 Cl12 O8 | 62 | 1.714 |
| mp-1196382 | simmate / provider | Ni1 H44 C12 N8 Cl2 O10 | 2 | 1.122 |
| mp-1190493 | simmate / provider | Ni4 H20 C4 N4 Cl8 O8 | 15 | 2.165 |
| mp-1348675 | simmate / provider | Ni1 H44 C12 N8 Cl2 O10 | 2 | 1.386 |
