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-684942 | simmate / provider | Fe2 P2 H10 N2 O8 F2 | 1 | 2.142 |
| mp-1233276 | simmate / provider | K2 Mg1 Mn2 P6 H2 O20 | 1 | 2.524 |
| mp-977569 | simmate / provider | Na2 H12 C2 N4 Cl2 O4 | 5 | 1.564 |
| mp-773906 | simmate / provider | K4 Na4 Zr4 Si12 H16 O44 | 33 | 2.595 |
| mp-1181015 | simmate / provider | Mo6 C14 Br6 N2 Cl6 O14 | 2 | 2.171 |
| mp-569292 | simmate / provider | Zr4 Cu4 H32 C8 N4 Cl24 | 14 | 2.206 |
| mp-697127 | simmate / provider | K6 H2 Pd2 S4 Cl4 O12 | 36 | 2.604 |
| mp-1199348 | simmate / provider | Cu1 H44 C12 N8 Cl2 O10 | 2 | 1.327 |
| mp-1235462 | simmate / provider | Ba2 Li1 Sm1 Co1 Cu2 O7 | 25 | 6.166 |
| mp-24680 | simmate / provider | Rb1 H18 Ru1 N6 Cl4 O8 | 148 | 2.178 |
| mp-695946 | simmate / provider | Ni1 H16 C4 S4 N8 Cl2 | 79 | 1.696 |
| mp-534782 | simmate / provider | Ca18 Nd2 Si3 P9 O48 F3 | 6 | 3.315 |
