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-706601 | simmate / provider | Zn4 H64 C16 S16 N40 O24 | 56 | 1.560 |
| mp-1223573 | simmate / provider | K2 Ba2 V4 Cu2 Cl2 O14 | 35 | 3.574 |
| mp-1234716 | simmate / provider | Ca1 La2 Co2 Sb2 Pb2 O12 | 1 | 6.459 |
| mp-1180606 | simmate / provider | Na4 Cu1 P6 H22 N6 O22 | 2 | 1.972 |
| mp-696633 | simmate / provider | Ca10 Ta1 Ti8 Al1 Si10 O50 | 1 | 3.507 |
| mp-1234376 | simmate / provider | Mg1 Ti3 Fe2 Co1 P6 O24 | 1 | 3.269 |
| mp-567146 | simmate / provider | Si6 P2 H54 C18 Br2 N4 | 2 | 1.212 |
| mp-555612 | simmate / provider | Sb8 Ir2 C10 Cl2 O10 F44 | 4 | 3.224 |
| mp-1234222 | simmate / provider | Ba6 Ca1 Nb2 Ir1 Cl2 O12 | 1 | 4.890 |
| mp-1201772 | simmate / provider | Mo4 H48 C16 S8 Br8 O16 | 14 | 1.989 |
| mp-1233666 | simmate / provider | Ba6 Mg1 Sc2 C2 O6 F14 | 8 | 4.170 |
| mp-729296 | simmate / provider | Ni10 Sb2 H34 C30 N2 O18 | 2 | 2.169 |
