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-1220925 | simmate / provider | Na2 Pr2 Ti2 Nb2 O12 F2 | 74 | 4.874 |
| mp-1202300 | simmate / provider | V4 H60 C16 S8 N8 O40 | 14 | 1.907 |
| mp-1196601 | simmate / provider | K4 Co2 C8 S8 N8 O6 | 18 | 1.738 |
| mp-1203606 | simmate / provider | Pu2 H48 C16 N4 Cl8 O4 | 136 | 1.652 |
| mp-772237 | simmate / provider | Na2 Li10 Fe4 P4 C4 O28 | 4 | 2.837 |
| mp-773079 | simmate / provider | Al4 Zn4 H64 N4 O24 F24 | 14 | 2.044 |
| mp-1195210 | simmate / provider | H36 Ir2 C12 S6 Cl6 O6 | 1 | 1.766 |
| mp-1199897 | simmate / provider | Ca2 Co2 B2 P4 H10 O22 | 2 | 2.766 |
| mp-24828 | simmate / provider | Ba4 Co4 B4 P8 H4 O36 | 2 | 3.827 |
| mp-768847 | simmate / provider | Na10 Li2 Ni4 P4 C4 O28 | 6 | 2.997 |
| mp-1198285 | simmate / provider | Cu6 P8 H16 N4 O24 F8 | 14 | 2.888 |
| mp-759005 | simmate / provider | Li6 V3 Cr3 P6 H6 O30 | 2 | 3.118 |