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-1236436 | simmate / provider | K2 Ba1 Li1 Co1 N6 O12 | 1 | 2.716 |
| mp-722880 | simmate / provider | Ba4 Re8 H48 C12 N24 O44 | 14 | 3.238 |
| mp-1198947 | simmate / provider | Fe4 Hg8 C24 S8 N8 O16 | 88 | 2.913 |
| mp-1177607 | simmate / provider | Li12 Mn4 Fe4 Co4 P12 O48 | 6 | 3.478 |
| mp-1199099 | simmate / provider | Cu3 P4 H24 C6 N2 O16 | 2 | 2.105 |
| mp-1232383 | simmate / provider | Hf2 Ta2 Ti2 B8 Mo2 C8 | 2 | 9.302 |
| mp-1179748 | simmate / provider | Rb2 Hg2 C4 N4 Cl2 O2 | 63 | 2.650 |
| mp-1199154 | simmate / provider | P2 H24 C6 N12 O10 F2 | 1 | 1.530 |
| mp-1233022 | simmate / provider | Mg1 Co6 Ag2 P6 H4 O24 | 2 | 4.154 |
| mp-1225015 | simmate / provider | Fe2 P2 H10 N2 O8 F2 | 7 | 2.486 |
| mp-720222 | simmate / provider | Na6 Ca2 Al6 Si6 S2 O32 | 1 | 2.514 |
| mp-1197796 | simmate / provider | K4 Ca4 Co4 C24 S24 O40 | 19 | 1.930 |