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-23808 | simmate / provider | K2 Sc2 B2 P4 H2 O18 | 2 | 2.684 |
| mp-1177593 | simmate / provider | Li12 Mn4 Fe4 Co4 P12 O48 | 6 | 3.468 |
| mp-773133 | simmate / provider | K12 Cu4 B8 P16 H12 O68 | 14 | 2.624 |
| mp-559978 | simmate / provider | Cu2 As4 S16 N16 O8 F56 | 88 | 2.582 |
| mp-720987 | simmate / provider | Na6 Ca2 Sc6 Zn2 Si16 O48 | 13 | 2.916 |
| mp-760245 | simmate / provider | Li3 Mn3 V3 P6 H6 O30 | 1 | 3.119 |
| mp-721128 | simmate / provider | Ga12 P12 H24 C8 N4 O52 | 14 | 2.570 |
| mp-1202117 | simmate / provider | Li2 Cu4 B2 P4 H4 O20 | 15 | 3.327 |
| mp-774708 | simmate / provider | Zn4 H48 C12 S16 N24 O16 | 29 | 1.910 |
| mp-766564 | simmate / provider | Li12 Fe3 Ni1 P4 C4 O28 | 6 | 2.840 |
| mp-1176343 | simmate / provider | Na10 Li2 Fe4 P4 C4 O28 | 1 | 2.906 |
| mp-1210434 | simmate / provider | Re12 Pb6 C4 S4 N8 O52 | 113 | 4.746 |