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-1195164 | simmate / provider | Cu4 B4 P16 H96 C32 S16 F16 | 14 | 1.384 |
| mp-706528 | simmate / provider | Cu2 H18 C2 S2 N8 Cl6 O2 | 2 | 1.660 |
| mp-1196726 | simmate / provider | Cu4 H56 C12 S12 N24 Cl4 O4 | 13 | 1.457 |
| mp-728315 | simmate / provider | Cu2 H18 C2 S2 N8 Cl6 O2 | 2 | 1.660 |
| mp-1195359 | simmate / provider | Er4 H40 C24 S24 N12 O68 F72 | 14 | 2.210 |
| mp-1201707 | simmate / provider | Fe12 P12 H48 C8 N8 O52 F8 | 14 | 2.351 |
| mp-651106 | simmate / provider | Fe4 Sb8 W4 C32 Se8 O32 F48 | 14 | 3.084 |
| mp-1202559 | simmate / provider | Ga12 P16 H112 C28 N14 O64 F2 | 2 | 1.987 |
| mp-1198245 | simmate / provider | Ga1 Si6 Bi1 H54 C18 N4 Cl4 | 1 | 1.352 |
| mp-1195290 | simmate / provider | Ga12 Si20 P40 H144 C48 N16 Cl44 | 14 | 1.497 |
| mp-1205154 | simmate / provider | Ga2 Si6 P2 H60 C20 N4 Cl8 | 4 | 1.232 |
| mp-721059 | simmate / provider | H32 Au4 C8 S8 N16 Cl4 O16 | 54 | 2.666 |
