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-626308 | simmate / provider | Ca2 H32 O20 | 1 | 1.560 |
| mp-504975 | simmate / provider | Mn1 Al2 P2 H18 O18 | 2 | 2.267 |
| mp-728290 | simmate / provider | V4 H48 N12 O20 F8 | 19 | 1.890 |
| mp-698362 | simmate / provider | H88 Ir4 C12 N24 O32 | 58 | 2.253 |
| mp-850221 | simmate / provider | H56 Ru2 S4 N12 O20 | 14 | 1.814 |
| mp-1175418 | simmate / provider | Li9 Co7 O16 | 12 | 4.452 |
| mp-626143 | simmate / provider | Mg1 H2 O2 | 5 | 2.274 |
| mp-754464 | simmate / provider | Li3 Co4 Ni1 O8 | 12 | 5.400 |
| mp-1180666 | simmate / provider | Li16 Be8 H32 | 14 | 0.750 |
| mp-12022 | simmate / provider | Hg2 B8 O14 | 31 | 5.782 |
| mp-777762 | simmate / provider | Li10 Cr3 Co2 Ni3 O16 | 1 | 4.447 |
| mp-1246094 | simmate / provider | Co16 C4 N16 | 62 | 6.583 |