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-1233983 | simmate / provider | Mg1 H4 C4 S4 O12 F12 | 1 | 1.861 |
| mp-684853 | simmate / provider | Ba2 Yb2 Al4 Si3 N10 O4 | 1 | 4.727 |
| mp-1216219 | simmate / provider | Zn3 Cr1 H80 S8 N8 O56 | 2 | 1.860 |
| mp-758399 | simmate / provider | Li6 V3 Cr3 P6 H6 O30 | 2 | 3.116 |
| mp-1197012 | simmate / provider | As4 P4 H4 Cl12 O4 F24 | 62 | 2.273 |
| mp-1218551 | simmate / provider | Sr3 Y2 Fe1 Cu3 Bi1 O12 | 38 | 6.157 |
| mp-1234478 | simmate / provider | Mg1 V1 Cr2 Fe3 P6 O24 | 1 | 3.318 |
| mp-24179 | simmate / provider | K4 H24 C8 S8 N4 O16 | 14 | 1.797 |
| mp-1201666 | simmate / provider | V12 Co1 H24 C8 N2 O32 | 2 | 2.138 |
| mp-776477 | simmate / provider | Li6 Mn3 V3 P6 O24 F6 | 2 | 3.148 |
| mp-1183871 | simmate / provider | Co2 B2 P4 H2 Pb2 O18 | 2 | 4.623 |
| mp-1235304 | simmate / provider | K1 Li1 Ni2 H3 Se2 O10 | 8 | 3.586 |