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-543032 | simmate / provider | Nd2 H36 C6 S6 O36 F18 | 176 | 1.976 |
| mp-1200250 | simmate / provider | Na4 Li4 Ni4 P4 O16 F4 | 14 | 3.425 |
| mp-766531 | simmate / provider | Li12 Mn3 Cr1 P4 C4 O28 | 6 | 2.715 |
| mp-534807 | simmate / provider | Ca5 Y7 Al16 Cr2 Si2 O48 | 1 | 4.055 |
| mp-1216219 | simmate / provider | Zn3 Cr1 H80 S8 N8 O56 | 2 | 1.860 |
| mp-1228289 | simmate / provider | Ba4 Nd4 Ti3 Mn1 Cu4 O22 | 99 | 6.498 |
| mp-1235974 | simmate / provider | Rb1 Li1 Cu2 H3 S2 O10 | 8 | 3.192 |
| mp-534773 | simmate / provider | Na2 Al17 Si11 B7 H6 O62 | 1 | 3.000 |
| mp-1180373 | simmate / provider | Ni4 H56 C12 N4 Cl12 O8 | 62 | 1.623 |
| mp-1177767 | simmate / provider | Li4 V2 Fe2 P4 H4 O20 | 2 | 3.127 |
| mp-1179748 | simmate / provider | Rb2 Hg2 C4 N4 Cl2 O2 | 63 | 2.650 |
| mp-720704 | simmate / provider | Na1 Ca9 Sc1 Zn9 Si20 O60 | 5 | 3.677 |
