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-643446 | simmate / provider | Ca2 Al1 H8 S2 Cl1 O12 F2 | 87 | 2.305 |
| mp-1229326 | simmate / provider | Al16 P16 H44 C28 N8 O66 F4 | 15 | 1.932 |
| mp-6903 | simmate / provider | Na4 Ca8 Zr2 Nb2 Si8 O34 F2 | 4 | 3.312 |
| mp-1221911 | simmate / provider | Na4 Ca8 Zr2 Nb2 Si8 O34 F2 | 4 | 3.260 |
| mp-720410 | simmate / provider | K4 Na2 Ca4 Ti2 Si14 H2 O40 | 2 | 2.707 |
| mp-1195311 | simmate / provider | Ca2 La2 Mg2 Al4 Si6 H2 O26 | 11 | 3.822 |
| mp-698303 | simmate / provider | Mn2 P4 H72 C24 N12 Cl4 O4 | 15 | 1.264 |
| mp-1200262 | simmate / provider | Na8 Zn2 P6 H64 C6 N2 O44 | 2 | 1.782 |
| mp-1198212 | simmate / provider | Cs2 Mo4 H4 C14 S14 O42 F42 | 11 | 2.147 |
| mp-1199737 | simmate / provider | K12 Al8 Si12 B2 H8 Cl2 O48 | 114 | 2.379 |
| mp-1199187 | simmate / provider | Zn2 H24 C4 S4 N8 Cl4 O8 | 31 | 1.765 |
| mp-1200682 | simmate / provider | Ag4 H72 C16 S16 Br4 N32 O4 | 14 | 1.751 |
