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-697563 | simmate / provider | Ca4 Mg1 B4 H6 C2 O18 | 12 | 2.623 |
| mp-24100 | simmate / provider | K1 Cr1 H18 N6 Cl4 O8 | 148 | 1.874 |
| mp-534904 | simmate / provider | Ba6 La6 Mg6 Ti3 W3 O36 | 164 | 6.537 |
| mp-1232383 | simmate / provider | Hf2 Ta2 Ti2 B8 Mo2 C8 | 2 | 9.302 |
| mp-727393 | simmate / provider | Ca4 Mn2 Al4 Si8 B2 O30 | 2 | 3.150 |
| mp-720704 | simmate / provider | Na1 Ca9 Sc1 Zn9 Si20 O60 | 5 | 3.677 |
| mp-738726 | simmate / provider | Zr4 H64 C20 N8 O12 F16 | 41 | 1.683 |
| mp-560721 | simmate / provider | Na4 Ca4 Be4 Si8 O24 F4 | 19 | 2.872 |
| mp-1212565 | simmate / provider | Na4 Ca2 Zr4 Si20 H2 O52 | 9 | 2.123 |
| mp-772717 | simmate / provider | Na4 Li8 Fe4 P4 C4 O28 | 1 | 2.856 |
| mp-1101651 | simmate / provider | Na2 Li10 Fe4 P4 C4 O28 | 1 | 2.812 |
| mp-1173853 | simmate / provider | Na3 Ca2 Mg10 Si16 O44 F4 | 1 | 2.812 |
