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-706456 | simmate / provider | Te8 As8 S4 I24 O8 F48 | 1 | 3.935 |
| mp-504807 | simmate / provider | Mg2 P4 H40 C8 N16 O24 | 14 | 1.742 |
| mp-1238663 | simmate / provider | Mn4 H48 C8 N4 Cl12 O8 | 64 | 1.087 |
| mp-1235305 | simmate / provider | Sr2 Li1 Pr2 Fe2 Ru2 O12 | 1 | 6.199 |
| mp-1204475 | simmate / provider | Rb4 Cu8 H8 C12 N12 O4 | 14 | 2.582 |
| mp-1236434 | simmate / provider | Sr4 Li1 Mn2 Cu3 S4 O4 | 5 | 4.570 |
| mp-1106075 | simmate / provider | K2 Au2 C4 N4 Cl4 O2 | 15 | 2.881 |
| mp-1229322 | simmate / provider | Ba4 Co4 H8 C12 Cl4 O32 | 15 | 2.907 |
| mp-1223381 | simmate / provider | Li2 Co2 H24 C6 N12 O15 | 1 | 1.868 |
| mp-1199298 | simmate / provider | Cu4 H24 C12 S4 Br12 N12 | 14 | 2.607 |
| mp-1233645 | simmate / provider | Ba2 Mg1 Fe2 B2 P4 O18 | 1 | 3.475 |
| mp-1228046 | simmate / provider | Ba1 Fe1 Cu1 Pb2 Cl1 O5 | 99 | 7.138 |
