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-1235616 | simmate / provider | Li1 Pr2 Ta2 Cl2 O7 | 8 | 6.686 |
| mp-989602 | simmate / provider | La1 Re1 N3 | 221 | 9.744 |
| mp-1207606 | simmate / provider | Y1 Fe3 B4 O12 | 155 | 3.977 |
| mp-1376587 | simmate / provider | Li2 Ti2 Si6 O16 | 2 | 2.850 |
| mp-510382 | simmate / provider | Fe3 Pt1 N1 | 221 | 6.059 |
| mp-1189919 | simmate / provider | Li3 P3 O12 | 146 | 2.029 |
| mp-1197606 | simmate / provider | Hg4 C6 I14 N18 | 15 | 3.640 |
| mp-1520172 | simmate / provider | Ba2 Ca1 Cr1 O6 | 225 | 5.360 |
| mp-1247248 | simmate / provider | Mn4 Ag4 N4 | 12 | 6.849 |
| mp-1042892 | simmate / provider | Zn2 Cu2 Ge4 O12 | 15 | 4.929 |
| mp-569346 | simmate / provider | Cu2 I2 | 186 | 5.747 |
| mp-757302 | simmate / provider | P12 W8 O52 | 14 | 3.781 |