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-4950 | simmate / provider | K1 Ca1 F3 | 221 | 2.512 |
| mp-673801 | simmate / provider | Ca6 Nd2 F18 | 1 | 4.032 |
| mp-776825 | simmate / provider | Ba4 Y12 F44 | 19 | 2.785 |
| mp-1201985 | simmate / provider | Rb4 Y4 B16 H64 | 14 | 1.344 |
| mp-1212152 | simmate / provider | Ho4 Mg4 B20 O40 | 14 | 4.348 |
| mp-557793 | simmate / provider | Rb16 Li4 Zr12 H8 F76 | 14 | 3.512 |
| mp-706514 | simmate / provider | H20 C4 S4 O20 F12 | 14 | 1.738 |
| mp-24618 | simmate / provider | Al4 H40 N8 O4 F20 | 60 | 1.765 |
| mp-1197966 | simmate / provider | K4 Li4 B8 H32 | 62 | 1.026 |
| mp-1229104 | simmate / provider | Al2 H30 O12 F12 | 2 | 1.672 |
| mp-978526 | simmate / provider | Si8 H96 C32 | 205 | 0.998 |
| mp-1180553 | simmate / provider | Li4 C1 O4 | 23 | 2.415 |