Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Li3PO4 | COD | 9012500 | Pmn2_1 (31) | ✗ | 16 | 76 | 1 | 6.1067 | 6.197 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Ba7(ClF6)2 | ICSD | 87084 | P-6 (174) | ✗ | 21 | 168 | 1 | 6.1133 | 6.113 | 0.000 | (0;000) | ✗ | 04/08/17 |
| LiH2N | ICSD | 237214 | Pbcm (57) | ✔ | 16 | 40 | 3 | 6.1225 | 6.972 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BH3OF4 | ICSD | 15591 | P-1 (2) | ✔ | 18 | 80 | 1 | 6.1272 | 6.158 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BH6CN3F4 | ICSD | 202434 | R3m (160) | ✗ | 15 | 56 | 1 | 6.1298 | 6.130 | 0.000 | (0;000) | ✗ | 15/02/17 |
| KF | COD | 9008652 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 6.1456 | 6.146 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CsClO4 | ICSD | 63364 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.149 | 6.169 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CsK(ClO4)2 | ICSD | 22504 | R-3m (166) | ✔ | 12 | 80 | 1 | 6.1528 | 6.157 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2HfF6 | ICSD | 47244 | Fm-3m (225) | ✔ | 9 | 72 | 1 | 6.1532 | 6.153 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiAlPHO5 | ICSD | 68921 | P-1 (2) | ✔ | 18 | 84 | 3 | 6.1578 | 6.188 | 0.000 | (0;000) | ✗ | 05/01/17 |
| CaSnF6 | ICSD | 35713 | Fm-3m (225) | ✔ | 8 | 66 | 1 | 6.1583 | 6.158 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Be2BO3F | ICSD | 56847 | C2/c (15) | ✔ | 14 | 72 | 1 | 6.1761 | 6.176 | 0.000 | (0;000) | ✗ | 05/01/17 |
| NaBH4 | ICSD | 166446 | Pnma (62) | ✔ | 24 | 64 | 1 | 6.1844 | 6.186 | 0.000 | (0;000) | ✗ | 04/08/17 |
| HCN | ICSD | 76419 | Imm2 (44) | ✗ | 3 | 10 | 1 | 6.1862 | 6.634 | 0.000 | (0;000) | ✗ | 15/02/17 |
| K3SiF7 | ICSD | 23875 | P4/mbm (127) | ✔ | 22 | 160 | 1 | 6.192 | 6.192 | 0.000 | (0;000) | ✗ | 04/08/17 |
| NaMgF3 | COD | 9003812 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 6.1969 | 6.641 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BH2C2NF4 | COD | 4300536 | P2_1 (4) | ✗ | 20 | 92 | 1 | 6.197 | 6.204 | 0.000 | (0;000) | ✗ | 21/03/17 |
| KCaF3 | ICSD | 154074 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 6.2019 | 6.356 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CaSO4 | COD | 5000040 | Cmcm (63) | ✔ | 12 | 80 | 1 | 6.2076 | 6.694 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaBClF4 | ICSD | 188654 | Pmn2_1 (31) | ✗ | 14 | 96 | 1 | 6.2092 | 6.211 | 0.000 | (0;000) | ✗ | 21/03/17 |
| POF3 | ICSD | 250498 | P-3m1 (164) | ✔ | 10 | 64 | 1 | 6.2121 | 6.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaBePO4F | ICSD | 200922 | P1 (1) | ✗ | 16 | 100 | 1 | 6.2132 | 6.473 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Cs2SiF6 | COD | 1010285 | Fm-3m (225) | ✔ | 9 | 64 | 1 | 6.2138 | 6.244 | 0.000 | (0;000) | ✗ | 27/01/17 |
| AlPO4 | ICSD | 159272 | Cmcm (63) | ✔ | 12 | 64 | 3 | 6.2169 | 6.335 | 0.000 | (0;000) | ✗ | 05/01/17 |
| KRb2GaF6 | ICSD | 416605 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 6.2312 | 6.231 | 0.000 | (0;000) | ✗ | 27/01/17 |