▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Al2Si2H4O9 | COD | 9009234 | P1 (1) | ✗ | 17 | 72 | 2 | 4.497 | 4.574 | 0.000 | (0;000) | ✗ | 15/02/17 |
Cs3ZnCl5 | COD | 2213127 | I4/mcm (140) | ✔ | 18 | 148 | 1 | 4.4993 | 4.499 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zn(H3C)2 | ICSD | 262113 | P2_1/c (14) | ✔ | 18 | 52 | 2 | 4.5024 | 4.572 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaSeO4 | COD | 8102886 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.5065 | 4.555 | 0.000 | (0;000) | ✗ | 04/08/17 |
PHSF2 | ICSD | 63001 | P2_1/c (14) | ✔ | 20 | 104 | 1 | 4.5103 | 4.510 | 0.000 | (0;000) | ✗ | 02/02/17 |
InBF4 | COD | 1511123 | Pnma (62) | ✔ | 24 | 176 | 1 | 4.5108 | 4.575 | 0.000 | (0;000) | ✗ | 04/08/17 |
KNaSO4 | ICSD | 77343 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 4.5117 | 4.575 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaZnF4 | ICSD | 182607 | Ccm2_1 (36) | ✗ | 12 | 100 | 2 | 4.5127 | 4.584 | 0.000 | (0;000) | ✗ | 06/10/16 |
YScO3 | ICSD | 237285 | Pnma (62) | ✔ | 20 | 160 | 3 | 4.5155 | 4.516 | 0.000 | (0;000) | ✗ | 02/02/17 |
MoF6 | ICSD | 1879 | Im-3m (229) | ✔ | 7 | 56 | 1 | 4.5156 | 4.617 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaCl2 | ICSD | 2190 | P-62m (189) | ✗ | 9 | 72 | 1 | 4.5187 | 4.519 | 0.000 | (0;000) | ✗ | 21/03/17 |
Mg2P2O7 | COD | 1530318 | C2/m (12) | ✔ | 11 | 72 | 3 | 4.5221 | 4.522 | 0.000 | (0;000) | ✗ | 27/01/17 |
C | COD | 9012593 | R-3m (166) | ✔ | 10 | 40 | 3 | 4.5247 | 5.260 | 0.000 | (0;000) | ✗ | 22/03/17 |
KHSeO3 | ICSD | 20862 | P-1 (2) | ✔ | 12 | 68 | 1 | 4.525 | 4.707 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ge3F8 | ICSD | 427896 | P2_1/c (14) | ✔ | 22 | 136 | 3 | 4.5299 | 4.541 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs3LiCl4 | ICSD | 245969 | Cm2m (38) | ✗ | 8 | 58 | 1 | 4.5309 | 4.531 | 0.000 | (0;000) | ✗ | 28/10/16 |
Ba3(AsO4)2 | COD | 9016707 | R-3m (166) | ✔ | 13 | 88 | 1 | 4.531 | 4.737 | 0.000 | (0;000) | ✗ | 30/01/17 |
Na2Mg(CO3)2 | COD | 9009293 | R-3 (148) | ✔ | 11 | 72 | 1 | 4.5324 | 4.554 | 0.000 | (0;000) | ✗ | 27/01/17 |
As(CN)3 | COD | 2310572 | C2 (5) | ✗ | 14 | 64 | 1 | 4.5336 | 4.574 | 0.000 | (0;000) | ✗ | 21/03/17 |
SiO2 | COD | 4124048 | Fddd (70) | ✔ | 24 | 128 | 3 | 4.5379 | 4.538 | 0.000 | (0;000) | ✗ | 04/08/17 |
MgGeO3 | COD | 9003756 | R-3 (148) | ✔ | 10 | 64 | 3 | 4.5416 | 4.571 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaZnF4 | ICSD | 182608 | Pc (7) | ✗ | 24 | 200 | 3 | 4.5419 | 4.639 | 0.000 | (0;000) | ✗ | 04/08/17 |
SbAsF8 | COD | 1533113 | P2_1/m (11) | ✔ | 20 | 132 | 1 | 4.5459 | 4.676 | 0.000 | (0;000) | ✗ | 30/01/17 |
Li2CaGeO4 | ICSD | 19024 | I-42m (121) | ✗ | 8 | 44 | 1 | 4.5502 | 4.765 | 0.000 | (0;000) | ✗ | 15/02/17 |
CaZrSi2O7 | COD | 9004208 | C2 (5) | ✗ | 11 | 64 | 3 | 4.5504 | 4.594 | 0.000 | (0;000) | ✗ | 15/02/17 |