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| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| LiP5 | ICSD | 88710 | Pna2_1 (33) | ✗ | 24 | 112 | 1 | 1.2082 | 1.218 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Mo3Pt2N | ICSD | 150314 | P4_132 (213) | ✗ | 24 | 268 | 3 | 0.0 | 0.000 | 0.464 | ? | ✗ | 04/08/17 |
| NbTe4Os | ICSD | 656450 | Pmn2_1 (31) | ✗ | 24 | 212 | 2 | 0.0 | 0.000 | 0.826 | ? | ✗ | 04/08/17 |
| SiO2 | COD | 4124053 | P-4n2 (118) | ✗ | 24 | 128 | 3 | 5.6077 | 5.660 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Zn2SiO5 | COD | 9015618 | Imm2 (44) | ✗ | 16 | 116 | 3 | 0.0 | 0.005 | 0.337 | ? | ✗ | 04/08/17 |
| SiP | ICSD | 87149 | Cmc2_1 (36) | ✗ | 24 | 108 | 2 | 1.1331 | 1.265 | 0.000 | (0;000) | ✗ | 04/08/17 |
| ScAgSn | COD | 4307155 | Ima2 (46) | ✗ | 18 | 216 | 3 | 0.0 | 0.007 | 0.391 | ? | ✗ | 07/08/17 |
| Cd4SiS6 | COD | 1527686 | Cc (9) | ✗ | 22 | 176 | 3 | 1.5312 | 1.531 | 0.000 | (0;000) | ✗ | 07/08/17 |
| K6CdO4 | ICSD | 62053 | P6_3mc (186) | ✗ | 22 | 180 | 3 | 1.6958 | 1.709 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Cs4O7 | COD | 1010172 | I-43d (220) | ✗ | 22 | 156 | 1 | 0.0 | 0.000 | 0.455 | ? | ✗ | 07/08/17 |
| K6MnS4 | ICSD | 65448 | P6_3mc (186) | ✗ | 22 | 186 | 1 | 0.0 | 0.000 | 0.494 | ? | ✗ | 07/08/17 |
| Na6P4W | ICSD | 71647 | P6_3mc (186) | ✗ | 22 | 204 | 1 | 1.2298 | 1.264 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Y7Rh3 | ICSD | 650528 | P6_3mc (186) | ✗ | 20 | 256 | 3 | 0.0 | 0.000 | 0.293 | ? | ✗ | 07/08/17 |
| CdI2 | ICSD | 35446 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9825 | 2.158 | 0.000 | (0;000) | ✗ | 04/08/17 |
| IOF3 | ICSD | 4076 | P2_12_12_1 (19) | ✗ | 20 | 136 | 1 | 3.7853 | 3.792 | 0.000 | (0;000) | ✗ | 22/03/17 |
| CdI2 | ICSD | 42209 | P3m1 (156) | ✗ | 15 | 130 | 1 | 1.9483 | 2.182 | 0.000 | (0;000) | ✗ | 22/03/17 |
| ZnS | ICSD | 15740 | P3m1 (156) | ✗ | 20 | 180 | 3 | 2.0771 | 2.077 | 0.000 | (0;000) | ✗ | 29/03/17 |
| CdI2 | ICSD | 42303 | P3m1 (156) | ✗ | 21 | 182 | 1 | 1.9895 | 2.174 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Y3TaO7 | COD | 1525169 | C222_1 (20) | ✗ | 22 | 176 | 3 | 2.5659 | 2.566 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Na6MnSe4 | ICSD | 65449 | P6_3mc (186) | ✗ | 22 | 186 | 1 | 0.0 | 0.000 | 0.595 | ? | ✗ | 07/08/17 |
| Sr4I6O | COD | 2200256 | P6_3mc (186) | ✗ | 22 | 176 | 1 | 3.1042 | 3.104 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Na6CoSe4 | ICSD | 68604 | P6_3mc (186) | ✗ | 22 | 190 | 1 | 0.0 | 0.000 | 0.795 | ? | ✗ | 07/08/17 |
| CdI2 | ICSD | 30813 | P3m1 (156) | ✗ | 21 | 182 | 1 | 1.9735 | 2.176 | 0.000 | (0;000) | ✗ | 07/08/17 |
| In5S5Br | ICSD | 414219 | Pmn2_1 (31) | ✗ | 22 | 204 | 3 | 1.0705 | 1.216 | 0.000 | (0;000) | ✗ | 07/08/17 |
| TaTe4Rh | ICSD | 656453 | Pmn2_1 (31) | ✗ | 24 | 216 | 2 | 0.0 | 0.002 | 0.118 | ? | ✗ | 04/08/17 |
| TaTe4Os | ICSD | 656454 | Pmn2_1 (31) | ✗ | 24 | 212 | 2 | 0.0 | 0.001 | 0.826 | ? | ✗ | 04/08/17 |
| SiO2 | COD | 4124081 | P4_322 (95) | ✗ | 24 | 128 | 3 | 0.6038 | 0.604 | 0.000 | (0;000) | ✗ | 04/08/17 |
| V3Zn2N | ICSD | 644866 | P4_132 (213) | ✗ | 24 | 272 | 3 | 0.0 | 0.026 | 0.128 | ? | ✗ | 04/08/17 |
| Nb3RhSe6 | ICSD | 645284 | P6_322 (182) | ✗ | 20 | 184 | 3 | 0.0 | 0.013 | 0.229 | ? | ✗ | 04/08/17 |
| MgZn | ICSD | 151402 | Imm2 (44) | ✗ | 24 | 264 | 3 | 0.0 | 0.008 | 0.770 | ? | ✗ | 04/08/17 |
| Li8SeN2 | ICSD | 247255 | I4_1md (109) | ✗ | 22 | 80 | 1 | 1.648 | 1.648 | 0.000 | (0;000) | ✗ | 04/08/17 |
| NaI3O8 | ICSD | 418336 | P-4 (81) | ✗ | 24 | 156 | 2 | 3.3231 | 3.422 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ga4SnSe7 | COD | 4001921 | Pc (7) | ✗ | 24 | 216 | 3 | 1.7428 | 1.744 | 0.000 | (0;000) | ✗ | 04/08/17 |
| K3FeO2 | COD | 1517825 | P4_12_12 (92) | ✗ | 24 | 188 | 2 | 0.0 | 0.000 | 0.445 | ? | ✗ | 04/08/17 |
| RbCuSe4 | ICSD | 404225 | P2_12_12_1 (19) | ✗ | 24 | 176 | 1 | 1.0816 | 1.103 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Re2W3C | ICSD | 77384 | P4_132 (213) | ✗ | 24 | 472 | 3 | 0.0 | 0.001 | 0.702 | ? | ✗ | 04/08/17 |
| NaGaCl4 | ICSD | 425228 | P2_12_12_1 (19) | ✗ | 24 | 200 | 1 | 4.437 | 4.438 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SbCl3F2 | ICSD | 380014 | I-4 (82) | ✗ | 24 | 160 | 1 | 1.5218 | 1.557 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SCl2 | ICSD | 38351 | P2_12_12_1 (19) | ✗ | 24 | 160 | 1 | 2.017 | 2.049 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CdI2 | ICSD | 108919 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9051 | 2.100 | 0.000 | (0;000) | ✗ | 04/08/17 |
| H10C7O5 | COD | 7218172 | P1 (1) | ✗ | 22 | 68 | 1 | 4.6528 | 4.703 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Sr4Br6O | ICSD | 418452 | P6_3mc (186) | ✗ | 22 | 176 | 1 | 4.3606 | 4.361 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Li2BPd3 | COD | 1511224 | P4_332 (212) | ✗ | 24 | 252 | 3 | 0.0 | 0.000 | 0.557 | ? | ✗ | 04/08/17 |
| BaHgO2 | COD | 2002491 | P6_322 (182) | ✗ | 24 | 204 | 1 | 2.1697 | 2.247 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Zn4B6O13 | COD | 1511638 | I-43m (217) | ✗ | 23 | 144 | 3 | 3.3838 | 3.384 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CaB4O7 | COD | 7209486 | Pmn2_1 (31) | ✗ | 24 | 128 | 3 | 6.4573 | 6.760 | 0.000 | (0;000) | ✗ | 04/08/17 |
| AsS2 | ICSD | 424590 | P2_1 (4) | ✗ | 24 | 136 | 2 | 1.2111 | 1.211 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BaAl4Se7 | COD | 7015593 | Pc (7) | ✗ | 24 | 128 | 3 | 2.4123 | 2.412 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ag3PSe4 | COD | 1510029 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.0 | 0.028 | 0.178 | ? | ✗ | 04/08/17 |
| V4GeS8 | ICSD | 50502 | F-43m (216) | ✗ | 13 | 104 | 3 | 0.0 | 0.000 | 0.188 | (0;000) | ✔ | 26/04/17 |
| CaPPt | ICSD | 60826 | Pmc2_1 (26) | ✗ | 12 | 100 | 3 | 0.0 | 0.011 | 0.164 | (0;000) | ✔ | 26/04/17 |
| Al4Cu2O7 | COD | 2002328 | F-43m (216) | ✗ | 13 | 76 | 3 | 0.0 | 0.000 | 0.247 | (1;000) | ✔ | 26/04/17 |
| Ge3Ru2 | ICSD | 95589 | P-4c2 (116) | ✗ | 20 | 176 | 3 | 0.3075 | 0.314 | 0.000 | (0;000) | ✔ | 24/04/17 |
| Ag2SnHgSe4 | ICSD | 95094 | Pmn2_1 (31) | ✗ | 16 | 144 | 3 | 0.0 | 0.042 | 0.026 | (1;000) | ✔ | 24/04/17 |
| BaSi2 | ICSD | 2218 | P4_332 (212) | ✗ | 12 | 72 | 3 | 0.0 | 0.008 | 0.016 | (0;000) | ✔ | 13/04/17 |
| Sb2WO6 | ICSD | 75595 | P1 (1) | ✗ | 18 | 148 | 3 | 0.0 | 1.132 | 1.000 | ? | ✗ | 11/04/17 |
| GePt2 | ICSD | 637640 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.0 | 0.000 | 0.334 | (0;000) | ✔ | 11/04/17 |
| Li2MoF6 | COD | 2101133 | P4_22_12 (94) | ✗ | 18 | 124 | 1 | 0.0 | 0.004 | 0.142 | (0;000) | ✔ | 11/04/17 |
| CsIn3 | COD | 1524224 | I-4m2 (119) | ✗ | 12 | 144 | 3 | 0.0 | 0.239 | 0.019 | (0;000) | ✔ | 11/04/17 |
| Ca2FeWO6 | ICSD | 81204 | Pmm2 (25) | ✗ | 20 | 184 | 3 | 0.5589 | 0.594 | 0.000 | (0;000) | ✗ | 11/04/17 |
| FeSi(AgS2)2 | ICSD | 425760 | Pc (7) | ✗ | 16 | 116 | 3 | 0.0 | 0.004 | 0.400 | (1;010) | ✔ | 11/04/17 |
| KTe | ICSD | 73178 | P-62m (189) | ✗ | 12 | 90 | 1 | 0.0 | 0.589 | 0.294 | (0;000) | ✔ | 10/04/17 |
| ZnS | COD | 9013162 | P6_3mc (186) | ✗ | 12 | 108 | 3 | 2.1312 | 2.131 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnSnSb2 | ICSD | 651588 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.008 | 0.020 | (1;000) | ✔ | 29/03/17 |
| TaSiRu | ICSD | 600058 | Ima2 (46) | ✗ | 18 | 198 | 3 | 0.0 | 0.000 | 0.758 | ? | ✗ | 29/03/17 |
| Rb2SnTe5 | ICSD | 40556 | I4cm (108) | ✗ | 16 | 124 | 1 | 0.5921 | 0.592 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Y7Pt3 | ICSD | 649860 | P6_3mc (186) | ✗ | 20 | 214 | 3 | 0.0 | 0.000 | 0.521 | ? | ✗ | 29/03/17 |
| RbVP2S7 | ICSD | 73782 | C2 (5) | ✗ | 11 | 74 | 2 | 0.0 | 0.011 | 0.754 | ? | ✗ | 29/03/17 |
| Te2SO7 | ICSD | 28468 | Pmn2_1 (31) | ✗ | 20 | 120 | 3 | 2.0951 | 2.120 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Rb4O3 | COD | 9014100 | I-43d (220) | ✗ | 14 | 108 | 1 | 0.0 | 0.000 | 0.570 | ? | ✗ | 29/03/17 |
| SiO2 | ICSD | 154321 | P2_1 (4) | ✗ | 12 | 64 | 1 | 0.0 | 0.002 | 0.694 | ? | ✗ | 29/03/17 |
| NaP | COD | 1528277 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 0.8664 | 0.916 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnS4 | ICSD | 42035 | P-42_1c (114) | ✗ | 18 | 148 | 1 | 2.2298 | 2.230 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4ReN3 | ICSD | 411243 | Cc (9) | ✗ | 16 | 132 | 1 | 2.236 | 2.312 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnTeMoO6 | ICSD | 250523 | P2_12_12 (18) | ✗ | 18 | 136 | 2 | 3.0362 | 3.097 | 0.000 | (0;000) | ✗ | 29/03/17 |
| MgSO9 | COD | 9015164 | R3 (146) | ✗ | 11 | 70 | 1 | 0.0 | 0.003 | 0.521 | ? | ✗ | 29/03/17 |
| Mg2Ni | COD | 1008171 | P6_222 (180) | ✗ | 18 | 180 | 3 | 0.0 | 0.000 | 0.686 | ? | ✗ | 29/03/17 |
| Li2Sb | COD | 7221229 | P-62c (190) | ✗ | 18 | 66 | 1 | 0.0 | 0.000 | 0.835 | ? | ✗ | 29/03/17 |
| KSb(PSe3)2 | ICSD | 90152 | P2_1 (4) | ✗ | 20 | 120 | 3 | 1.769 | 1.795 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Zr3Ir | COD | 2020030 | I-42m (121) | ✗ | 16 | 116 | 3 | 0.0 | 0.005 | 0.664 | ? | ✗ | 29/03/17 |
| Mn3SiIr | ICSD | 151749 | P2_13 (198) | ✗ | 20 | 264 | 3 | 0.0 | 0.001 | 0.472 | ? | ✗ | 29/03/17 |
| NaIO3 | COD | 1530808 | Pna2_1 (33) | ✗ | 20 | 136 | 1 | 2.1927 | 2.211 | 0.000 | (0;000) | ✗ | 29/03/17 |
| K2ReI6 | COD | 4313464 | Pc (7) | ✗ | 18 | 150 | 1 | 0.0 | 0.000 | 0.860 | ? | ✗ | 29/03/17 |
| K3MoHS4O | ICSD | 425985 | Pmn2_1 (31) | ✗ | 20 | 144 | 1 | 2.0081 | 2.008 | 0.000 | (0;000) | ✗ | 29/03/17 |
| KHgI3 | COD | 1529983 | Pna2_1 (33) | ✗ | 20 | 168 | 1 | 1.6841 | 1.684 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Hf3Sb | ICSD | 638878 | I-4 (82) | ✗ | 16 | 164 | 3 | 0.0 | 0.046 | 0.486 | ? | ✗ | 29/03/17 |
| PH2NO4 | ICSD | 76970 | I-42d (122) | ✗ | 16 | 72 | 3 | 0.0 | 0.004 | 0.269 | (1;000) | ✔ | 29/03/17 |
| GePtS | ICSD | 637647 | Pca2_1 (29) | ✗ | 12 | 80 | 3 | 0.708 | 0.880 | 0.000 | (0;000) | ✗ | 22/03/17 |
| GePb3O5 | COD | 9008276 | P2_1 (4) | ✗ | 18 | 152 | 3 | 2.1034 | 2.107 | 0.000 | (0;000) | ✗ | 22/03/17 |
| KGeNO | ICSD | 60002 | Pca2_1 (29) | ✗ | 16 | 96 | 1 | 3.0607 | 3.061 | 0.000 | (0;000) | ✗ | 22/03/17 |
| K2Hg3(GeS4)2 | ICSD | 281506 | C2 (5) | ✗ | 15 | 110 | 3 | 1.5376 | 2.063 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Mg2Ga | COD | 1523635 | P-62c (190) | ✗ | 18 | 198 | 3 | 0.0 | 0.000 | 0.702 | ? | ✗ | 22/03/17 |
| V3Ga2 | ICSD | 635637 | P4_132 (213) | ✗ | 20 | 260 | 3 | 0.0 | 0.000 | 0.564 | ? | ✗ | 22/03/17 |
| TiFeSi | ICSD | 633588 | Ima2 (46) | ✗ | 18 | 144 | 3 | 0.0 | 0.016 | 0.521 | ? | ✗ | 22/03/17 |
| NaFeO2 | ICSD | 186309 | Pna2_1 (33) | ✗ | 16 | 116 | 3 | 0.0 | 0.000 | 0.554 | ? | ✗ | 22/03/17 |
| Fe2O | COD | 2101926 | P4mm (99) | ✗ | 3 | 22 | 1 | 0.0 | 0.000 | 0.526 | ? | ✗ | 22/03/17 |
| Na3FeF6 | COD | 1530372 | P2_1 (4) | ✗ | 20 | 154 | 1 | 0.0 | 0.000 | 0.753 | ? | ✗ | 22/03/17 |
| PbF3 | ICSD | 23467 | P-4c2 (116) | ✗ | 16 | 140 | 3 | 0.6313 | 0.631 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Pb2OF2 | ICSD | 76964 | P-4m2 (115) | ✗ | 20 | 192 | 3 | 0.0 | 0.003 | 0.052 | (0;000) | ✔ | 22/03/17 |
| InCuTe2 | ICSD | 73352 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.010 | 0.012 | (0;000) | ✔ | 22/03/17 |