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| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▴ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Pd(SeCl3)2 | ICSD | 39435 | C2/c (15) | ✔ | 18 | 144 | 1 | 1.6214 | 1.627 | 0.000 | (0;000) | ✗ | 02/02/17 |
| C3S8 | COD | 2001128 | P-1 (2) | ✔ | 22 | 120 | 1 | 1.5344 | 1.628 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Cd(GaS2)2 | ICSD | 2286 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.628 | 1.628 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HgO | ICSD | 639125 | P3_221 (154) | ✗ | 6 | 54 | 3 | 1.4576 | 1.628 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CsCuF4 | ICSD | 35264 | I4/mcm (140) | ✔ | 12 | 96 | 3 | 1.5647 | 1.629 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2Ti(CuSe2)2 | COD | 4319683 | P4_2/mcm (132) | ✔ | 18 | 152 | 2 | 1.328 | 1.629 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GaCuO2 | ICSD | 60846 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.9088 | 1.630 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Rb6Br4O | ICSD | 411955 | R-3c (167) | ✔ | 22 | 176 | 1 | 1.6305 | 1.631 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Mg(SbO3)2 | COD | 9015308 | P4_2/mnm (136) | ✔ | 18 | 112 | 3 | 1.632 | 1.632 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Bi2O3 | ICSD | 168815 | Pnab (60) | ✔ | 20 | 112 | 3 | 1.6331 | 1.633 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TlNO2 | ICSD | 50326 | P3_121 (152) | ✗ | 12 | 90 | 1 | 1.5802 | 1.634 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sr3Co(CN)3 | ICSD | 423302 | P6_3/m (176) | ✔ | 20 | 148 | 1 | 1.2302 | 1.634 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2PdS2 | ICSD | 641296 | Immm (71) | ✔ | 5 | 48 | 1 | 1.1239 | 1.634 | 0.000 | (0;000) | ✗ | 27/01/17 |
| VAg2AsO6 | ICSD | 425757 | P-1 (2) | ✔ | 20 | 152 | 3 | 1.624 | 1.635 | 0.000 | (0;000) | ✗ | 30/01/17 |
| WS2 | ICSD | 202367 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8802 | 1.635 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cs2PdC2 | COD | 1526416 | P-3m1 (164) | ✔ | 5 | 44 | 3 | 1.5635 | 1.637 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K2SnO3 | ICSD | 24131 | Pnma (62) | ✔ | 24 | 200 | 2 | 1.6375 | 1.638 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SbSI | ICSD | 28263 | P2_1nb (33) | ✗ | 12 | 72 | 1 | 1.4604 | 1.638 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Nb2Tl5S4Br9 | ICSD | 418796 | Immm (71) | ✔ | 20 | 178 | 2 | 1.627 | 1.638 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GaS | COD | 9008966 | P6_3/mmc (194) | ✔ | 8 | 76 | 2 | 1.5763 | 1.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Cd3(BO3)2 | COD | 2212013 | Pnnm (58) | ✔ | 22 | 156 | 3 | 1.639 | 1.639 | 0.000 | (0;000) | ✗ | 07/08/17 |
| CsCu3O2 | ICSD | 413342 | P-3m1 (164) | ✔ | 6 | 54 | 2 | 1.5592 | 1.641 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr2VN3 | ICSD | 80176 | C2/c (15) | ✔ | 24 | 192 | 1 | 1.6347 | 1.643 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Sr(AuO2)2 | COD | 1510452 | I4_1/a (88) | ✔ | 14 | 112 | 3 | 1.6058 | 1.644 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Hf2SN2 | ICSD | 250914 | Immm (71) | ✔ | 5 | 40 | 3 | 1.62 | 1.644 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TiCoSb | ICSD | 169161 | F-43m (216) | ✗ | 3 | 34 | 3 | 0.9996 | 1.647 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Li8SeN2 | ICSD | 247255 | I4_1md (109) | ✗ | 22 | 80 | 1 | 1.648 | 1.648 | 0.000 | (0;000) | ✗ | 04/08/17 |
| TlBr | COD | 9008825 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 1.2438 | 1.649 | 0.000 | (0;000) | ✗ | 27/01/17 |
| C2S3 | COD | 7006523 | P2_1/c (14) | ✔ | 20 | 104 | 1 | 1.647 | 1.649 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CsAu3S2 | COD | 1510489 | P-3m1 (164) | ✔ | 6 | 54 | 2 | 1.6491 | 1.649 | 0.000 | (0;000) | ✗ | 05/01/17 |
| SnI2 | ICSD | 2831 | C2/m (12) | ✔ | 9 | 84 | 3 | 1.373 | 1.650 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg2P3Cl | ICSD | 74771 | C2/c (15) | ✔ | 12 | 92 | 3 | 1.102 | 1.651 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Nb3AgO8 | COD | 7209349 | Ibam (72) | ✔ | 24 | 196 | 3 | 1.6519 | 1.652 | 0.000 | (0;000) | ✗ | 04/08/17 |
| MoS2 | ICSD | 644259 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.8813 | 1.652 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KClO4 | COD | 1010568 | F-43m (216) | ✗ | 6 | 40 | 1 | 1.6538 | 1.654 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Na4RuH6 | ICSD | 638362 | R-3c (167) | ✔ | 22 | 116 | 1 | 1.6539 | 1.654 | 0.000 | (0;000) | ✗ | 04/08/17 |
| NbTl3Se4 | ICSD | 600249 | I-43m (217) | ✗ | 8 | 76 | 3 | 1.5689 | 1.654 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cs2PdCl4 | COD | 1532214 | Cmcm (63) | ✔ | 14 | 128 | 1 | 1.6548 | 1.655 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AgCNO | ICSD | 260378 | Pmmn (59) | ✔ | 8 | 52 | 3 | 1.449 | 1.655 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NaS | ICSD | 43405 | P-62m (189) | ✗ | 12 | 90 | 1 | 0.8537 | 1.655 | 0.000 | (0;000) | ✗ | 29/03/17 |
| TlI | ICSD | 26761 | Ccmm (63) | ✔ | 4 | 40 | 2 | 1.4715 | 1.656 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K3NbO8 | ICSD | 30405 | I-42m (121) | ✗ | 12 | 88 | 1 | 1.5824 | 1.656 | 0.000 | (0;000) | ✗ | 07/10/16 |
| NaHg2IO2 | COD | 9012531 | P6_222 (180) | ✗ | 18 | 156 | 3 | 1.378 | 1.658 | 0.000 | (0;000) | ✗ | 29/03/17 |
| KAsSe2 | ICSD | 68638 | Cc (9) | ✗ | 16 | 104 | 2 | 1.5358 | 1.658 | 0.000 | (0;000) | ✗ | 21/03/17 |
| SiO2 | ICSD | 155241 | P3_221 (154) | ✗ | 9 | 48 | 3 | 0.4447 | 1.658 | 0.000 | (0;000) | ✔ | 15/02/17 |
| RbIn5S8 | ICSD | 40877 | C2/m (12) | ✔ | 14 | 122 | 3 | 1.5186 | 1.658 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GeI2 | ICSD | 23176 | P-3m1 (164) | ✔ | 9 | 54 | 2 | 1.3784 | 1.659 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaAuF4 | COD | 1510141 | I4/mcm (140) | ✔ | 12 | 96 | 1 | 1.6526 | 1.659 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Si4P4Ru | ICSD | 79006 | P1 (1) | ✗ | 9 | 52 | 3 | 1.442 | 1.660 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CrAg3ClO4 | COD | 8100983 | P4/nmm (129) | ✔ | 18 | 156 | 3 | 1.3301 | 1.661 | 0.000 | (0;000) | ✗ | 30/01/17 |
| RhCl3 | ICSD | 25764 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.5711 | 1.663 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Tl4CdI6 | COD | 4510235 | P4/mnc (128) | ✔ | 22 | 212 | 3 | 1.6639 | 1.664 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Tl2PtCl6 | COD | 1010239 | Fm-3m (225) | ✔ | 9 | 78 | 1 | 1.619 | 1.664 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CuBS2 | ICSD | 156413 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.6658 | 1.666 | 0.000 | (0;000) | ✗ | 07/10/16 |
| KAgO | COD | 1509421 | I4/mmm (139) | ✔ | 12 | 104 | 1 | 1.5553 | 1.666 | 0.000 | (0;000) | ✗ | 30/01/17 |
| ScTlS2 | ICSD | 418474 | P6_3/mmc (194) | ✔ | 8 | 72 | 2 | 0.725 | 1.667 | 0.000 | (0;000) | ✗ | 27/01/17 |
| AgHgSBr | ICSD | 411773 | Pmma (51) | ✔ | 16 | 144 | 3 | 1.4346 | 1.667 | 0.000 | (0;000) | ✗ | 16/03/17 |
| RbI3 | ICSD | 61348 | Pnma (62) | ✔ | 16 | 120 | 1 | 1.6576 | 1.668 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cd2PCl2 | ICSD | 412647 | P2_1/c (14) | ✔ | 20 | 172 | 3 | 1.6678 | 1.668 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CdHg2SO6 | ICSD | 413287 | P-1 (2) | ✔ | 20 | 156 | 3 | 1.5314 | 1.669 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AlPS4 | ICSD | 15910 | P222 (16) | ✗ | 12 | 64 | 2 | 1.5836 | 1.670 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MoS2 | ICSD | 38401 | R3m (160) | ✗ | 3 | 26 | 2 | 0.8476 | 1.670 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TlI | COD | 9008981 | Cmcm (63) | ✔ | 4 | 40 | 2 | 1.4934 | 1.671 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Be4TeO7 | COD | 2106455 | F-43m (216) | ✗ | 12 | 64 | 1 | 1.6716 | 1.672 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Tl4PbI6 | COD | 7221245 | Pbam (55) | ✔ | 22 | 216 | 3 | 1.6709 | 1.674 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Tl2Hg2PdCl8 | ICSD | 203186 | C2/m (12) | ✔ | 13 | 124 | 1 | 1.6229 | 1.675 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2SnBr6 | ICSD | 35557 | P2_1/c (14) | ✔ | 18 | 148 | 1 | 1.6747 | 1.675 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Pt(SCl3)2 | ICSD | 66013 | P-1 (2) | ✔ | 9 | 64 | 1 | 1.6439 | 1.676 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaV2Bi3O10 | ICSD | 88455 | P1 (1) | ✗ | 16 | 140 | 3 | 1.6199 | 1.676 | 0.000 | (0;000) | ✗ | 21/03/17 |
| Tl3Cd2I7 | ICSD | 63340 | Pbam (55) | ✔ | 24 | 224 | 3 | 1.5368 | 1.678 | 0.000 | (0;000) | ✗ | 04/08/17 |
| B6O | COD | 1511635 | R-3m (166) | ✔ | 14 | 48 | 3 | 1.679 | 1.679 | 0.000 | (0;000) | ✗ | 05/01/17 |
| LiCuO | ICSD | 188520 | I-4m2 (119) | ✗ | 12 | 80 | 3 | 1.4772 | 1.679 | 0.000 | (0;000) | ✗ | 07/10/16 |
| Ga2TeSe2 | ICSD | 64617 | I4_1md (109) | ✗ | 10 | 88 | 3 | 1.673 | 1.679 | 0.000 | (0;000) | ✗ | 07/10/16 |
| Ca4TiN4 | COD | 1528590 | P-1 (2) | ✔ | 18 | 144 | 1 | 1.5561 | 1.680 | 0.000 | (0;000) | ✗ | 02/02/17 |
| H8Pt(NCl3)2 | ICSD | 97927 | Fm-3m (225) | ✔ | 17 | 70 | 1 | 1.6827 | 1.683 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cd(GaSe2)2 | ICSD | 619892 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6831 | 1.683 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZnSi(CuS2)2 | ICSD | 236248 | Pc (7) | ✗ | 16 | 124 | 3 | 1.684 | 1.684 | 0.000 | (0;000) | ✗ | 22/03/17 |
| BCl(OF2)2 | ICSD | 60080 | Cc (9) | ✗ | 16 | 100 | 1 | 1.6747 | 1.684 | 0.000 | (0;000) | ✗ | 21/03/17 |
| KHgI3 | COD | 1529983 | Pna2_1 (33) | ✗ | 20 | 168 | 1 | 1.6841 | 1.684 | 0.000 | (0;000) | ✗ | 29/03/17 |
| AgPS3 | COD | 2105351 | C2/m (12) | ✔ | 10 | 68 | 3 | 1.3659 | 1.686 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Ga2HgS4 | ICSD | 25643 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6862 | 1.686 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SbIrS | ICSD | 41400 | P2_13 (198) | ✗ | 12 | 80 | 3 | 1.5396 | 1.688 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InTeCl | ICSD | 21031 | P2_1/c (14) | ✔ | 24 | 208 | 2 | 1.6881 | 1.688 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CsBiS2 | ICSD | 72975 | P2_1/c (14) | ✔ | 16 | 144 | 1 | 1.5688 | 1.689 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BaCuSF | ICSD | 183712 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 1.6889 | 1.689 | 0.000 | (0;000) | ✗ | 05/01/17 |
| IrCl3 | ICSD | 23171 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.6895 | 1.690 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BP | ICSD | 615155 | P6_3mc (186) | ✗ | 4 | 16 | 1 | 1.5643 | 1.691 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiPbO3 | COD | 9011193 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 1.6718 | 1.692 | 0.000 | (0;000) | ✗ | 27/01/17 |
| TlV3O8 | COD | 9007733 | P2_1/m (11) | ✔ | 24 | 200 | 3 | 1.6922 | 1.692 | 0.000 | (0;000) | ✗ | 04/08/17 |
| WSCl4 | ICSD | 16125 | P-1 (2) | ✔ | 12 | 124 | 1 | 1.6929 | 1.693 | 0.000 | (0;000) | ✗ | 11/04/17 |
| Zn2IN | ICSD | 425735 | Pnma (62) | ✔ | 16 | 144 | 3 | 1.6574 | 1.693 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba3BAsO3 | ICSD | 402682 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 1.3926 | 1.694 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Na2B2Se7 | COD | 1510772 | C2/c (15) | ✔ | 22 | 132 | 3 | 1.5748 | 1.694 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ga2HgS4 | ICSD | 189738 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6944 | 1.694 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ICl | COD | 9008992 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 1.6268 | 1.696 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Tl2GeS3 | ICSD | 2240 | P-1 (2) | ✔ | 12 | 96 | 1 | 1.5977 | 1.697 | 0.000 | (0;000) | ✗ | 02/02/17 |
| IrCl3 | ICSD | 25716 | Fddd (70) | ✔ | 16 | 152 | 3 | 1.6687 | 1.699 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Hg(AsO3)2 | COD | 8101392 | P-31m (162) | ✔ | 9 | 58 | 3 | 0.9726 | 1.700 | 0.000 | (0;000) | ✗ | 05/01/17 |
| KAgO | ICSD | 25744 | I-4 (82) | ✗ | 12 | 104 | 1 | 1.4553 | 1.701 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiGePt | ICSD | 188965 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.7725 | 1.701 | 0.000 | (0;000) | ✗ | 15/02/17 |