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| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ScSn2 | ICSD | 106965 | I4_1/amd (141) | ✔ | 12 | 156 | 3 | 0.0 | 0.007 | 0.811 | (1;111) | ✗ | 29/03/17 |
| Cu(SbO3)2 | COD | 9012740 | P2_1/c (14) | ✔ | 18 | 114 | 3 | 0.0 | 0.000 | 0.944 | (0;010) | ✗ | 27/01/17 |
| InCuO2 | COD | 1531594 | P6_3/mmc (194) | ✔ | 8 | 72 | 3 | 0.1846 | 0.515 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ta3VSe6 | ICSD | 651970 | P6_322 (182) | ✗ | 20 | 176 | 3 | 0.0 | 0.000 | 0.550 | ? | ✗ | 29/03/17 |
| TiSe | ICSD | 652055 | R-3m (166) | ✔ | 8 | 72 | 3 | 0.0 | 0.012 | 0.693 | (1;000) | ✗ | 29/03/17 |
| TiV4Si3 | ICSD | 652443 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 0.0 | 0.000 | 0.655 | (1;000) | ✗ | 29/03/17 |
| Ti2Sn3 | COD | 4000005 | Cmce (64) | ✔ | 20 | 264 | 3 | 0.0 | 0.010 | 0.504 | (1;110) | ✗ | 29/03/17 |
| CdTe | ICSD | 108237 | Pm2m (25) | ✗ | 2 | 18 | 3 | 0.0 | 0.032 | 0.374 | (0;110) | ✔ | 06/10/16 |
| TiS | COD | 9015328 | R-3m (166) | ✔ | 6 | 54 | 3 | 0.0 | 0.005 | 0.828 | (1;111) | ✗ | 29/03/17 |
| V3S | ICSD | 26515 | I-42m (121) | ✗ | 16 | 180 | 3 | 0.0 | 0.002 | 0.642 | ? | ✗ | 29/03/17 |
| ZnS | ICSD | 107134 | P3m1 (156) | ✗ | 16 | 144 | 3 | 2.1006 | 2.101 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnS | ICSD | 15740 | P3m1 (156) | ✗ | 20 | 180 | 3 | 2.0771 | 2.077 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnS | COD | 9000085 | P6_3mc (186) | ✗ | 20 | 180 | 3 | 2.0884 | 2.088 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnS | ICSD | 107133 | P3m1 (156) | ✗ | 16 | 144 | 3 | 2.0809 | 2.081 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnS | COD | 9000086 | P6_3mc (186) | ✗ | 16 | 144 | 3 | 2.1007 | 2.101 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ZnS | COD | 9013162 | P6_3mc (186) | ✗ | 12 | 108 | 3 | 2.1312 | 2.131 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Ta | ICSD | 54206 | P-42_1m (113) | ✗ | 22 | 286 | 3 | 0.0 | 0.000 | 0.850 | ? | ✗ | 29/03/17 |
| ZrTc2 | COD | 1501466 | P6_3/mmc (194) | ✔ | 12 | 136 | 3 | 26.7426 | 0.012 | 1.000 | (0;000) | ✗ | 29/03/17 |
| Sn(HgSe2)2 | ICSD | 95061 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.2537 | 0.254 | 0.000 | (0;000) | ✔ | 06/10/16 |
| Tl2Te3 | ICSD | 26282 | Cc (9) | ✗ | 10 | 88 | 3 | 0.0 | 0.015 | 1.000 | ? | ✗ | 29/03/17 |
| TlTe | COD | 1521987 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 2.2939 | 0.010 | 1.000 | (0;000) | ✗ | 29/03/17 |
| Y3Tl5 | ICSD | 653335 | Cmcm (63) | ✔ | 16 | 196 | 3 | 2.9751 | 0.014 | 1.000 | (0;000) | ✗ | 29/03/17 |
| W | COD | 9008583 | Pm-3n (223) | ✔ | 8 | 112 | 3 | 0.0 | 0.008 | 1.000 | (1;000) | ✗ | 29/03/17 |
| ScAu | COD | 1510291 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.714 | (0;111) | ✗ | 05/01/17 |
| HfSi2Cu | ICSD | 87174 | P4/nmm (129) | ✔ | 8 | 62 | 3 | 0.0 | 0.000 | 0.899 | (1;000) | ✗ | 27/01/17 |
| KIO3 | ICSD | 247719 | R3 (146) | ✗ | 10 | 68 | 3 | 1.9552 | 1.956 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Mn3GeC | ICSD | 25775 | I4/mcm (140) | ✔ | 10 | 106 | 3 | 0.0 | 0.000 | 0.840 | (0;000) | ✗ | 27/01/17 |
| TaCuN2 | COD | 4030363 | R-3m (166) | ✔ | 4 | 34 | 3 | 0.8763 | 1.447 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CuH2SO5 | ICSD | 68184 | P-1 (2) | ✔ | 18 | 98 | 3 | 0.0 | 0.020 | 0.095 | (0;011) | ✗ | 27/01/17 |
| KIO3 | ICSD | 28545 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.091 | 0.116 | (1;111) | ✗ | 30/01/17 |
| ZrNi | ICSD | 105478 | Ccmm (63) | ✔ | 4 | 44 | 3 | 0.0 | 0.007 | 0.409 | (1;000) | ✗ | 06/10/16 |
| Y3GaC | ICSD | 56396 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.111 | (1;000) | ✗ | 27/01/17 |
| Y2Sn5Rh3 | COD | 1522512 | Cmc2_1 (36) | ✗ | 20 | 286 | 3 | 0.0 | 0.000 | 0.972 | ? | ✗ | 10/04/17 |
| SiRh | ICSD | 79233 | P2_13 (198) | ✗ | 8 | 84 | 3 | 0.0 | 0.000 | 0.247 | (1;111) | ✔ | 10/04/17 |
| SnRh | COD | 7221174 | P2_13 (198) | ✗ | 8 | 124 | 3 | 0.0 | 0.000 | 0.365 | (0;100) | ✔ | 10/04/17 |
| Tl5Te3 | ICSD | 604388 | I-4 (82) | ✗ | 16 | 166 | 3 | 0.0 | 0.009 | 1.000 | ? | ✗ | 10/04/17 |
| FeSi(AgS2)2 | ICSD | 425760 | Pc (7) | ✗ | 16 | 116 | 3 | 0.0 | 0.004 | 0.400 | (1;010) | ✔ | 11/04/17 |
| KIO3 | ICSD | 424864 | R3 (146) | ✗ | 10 | 68 | 3 | 2.2905 | 2.302 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TlBr | ICSD | 61519 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 1.7789 | 1.779 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Al4W | ICSD | 58205 | Cm (8) | ✗ | 15 | 120 | 3 | 0.0 | 0.008 | 0.676 | ? | ✗ | 11/04/17 |
| AlBW | COD | 4343329 | Cmcm (63) | ✔ | 6 | 68 | 3 | 0.0 | 0.097 | 0.225 | (1;110) | ✗ | 11/04/17 |
| As3W2 | ICSD | 43185 | C2/m (12) | ✔ | 10 | 142 | 3 | 0.0 | 0.009 | 0.309 | (0;111) | ✗ | 11/04/17 |
| CaAsPt | ICSD | 60828 | I4_1md (109) | ✗ | 18 | 150 | 3 | 0.0 | 0.000 | 0.945 | ? | ✗ | 11/04/17 |
| Fe(BW)2 | ICSD | 614261 | Immm (71) | ✔ | 5 | 70 | 3 | 0.0 | 0.045 | 0.291 | (1;000) | ✗ | 11/04/17 |
| Fe(BW)2 | COD | 1510686 | P4/mbm (127) | ✔ | 10 | 140 | 3 | 0.0 | 0.012 | 0.601 | (1;000) | ✗ | 11/04/17 |
| Ni(BW)2 | ICSD | 615069 | Immm (71) | ✔ | 5 | 72 | 3 | 0.0 | 0.116 | 0.039 | (1;000) | ✗ | 11/04/17 |
| B2OsW2 | ICSD | 615145 | Pnnm (58) | ✔ | 20 | 312 | 3 | 0.0 | 0.004 | 0.815 | (1;110) | ✗ | 11/04/17 |
| B2W | COD | 1510852 | P6_3/mmc (194) | ✔ | 12 | 136 | 3 | 0.0 | 0.043 | 0.756 | (0;000) | ✗ | 11/04/17 |
| Co(BW)3 | COD | 1510898 | Cmcm (63) | ✔ | 14 | 220 | 3 | 0.0 | 0.011 | 0.418 | (0;110) | ✗ | 11/04/17 |
| Ni(BW)3 | ICSD | 615070 | Cmcm (63) | ✔ | 14 | 206 | 3 | 0.0 | 0.000 | 0.737 | (0;110) | ✗ | 11/04/17 |
| B4W | ICSD | 615683 | P4/mbm (127) | ✔ | 20 | 160 | 3 | 0.0 | 0.005 | 0.388 | (1;000) | ✗ | 11/04/17 |
| B4W | COD | 2310108 | P6_3/mmc (194) | ✔ | 20 | 160 | 3 | 0.0 | 0.018 | 0.540 | (1;000) | ✗ | 11/04/17 |
| LiInO2 | ICSD | 639886 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 1.4431 | 1.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li2InIr | ICSD | 639824 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.005 | 0.483 | (1;000) | ✗ | 27/01/17 |
| FeBW | ICSD | 614256 | Pnma (62) | ✔ | 12 | 156 | 3 | 0.0 | 0.001 | 0.589 | (0;011) | ✗ | 11/04/17 |
| Cu(BiO2)2 | COD | 2002233 | I4 (79) | ✗ | 14 | 130 | 3 | 0.0 | 0.015 | 0.180 | (0;000) | ✔ | 11/04/17 |
| Bi2WO6 | COD | 1528731 | C2/m (12) | ✔ | 18 | 188 | 3 | 1.9362 | 2.313 | 0.000 | (0;000) | ✗ | 11/04/17 |
| InCuO2 | COD | 1521924 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.441 | 0.804 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CuBi(WO4)2 | ICSD | 67569 | P1 (1) | ✗ | 12 | 130 | 3 | 0.9085 | 0.914 | 0.000 | (0;000) | ✗ | 11/04/17 |
| BiRhSe | ICSD | 617014 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.1987 | 0.640 | 0.000 | (0;000) | ✔ | 11/04/17 |
| BW2 | COD | 1511333 | I4/mcm (140) | ✔ | 6 | 118 | 3 | 0.0 | 0.000 | 0.564 | (1;000) | ✗ | 11/04/17 |
| BW | ICSD | 615689 | Cmcm (63) | ✔ | 4 | 62 | 3 | 0.0 | 0.000 | 0.723 | (0;110) | ✗ | 11/04/17 |
| YWC2 | ICSD | 619103 | Pnma (62) | ✔ | 16 | 188 | 3 | 0.0 | 0.000 | 0.538 | (0;011) | ✗ | 11/04/17 |
| Ca2FeWO6 | ICSD | 81204 | Pmm2 (25) | ✗ | 20 | 184 | 3 | 0.5589 | 0.594 | 0.000 | (0;000) | ✗ | 11/04/17 |
| Ca2GePd2 | COD | 4002144 | Fdd2 (43) | ✗ | 10 | 120 | 3 | 0.0 | 0.051 | 0.309 | (0;000) | ✔ | 11/04/17 |
| SiNi2 | ICSD | 105342 | P6_3/mmc (194) | ✔ | 6 | 48 | 3 | 0.0 | 0.004 | 0.711 | (0;000) | ✗ | 06/10/16 |
| CaWO4 | ICSD | 193048 | C2/c (15) | ✔ | 12 | 124 | 3 | 3.8738 | 3.874 | 0.000 | (0;000) | ✗ | 11/04/17 |
| AgI | ICSD | 56557 | P2_1/m (11) | ✔ | 4 | 36 | 3 | 0.3263 | 1.617 | 0.000 | (0;000) | ✔ | 06/10/16 |
| CdWO4 | COD | 9013915 | P2/c (13) | ✔ | 12 | 128 | 3 | 3.1821 | 3.229 | 0.000 | (0;000) | ✗ | 11/04/17 |
| Sr2CdWO6 | ICSD | 71840 | Pmm2 (25) | ✗ | 20 | 192 | 3 | 2.9479 | 3.050 | 0.000 | (0;000) | ✗ | 11/04/17 |
| BN | ICSD | 162874 | F-43m (216) | ✗ | 2 | 8 | 3 | 4.4968 | 8.945 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Sc3SnB | COD | 1511324 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.112 | (1;000) | ✗ | 27/01/17 |
| Ta2B | COD | 1511330 | I4/mcm (140) | ✔ | 6 | 58 | 3 | 0.0 | 0.000 | 0.603 | (0;111) | ✗ | 27/01/17 |
| LiIn | ICSD | 639880 | Fd-3m (227) | ✔ | 4 | 32 | 3 | 0.0 | 0.000 | 0.232 | (0;000) | ✗ | 27/01/17 |
| Ni3Sn | ICSD | 646747 | Pmmn (59) | ✔ | 8 | 88 | 3 | 0.0 | 0.014 | 0.443 | (0;010) | ✗ | 27/01/17 |
| TaB | COD | 2310099 | Cmcm (63) | ✔ | 4 | 32 | 3 | 0.0 | 0.035 | 0.321 | (1;000) | ✗ | 27/01/17 |
| TiB | COD | 9008946 | Pnma (62) | ✔ | 8 | 60 | 3 | 0.0 | 0.000 | 0.817 | (0;011) | ✗ | 27/01/17 |
| HfSiCu | ICSD | 627916 | Pnma (62) | ✔ | 12 | 108 | 3 | 0.0 | 0.000 | 0.320 | (0;011) | ✗ | 27/01/17 |
| FeWClO4 | ICSD | 80798 | P4/nmm (129) | ✔ | 14 | 134 | 3 | 0.0 | 0.000 | 0.627 | (0;000) | ✗ | 11/04/17 |
| LiIO3 | ICSD | 20012 | P6_322 (182) | ✗ | 10 | 56 | 3 | 0.0 | 0.562 | 0.201 | (0;000) | ✔ | 06/10/16 |
| Co3SiW2 | ICSD | 625123 | P6_3/mmc (194) | ✔ | 12 | 222 | 3 | 0.0 | 0.000 | 0.794 | (0;000) | ✗ | 11/04/17 |
| CoPW | ICSD | 624662 | Pnma (62) | ✔ | 12 | 200 | 3 | 0.0 | 0.026 | 0.137 | (0;000) | ✗ | 11/04/17 |
| CS2 | COD | 9014813 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 0.2875 | 0.641 | 0.000 | (0;000) | ✔ | 11/04/17 |
| SiC | ICSD | 24631 | R3m (160) | ✗ | 18 | 72 | 3 | 1.531 | 2.768 | 0.000 | (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 |
| SiCu2HgTe4 | ICSD | 656152 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.014 | 0.110 | (1;000) | ✔ | 11/04/17 |
| Mg(AlC)2 | COD | 4030910 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 1.602 | 2.609 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Nb3In | ICSD | 51996 | Pm-3n (223) | ✔ | 8 | 104 | 3 | 0.0 | 0.003 | 0.746 | (0;000) | ✗ | 27/01/17 |
| CuWO3F2 | ICSD | 60759 | P2_1/m (11) | ✔ | 14 | 142 | 3 | 0.0 | 0.000 | 0.474 | (0;010) | ✗ | 11/04/17 |
| GaCuO2 | COD | 4342352 | Pna2_1 (33) | ✗ | 16 | 144 | 3 | 0.0321 | 0.033 | 0.000 | (0;000) | ✔ | 11/04/17 |
| MnInO3 | ICSD | 67671 | P6_3/mmc (194) | ✔ | 10 | 92 | 3 | 0.0 | 0.013 | 0.600 | (0;000) | ✗ | 27/01/17 |
| CuWO4 | COD | 4000807 | P2/c (13) | ✔ | 12 | 126 | 3 | 0.0 | 0.000 | 0.602 | (0;000) | ✗ | 11/04/17 |
| CuWO4 | COD | 4000809 | P-1 (2) | ✔ | 12 | 126 | 3 | 0.0 | 0.030 | 0.340 | (1;011) | ✗ | 11/04/17 |
| YCu(WO4)2 | ICSD | 36622 | P1 (1) | ✗ | 12 | 126 | 3 | 1.0866 | 1.304 | 0.000 | (0;000) | ✗ | 11/04/17 |
| W2C | ICSD | 108194 | Pbcn (60) | ✔ | 12 | 240 | 3 | 0.0 | 0.024 | 0.397 | (1;000) | ✗ | 11/04/17 |
| InCuPt2 | ICSD | 108380 | P4/mmm (123) | ✔ | 4 | 44 | 3 | 0.0 | 0.002 | 0.230 | (0;000) | ✗ | 27/01/17 |
| W2C | ICSD | 619097 | P-3m1 (164) | ✔ | 3 | 60 | 3 | 0.0 | 0.098 | 0.530 | (0;000) | ✗ | 11/04/17 |
| LiIO3 | ICSD | 35472 | P6_3 (173) | ✗ | 10 | 56 | 3 | 0.4539 | 0.635 | 0.000 | (0;000) | ✔ | 06/10/16 |
| Ta3AlC2 | COD | 4307745 | P6_3/mmc (194) | ✔ | 12 | 100 | 3 | 0.0 | 0.051 | 0.053 | (1;000) | ✗ | 27/01/17 |
| Fe7W6 | ICSD | 634060 | R-3m (166) | ✔ | 13 | 224 | 3 | 0.0 | 0.007 | 0.581 | (1;000) | ✗ | 11/04/17 |