Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| AlMo3 | ICSD | 57999 | Pm-3n (223) | ✔ | 8 | 90 | 3 | 0.0 | 0.000 | 0.955 | (1;000) | ✗ | 05/01/17 |
| NaAlSe2 | ICSD | 44704 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 2.2881 | 2.395 | 0.000 | (0;000) | ✗ | 05/01/17 |
| RbBe2F5 | ICSD | 28541 | P1 (1) | ✗ | 8 | 52 | 2 | 6.8553 | 6.858 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HgO | COD | 9012530 | Pnma (62) | ✔ | 8 | 72 | 3 | 1.1689 | 1.576 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Nb3Al | ICSD | 608653 | Pm-3n (223) | ✔ | 8 | 84 | 3 | 0.0 | 0.012 | 0.550 | (0;000) | ✗ | 05/01/17 |
| CsHF2 | ICSD | 45858 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 6.638 | 6.638 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaAs3 | ICSD | 86402 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.0 | 0.032 | 0.224 | (1;001) | ✔ | 30/01/17 |
| Ti2AlN | ICSD | 184882 | P6_3/mmc (194) | ✔ | 8 | 64 | 3 | 0.0 | 0.009 | 0.549 | (1;000) | ✗ | 05/01/17 |
| RbAlO2 | ICSD | 28373 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 3.7643 | 3.769 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Ti2TlC | ICSD | 618954 | P6_3/mmc (194) | ✔ | 8 | 82 | 3 | 0.0 | 0.000 | 0.970 | (1;000) | ✗ | 27/01/17 |
| AlTlO2 | ICSD | 29010 | R-3m (166) | ✔ | 8 | 56 | 3 | 1.3755 | 1.384 | 0.000 | (0;000) | ✗ | 05/01/17 |
| ZrAlPt2 | ICSD | 58139 | P6_3/mmc (194) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.927 | (0;000) | ✗ | 05/01/17 |
| Ti3Al | ICSD | 181338 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.474 | (1;000) | ✗ | 05/01/17 |
| AlV3 | ICSD | 609614 | Pm-3n (223) | ✔ | 8 | 84 | 3 | 0.0 | 0.001 | 0.696 | (0;000) | ✗ | 05/01/17 |
| Ti3Hg | COD | 1523041 | Pm-3n (223) | ✔ | 8 | 96 | 3 | 0.0 | 0.009 | 0.349 | (1;000) | ✗ | 27/01/17 |
| Zr3Hg | ICSD | 104375 | Pm-3n (223) | ✔ | 8 | 48 | 3 | 0.0 | 0.009 | 0.473 | (1;000) | ✗ | 27/01/17 |
| CrBr3 | ICSD | 24768 | R-3 (148) | ✔ | 8 | 70 | 2 | 0.0 | 0.029 | 0.410 | (0;000) | ✗ | 06/10/16 |
| CsCuO2 | COD | 1527507 | Cmcm (63) | ✔ | 8 | 64 | 2 | 0.9188 | 1.187 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SBr | ICSD | 37020 | Cc2e (41) | ✗ | 8 | 52 | 1 | 2.0962 | 2.254 | 0.000 | (0;000) | ✗ | 06/10/16 |
| FeBr3 | ICSD | 410924 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.010 | 0.479 | (0;000) | ✗ | 02/02/17 |
| ScCd3 | COD | 1525206 | P6_3/mmc (194) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.813 | (0;000) | ✗ | 27/01/17 |
| FeBr3 | ICSD | 76421 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.026 | 0.272 | (0;000) | ✗ | 06/10/16 |
| FeGe | ICSD | 53456 | C2/m (12) | ✔ | 8 | 48 | 3 | 0.0 | 0.009 | 0.876 | (1;110) | ✗ | 27/01/17 |
| YFeGe2 | ICSD | 632162 | Cmcm (63) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.686 | (1;110) | ✗ | 27/01/17 |
| LaBr3 | ICSD | 31581 | P2_1/m (11) | ✔ | 8 | 48 | 3 | 3.1889 | 3.189 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Fe3Sn | ICSD | 633746 | P6_3/mmc (194) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.559 | (1;000) | ✗ | 27/01/17 |
| BaAs2Pd | ICSD | 405110 | Cmcm (63) | ✔ | 8 | 76 | 3 | 0.0 | 0.030 | 0.506 | (1;000) | ✗ | 05/01/17 |
| TiBr3 | ICSD | 39242 | R-3 (148) | ✔ | 8 | 66 | 2 | 0.0 | 0.008 | 0.833 | (1;000) | ✗ | 02/02/17 |
| BaAs2Pt | ICSD | 405112 | Cmcm (63) | ✔ | 8 | 60 | 3 | 0.0 | 0.025 | 0.569 | (0;000) | ✗ | 05/01/17 |
| SeBr | ICSD | 37019 | Cc2e (41) | ✗ | 8 | 52 | 1 | 1.6226 | 1.760 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag3As | COD | 9015121 | Pm-3n (223) | ✔ | 8 | 76 | 3 | 0.0 | 0.018 | 0.286 | (1;000) | ✗ | 30/01/17 |
| FeHO2 | ICSD | 24885 | Cmcm (63) | ✔ | 8 | 42 | 3 | 0.0 | 0.000 | 0.734 | (0;000) | ✗ | 27/01/17 |
| TiBr3 | ICSD | 39784 | P-1 (2) | ✔ | 8 | 66 | 2 | 0.0 | 0.007 | 0.829 | (0;011) | ✗ | 06/10/16 |
| CoAs | ICSD | 15065 | P2_1nb (33) | ✗ | 8 | 56 | 3 | 0.0 | 0.020 | 0.375 | (1;000) | ✔ | 06/10/16 |
| TiFeH2 | ICSD | 601978 | P2/m (10) | ✔ | 8 | 44 | 3 | 0.0 | 0.017 | 0.760 | (1;100) | ✗ | 27/01/17 |
| InSe | ICSD | 640503 | P-6m2 (187) | ✗ | 8 | 76 | 2 | 0.6264 | 0.626 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InBr3 | ICSD | 65198 | C2/m (12) | ✔ | 8 | 68 | 2 | 2.6722 | 2.697 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KFeS2 | COD | 1008340 | C2/c (15) | ✔ | 8 | 58 | 1 | 0.0 | 0.000 | 0.278 | (1;101) | ✗ | 27/01/17 |
| LiFeO2 | ICSD | 31149 | I4_1/amd (141) | ✔ | 8 | 46 | 3 | 0.0 | 0.000 | 0.787 | (1;111) | ✗ | 27/01/17 |
| LiHO2 | ICSD | 27761 | C2/m (12) | ✔ | 8 | 32 | 1 | 0.0 | 0.008 | 0.718 | (1;111) | ✗ | 27/01/17 |
| K3Cu3As2 | ICSD | 32015 | R-3m (166) | ✔ | 8 | 70 | 2 | 1.2339 | 1.286 | 0.000 | (0;000) | ✗ | 05/01/17 |
| IrBr3 | ICSD | 14212 | C2/m (12) | ✔ | 8 | 60 | 2 | 1.4173 | 1.460 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ag3P | COD | 9015865 | Pm-3n (223) | ✔ | 8 | 76 | 3 | 0.0 | 0.001 | 0.278 | (0;000) | ✗ | 30/01/17 |
| YCuAs2 | COD | 8100824 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.048 | 0.338 | (1;000) | ✗ | 05/01/17 |
| FeWN2 | ICSD | 81488 | P6_3/mmc (194) | ✔ | 8 | 64 | 3 | 0.0 | 0.010 | 1.000 | (1;000) | ✗ | 27/01/17 |
| RhBr3 | ICSD | 28245 | C2/m (12) | ✔ | 8 | 76 | 2 | 1.23 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrCd2Pd | ICSD | 425494 | Cmcm (63) | ✔ | 8 | 104 | 3 | 0.0 | 0.013 | 0.642 | (1;000) | ✗ | 27/01/17 |
| SrIn2Rh | ICSD | 410403 | Cmcm (63) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.796 | (0;000) | ✗ | 27/01/17 |
| CsN3 | ICSD | 25008 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 4.2572 | 4.296 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CsReF6 | COD | 1530107 | R-3 (148) | ✔ | 8 | 66 | 1 | 0.0 | 0.001 | 0.032 | (0;000) | ✗ | 27/01/17 |
| RuBr3 | ICSD | 28119 | Cm2m (38) | ✗ | 8 | 74 | 1 | 0.0 | 0.064 | 0.330 | (0;000) | ✔ | 06/10/16 |
| CaAs3 | COD | 1529689 | P-1 (2) | ✔ | 8 | 50 | 1 | 0.0 | 0.060 | 0.008 | (1;100) | ✗ | 05/01/17 |
| NaCl3 | ICSD | 190539 | Pm-3n (223) | ✔ | 8 | 60 | 3 | 0.0 | 0.000 | 0.607 | (1;111) | ✗ | 27/01/17 |
| CaP3 | ICSD | 74479 | P-1 (2) | ✔ | 8 | 50 | 1 | 0.0 | 0.016 | 0.024 | (1;010) | ✗ | 27/01/17 |
| CsZn4As3 | COD | 4326066 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.0 | 0.040 | 0.073 | (0;001) | ✗ | 05/01/17 |
| BaP3 | ICSD | 23618 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.6198 | 0.781 | 0.000 | (0;000) | ✗ | 05/01/17 |
| RbZn4As3 | COD | 4326074 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 0.0 | 0.021 | 0.003 | (0;001) | ✗ | 05/01/17 |
| C | COD | 9012238 | Ia3 (206) | ✔ | 8 | 32 | 3 | 3.4586 | 3.459 | 0.000 | (0;000) | ✗ | 27/01/17 |
| YIn2Ni | ICSD | 413459 | Cmcm (63) | ✔ | 8 | 94 | 3 | 0.0 | 0.000 | 0.860 | (0;000) | ✗ | 27/01/17 |
| Na2AsAu | ICSD | 23254 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.2318 | 0.248 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BaCdAsF | ICSD | 189938 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.8914 | 0.891 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BaMnAsF | ICSD | 248365 | P4/nmm (129) | ✔ | 8 | 74 | 1 | 0.0 | 0.000 | 0.857 | (0;000) | ✗ | 05/01/17 |
| CsNbF6 | ICSD | 412444 | R-3 (148) | ✔ | 8 | 64 | 1 | 5.9823 | 6.038 | 0.000 | (0;000) | ✗ | 27/01/17 |
| BaZnAsF | ICSD | 189936 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 0.1626 | 0.163 | 0.000 | (0;000) | ✗ | 05/01/17 |
| BiPd2Pb | ICSD | 58830 | Cm (8) | ✗ | 8 | 130 | 3 | 0.0 | 0.009 | 0.811 | (1;011) | ✔ | 28/11/16 |
| SrIn2Pt | ICSD | 410400 | Cmcm (63) | ✔ | 8 | 92 | 3 | 0.0 | 0.007 | 0.632 | (1;000) | ✗ | 27/01/17 |
| ReC | ICSD | 618702 | P6_3/mmc (194) | ✔ | 8 | 76 | 3 | 0.0 | 0.004 | 0.767 | (1;000) | ✗ | 27/01/17 |
| CsAgBr2 | ICSD | 150302 | P4/nmm (129) | ✔ | 8 | 68 | 2 | 1.7855 | 2.190 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CaTe | ICSD | 41959 | Pnma (62) | ✔ | 8 | 64 | 3 | 0.0 | 0.022 | 0.119 | (0;000) | ✗ | 27/01/17 |
| CsAgBr2 | COD | 1509157 | Cmcm (63) | ✔ | 8 | 68 | 2 | 2.0615 | 2.492 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CaFeAsF | ICSD | 186504 | P4/nmm (129) | ✔ | 8 | 60 | 1 | 0.0 | 0.008 | 0.457 | (0;000) | ✗ | 05/01/17 |
| SrIn2Pd | ICSD | 410402 | Cmcm (63) | ✔ | 8 | 108 | 3 | 0.0 | 0.001 | 0.509 | (1;000) | ✗ | 27/01/17 |
| CoAs | COD | 9007664 | Pnma (62) | ✔ | 8 | 88 | 3 | 0.0 | 0.024 | 0.383 | (0;000) | ✗ | 05/01/17 |
| CsAgCl2 | ICSD | 150300 | P4/nmm (129) | ✔ | 8 | 68 | 2 | 2.2043 | 2.501 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CsAgCl2 | COD | 1509264 | Cmcm (63) | ✔ | 8 | 68 | 2 | 2.3293 | 2.738 | 0.000 | (0;000) | ✗ | 30/01/17 |
| CsFeO2 | ICSD | 421173 | Fd-3m (227) | ✔ | 8 | 58 | 3 | 0.0 | 0.000 | 0.275 | (0;000) | ✗ | 27/01/17 |
| TlFeO2 | ICSD | 29011 | R-3m (166) | ✔ | 8 | 66 | 3 | 0.0 | 0.007 | 0.271 | (0;000) | ✗ | 27/01/17 |
| CsSbF6 | COD | 1529843 | R-3 (148) | ✔ | 8 | 56 | 1 | 5.7879 | 5.788 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CsNbN2 | ICSD | 72546 | Fd-3m (227) | ✔ | 8 | 64 | 3 | 1.8404 | 1.853 | 0.000 | (0;000) | ✗ | 27/01/17 |
| ZrIn3 | ICSD | 640726 | I4/mmm (139) | ✔ | 8 | 86 | 3 | 0.0 | 0.021 | 0.685 | (1;000) | ✗ | 02/02/17 |
| CrAs | COD | 9008929 | Pnma (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.447 | (1;011) | ✗ | 05/01/17 |
| CsAsF6 | ICSD | 408070 | R-3 (148) | ✔ | 8 | 56 | 1 | 6.2483 | 6.248 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Ca3Zn | ICSD | 184359 | Cmcm (63) | ✔ | 8 | 84 | 1 | 0.0 | 0.002 | 0.471 | (1;110) | ✗ | 02/02/17 |
| HfSiCuAs | ICSD | 610322 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.050 | 0.067 | (0;001) | ✗ | 05/01/17 |
| Li2CuAs | ICSD | 43938 | P6_3/mmc (194) | ✔ | 8 | 44 | 2 | 0.0 | 0.467 | 0.219 | (0;000) | ✗ | 05/01/17 |
| Na2CuAs | ICSD | 43937 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.6081 | 0.674 | 0.000 | (0;000) | ✗ | 05/01/17 |
| ZrSiCuAs | ICSD | 42165 | P4/nmm (129) | ✔ | 8 | 48 | 3 | 0.0 | 0.015 | 0.079 | (0;001) | ✗ | 05/01/17 |
| LiInO2 | ICSD | 639886 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 1.4431 | 1.809 | 0.000 | (0;000) | ✗ | 27/01/17 |
| NbBr2O | ICSD | 416669 | C2 (5) | ✗ | 8 | 66 | 2 | 0.7552 | 0.860 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InAsF6 | ICSD | 417952 | R-3 (148) | ✔ | 8 | 60 | 1 | 4.2374 | 4.350 | 0.000 | (0;000) | ✗ | 05/01/17 |
| KAsF6 | COD | 2310606 | R-3m (166) | ✔ | 8 | 56 | 1 | 3.9593 | 3.959 | 0.000 | (0;000) | ✗ | 05/01/17 |
| InMoS2 | ICSD | 603787 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.779 | (0;000) | ✗ | 27/01/17 |
| Mg3In | ICSD | 639928 | P6_3/mmc (194) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.635 | (0;000) | ✗ | 27/01/17 |
| LiAsF6 | ICSD | 74831 | R-3 (148) | ✔ | 8 | 50 | 1 | 5.5912 | 5.598 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TlAgI2 | COD | 1509391 | I4/mcm (140) | ✔ | 8 | 76 | 1 | 1.1422 | 1.142 | 0.000 | (0;000) | ✗ | 30/01/17 |
| NaAsF6 | ICSD | 184565 | Fm-3m (225) | ✔ | 8 | 56 | 1 | 6.3822 | 6.382 | 0.000 | (0;000) | ✗ | 05/01/17 |
| RbAsF6 | ICSD | 408069 | R-3 (148) | ✔ | 8 | 56 | 1 | 6.0558 | 6.056 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TlAsF6 | ICSD | 417954 | R-3 (148) | ✔ | 8 | 60 | 1 | 5.1421 | 5.237 | 0.000 | (0;000) | ✗ | 05/01/17 |
| YInPt2 | ICSD | 59505 | P6_3/mmc (194) | ✔ | 8 | 88 | 3 | 0.0 | 0.013 | 0.691 | (1;000) | ✗ | 27/01/17 |
| FeAs | COD | 9007671 | Pnma (62) | ✔ | 8 | 52 | 3 | 0.0 | 0.001 | 0.486 | (0;011) | ✗ | 05/01/17 |