Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▴ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Cs5Nb2S4Br9 | ICSD | 410590 | Immm (71) | ✔ | 20 | 158 | 1 | 1.7015 | 1.702 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgSe2 | ICSD | 642815 | Pa3 (205) | ✔ | 12 | 88 | 3 | 1.5797 | 1.703 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Pb(ClO2)2 | ICSD | 68484 | Ccce (68) | ✔ | 14 | 104 | 2 | 0.953 | 1.704 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NbNO | COD | 1525453 | P2_1/c (14) | ✔ | 12 | 96 | 3 | 1.5582 | 1.705 | 0.000 | (0;000) | ✗ | 27/01/17 |
| AlAs | ICSD | 67771 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 1.599 | 1.705 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CrHgO4 | ICSD | 2224 | P2_1/c (14) | ✔ | 24 | 200 | 3 | 1.7041 | 1.705 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Li5NCl2 | ICSD | 84763 | R-3m (166) | ✔ | 8 | 34 | 1 | 1.7049 | 1.706 | 0.000 | (0;000) | ✗ | 22/03/17 |
| InGaS3 | ICSD | 62340 | Ccm2_1 (36) | ✗ | 10 | 88 | 2 | 1.6062 | 1.706 | 0.000 | (0;000) | ✗ | 06/10/16 |
| InI2 | ICSD | 201607 | Pnna (52) | ✔ | 24 | 216 | 1 | 1.6982 | 1.707 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Cs2PbCl6 | COD | 1010242 | Fm-3m (225) | ✔ | 9 | 74 | 1 | 1.7069 | 1.707 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AuI | COD | 9008986 | P4_2/ncm (138) | ✔ | 8 | 72 | 2 | 1.3722 | 1.708 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2Te | ICSD | 55148 | Cmc2_1 (36) | ✗ | 6 | 48 | 2 | 1.7077 | 1.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2PdO2 | ICSD | 6158 | Immm (71) | ✔ | 5 | 48 | 2 | 1.4517 | 1.708 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Cs2AgSbS4 | ICSD | 55367 | P-1 (2) | ✔ | 16 | 116 | 1 | 1.6561 | 1.709 | 0.000 | (0;000) | ✗ | 30/01/17 |
| HgSO4 | ICSD | 31870 | Pnm2_1 (31) | ✗ | 12 | 84 | 3 | 1.2801 | 1.709 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MoS2 | ICSD | 24000 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.8501 | 1.709 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K6CdO4 | ICSD | 62053 | P6_3mc (186) | ✗ | 22 | 180 | 3 | 1.6958 | 1.709 | 0.000 | (0;000) | ✗ | 07/08/17 |
| LiCuO | ICSD | 40156 | I4/mmm (139) | ✔ | 12 | 80 | 3 | 1.5296 | 1.711 | 0.000 | (0;000) | ✗ | 27/01/17 |
| C4S5O | COD | 2233890 | Pc (7) | ✗ | 20 | 104 | 1 | 1.6485 | 1.711 | 0.000 | (0;000) | ✗ | 21/03/17 |
| H2 | COD | 9013088 | P6_3/mmc (194) | ✔ | 4 | 4 | 1 | 1.4218 | 1.712 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Rb2PtCl6 | COD | 1010237 | Fm-3m (225) | ✔ | 9 | 70 | 1 | 1.7119 | 1.712 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ti(CuS)4 | ICSD | 82558 | I-42m (121) | ✗ | 9 | 80 | 3 | 1.4281 | 1.713 | 0.000 | (0;000) | ✗ | 07/10/16 |
| Li3As | COD | 1010288 | P6_3/mmc (194) | ✔ | 8 | 28 | 1 | 0.7732 | 1.714 | 0.000 | (0;000) | ✗ | 05/01/17 |
| H2C3O | COD | 2002929 | P-1 (2) | ✔ | 24 | 80 | 1 | 1.6811 | 1.714 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Na2Pd(SeO4)2 | ICSD | 249506 | P-1 (2) | ✔ | 13 | 96 | 2 | 1.7145 | 1.715 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KMgP | ICSD | 641231 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 1.6702 | 1.715 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K6HgS4 | COD | 9009861 | P6_3mc (186) | ✗ | 22 | 180 | 1 | 1.7141 | 1.715 | 0.000 | (0;000) | ✗ | 07/08/17 |
| LiInSe2 | ICSD | 56532 | I-42d (122) | ✗ | 8 | 56 | 3 | 1.7153 | 1.715 | 0.000 | (0;000) | ✗ | 07/10/16 |
| Zn3CdS4 | ICSD | 168376 | P-43m (215) | ✗ | 8 | 72 | 3 | 1.7167 | 1.717 | 0.000 | (0;000) | ✗ | 06/10/16 |
| S3(NO)2 | COD | 7221380 | C2/c (15) | ✔ | 14 | 80 | 1 | 1.5897 | 1.717 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KPS3 | ICSD | 33278 | Immm (71) | ✔ | 10 | 64 | 1 | 1.7043 | 1.718 | 0.000 | (0;000) | ✗ | 02/02/17 |
| RbPbF3 | ICSD | 49591 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 1.7182 | 1.718 | 0.000 | (0;000) | ✗ | 27/01/17 |
| PtCI2O | ICSD | 68098 | C2/c (15) | ✔ | 20 | 136 | 2 | 1.6393 | 1.719 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TlPS3 | ICSD | 658902 | Immm (71) | ✔ | 10 | 72 | 1 | 1.7134 | 1.720 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiAlSi | ICSD | 413257 | F-43m (216) | ✗ | 3 | 10 | 3 | 0.0 | 1.721 | 0.008 | (0;000) | ✔ | 15/02/17 |
| AuBr | COD | 1510610 | P4_2/ncm (138) | ✔ | 8 | 72 | 2 | 1.7201 | 1.721 | 0.000 | (0;000) | ✗ | 30/01/17 |
| In2O3 | ICSD | 181835 | Pnma (62) | ✔ | 20 | 176 | 3 | 1.4566 | 1.721 | 0.000 | (0;000) | ✗ | 27/01/17 |
| GeSe2 | ICSD | 637858 | Fdd2 (43) | ✗ | 18 | 96 | 3 | 1.6404 | 1.722 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Hg | ICSD | 15902 | P2_1/c (14) | ✔ | 6 | 72 | 3 | 1.6952 | 1.722 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CdP2 | ICSD | 42732 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 1.4322 | 1.723 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Ga2HgS4 | ICSD | 67220 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7231 | 1.723 | 0.000 | (0;000) | ✗ | 06/10/16 |
| In2GaBiS6 | ICSD | 410032 | P2_1/m (11) | ✔ | 20 | 180 | 3 | 1.6515 | 1.723 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2TlBiF6 | ICSD | 9385 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 1.7247 | 1.725 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ga2HgS4 | ICSD | 189739 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7259 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ga2HgS4 | ICSD | 189737 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.7261 | 1.726 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ba(MgP)2 | ICSD | 30914 | P-3m1 (164) | ✔ | 5 | 40 | 1 | 1.1281 | 1.727 | 0.000 | (0;000) | ✗ | 05/01/17 |
| TlBS3 | COD | 1511322 | P2_1/c (14) | ✔ | 20 | 136 | 1 | 1.5675 | 1.727 | 0.000 | (0;000) | ✗ | 02/02/17 |
| S | COD | 9014401 | P3_221 (154) | ✗ | 9 | 54 | 1 | 1.6752 | 1.727 | 0.000 | (0;000) | ✗ | 15/02/17 |
| PbI2 | ICSD | 108914 | R-3m (166) | ✔ | 6 | 56 | 1 | 1.4435 | 1.728 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TlGeI3 | ICSD | 201144 | Pnma (62) | ✔ | 20 | 152 | 2 | 1.6566 | 1.729 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CO2 | COD | 1010150 | Pn-3m (224) | ✔ | 12 | 64 | 3 | 1.7292 | 1.729 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K4P2PdS8 | ICSD | 165312 | P-1 (2) | ✔ | 15 | 112 | 1 | 1.7253 | 1.731 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KAl(SO4)2 | COD | 1011235 | P321 (150) | ✗ | 12 | 72 | 2 | 1.6616 | 1.732 | 0.000 | (0;000) | ✗ | 15/02/17 |
| SbCl4F | ICSD | 74783 | I-4 (82) | ✗ | 24 | 160 | 1 | 1.7328 | 1.733 | 0.000 | (0;000) | ✗ | 04/08/17 |
| KTlO | COD | 1528008 | C2/m (12) | ✔ | 6 | 56 | 1 | 1.2719 | 1.734 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ca3AsCl3 | ICSD | 36002 | Pm-3m (221) | ✔ | 7 | 56 | 1 | 1.7345 | 1.735 | 0.000 | (0;000) | ✗ | 05/01/17 |
| Cs2SnSe3 | ICSD | 67251 | C2/m (12) | ✔ | 12 | 100 | 1 | 1.7375 | 1.738 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba(BSe3)2 | COD | 1510647 | Cmce (64) | ✔ | 18 | 104 | 2 | 1.7291 | 1.739 | 0.000 | (0;000) | ✗ | 02/02/17 |
| RbGeBr3 | ICSD | 65244 | Pna2_1 (33) | ✗ | 20 | 136 | 1 | 1.7386 | 1.741 | 0.000 | (0;000) | ✗ | 21/03/17 |
| MgB9N | COD | 2012796 | R-3m (166) | ✔ | 22 | 84 | 3 | 1.6873 | 1.742 | 0.000 | (0;000) | ✗ | 04/08/17 |
| InBi2S4Cl | ICSD | 484 | C2/m (12) | ✔ | 8 | 74 | 2 | 1.5901 | 1.742 | 0.000 | (0;000) | ✗ | 05/01/17 |
| As(CN)3 | ICSD | 35330 | C2 (5) | ✗ | 14 | 64 | 2 | 1.6993 | 1.742 | 0.000 | (0;000) | ✗ | 21/03/17 |
| BiPPbO5 | ICSD | 419125 | P-1 (2) | ✔ | 16 | 128 | 3 | 1.6308 | 1.743 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ga4SnSe7 | COD | 4001921 | Pc (7) | ✗ | 24 | 216 | 3 | 1.7428 | 1.744 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Bi2TeO6 | ICSD | 6239 | Cmce (64) | ✔ | 18 | 144 | 3 | 1.7449 | 1.745 | 0.000 | (0;000) | ✗ | 02/02/17 |
| AgCl | ICSD | 56544 | Ccmm (63) | ✔ | 4 | 36 | 3 | 0.6341 | 1.745 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cs2PtCl6 | COD | 1010238 | Fm-3m (225) | ✔ | 9 | 70 | 1 | 1.745 | 1.745 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CdS | ICSD | 620316 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.2437 | 1.748 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CdSe | ICSD | 181026 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 1.749 | 0.105 | (0;000) | ✗ | 27/01/17 |
| Ca2VN3 | ICSD | 409644 | C2/c (15) | ✔ | 24 | 192 | 1 | 1.6877 | 1.751 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CsI3 | ICSD | 38169 | Pnma (62) | ✔ | 16 | 120 | 1 | 1.7324 | 1.753 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Mg2Si | COD | 1011355 | Fm-3m (225) | ✔ | 3 | 24 | 3 | 0.2225 | 1.756 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Rb3BAs2 | ICSD | 402082 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.3651 | 1.757 | 0.000 | (0;000) | ✗ | 30/01/17 |
| KNO3 | ICSD | 384 | R3m (160) | ✗ | 5 | 32 | 1 | 1.7583 | 1.758 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KYTe2 | ICSD | 419995 | R-3m (166) | ✔ | 4 | 32 | 3 | 0.682 | 1.760 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SeBr | ICSD | 37019 | Cc2e (41) | ✗ | 8 | 52 | 1 | 1.6226 | 1.760 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K2CdSnSe4 | ICSD | 185468 | I-42m (121) | ✗ | 8 | 68 | 1 | 1.761 | 1.761 | 0.000 | (0;000) | ✗ | 22/03/17 |
| CdGeO3 | COD | 1530775 | C2/c (15) | ✔ | 20 | 136 | 3 | 1.7048 | 1.761 | 0.000 | (0;000) | ✗ | 02/02/17 |
| GaTeI7 | ICSD | 407982 | Pc (7) | ✗ | 18 | 136 | 1 | 1.5755 | 1.763 | 0.000 | (0;000) | ✗ | 22/03/17 |
| Rb2Hg2PdCl8 | ICSD | 203187 | C2/m (12) | ✔ | 13 | 116 | 1 | 1.737 | 1.763 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2PbO3 | ICSD | 62140 | Cmcm (63) | ✔ | 12 | 100 | 2 | 1.7632 | 1.763 | 0.000 | (0;000) | ✗ | 02/02/17 |
| IO3 | ICSD | 182673 | P-1 (2) | ✔ | 16 | 100 | 2 | 1.7136 | 1.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba2P7I | ICSD | 426195 | P2_1/m (11) | ✔ | 20 | 124 | 1 | 1.6064 | 1.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Ba3BPO3 | ICSD | 402017 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 1.4131 | 1.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Li5BiO5 | ICSD | 203031 | Cm (8) | ✗ | 11 | 50 | 2 | 1.5359 | 1.767 | 0.000 | (0;000) | ✗ | 06/10/16 |
| In6Ge2PtO9 | ICSD | 170897 | Fm-3m (225) | ✔ | 18 | 150 | 3 | 1.6147 | 1.767 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K3BAs2 | ICSD | 300105 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.3279 | 1.768 | 0.000 | (0;000) | ✗ | 30/01/17 |
| Cs(SbS2)2 | ICSD | 67976 | P-1 (2) | ✔ | 14 | 86 | 3 | 1.2748 | 1.768 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Br | COD | 9013118 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.7043 | 1.768 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Sr6Li2Cr2N8O | ICSD | 411983 | P-1 (2) | ✔ | 19 | 140 | 1 | 1.7419 | 1.768 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K2SnSe3 | ICSD | 300234 | P-1 (2) | ✔ | 12 | 100 | 1 | 1.7684 | 1.768 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgSi(CuS2)2 | ICSD | 425554 | Pmn2_1 (31) | ✗ | 16 | 120 | 3 | 1.7685 | 1.769 | 0.000 | (0;000) | ✗ | 22/03/17 |
| TlF | COD | 1010462 | Fmmm (69) | ✔ | 2 | 20 | 2 | 1.7688 | 1.769 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Ba2P7Cl | ICSD | 426193 | P2_1/m (11) | ✔ | 20 | 124 | 1 | 1.3959 | 1.770 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Tl4HgBr6 | COD | 1525715 | P4/mnc (128) | ✔ | 22 | 212 | 3 | 1.7719 | 1.772 | 0.000 | (0;000) | ✗ | 07/08/17 |
| Cs3BAs2 | ICSD | 300122 | C2/c (15) | ✔ | 12 | 80 | 1 | 1.6808 | 1.772 | 0.000 | (0;000) | ✗ | 30/01/17 |
| SbPbClO2 | COD | 9010005 | Cmcm (63) | ✔ | 10 | 76 | 1 | 0.0 | 1.773 | 1.000 | (0;000) | ✗ | 27/01/17 |
| RbPS3 | ICSD | 416176 | Immm (71) | ✔ | 10 | 64 | 1 | 1.759 | 1.775 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Cs2AgAsS4 | ICSD | 55368 | P-1 (2) | ✔ | 16 | 116 | 1 | 1.6825 | 1.775 | 0.000 | (0;000) | ✗ | 16/03/17 |
| SrGeO3 | ICSD | 28603 | P-62m (189) | ✗ | 15 | 96 | 1 | 1.7626 | 1.776 | 0.000 | (0;000) | ✗ | 22/03/17 |