Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| K3P | ICSD | 25550 | P6_3/mmc (194) | ✔ | 8 | 64 | 1 | 0.2826 | 0.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TiBrN | ICSD | 27395 | Pmmn (59) | ✔ | 6 | 48 | 2 | 0.1946 | 0.195 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K3Sb | COD | 1010296 | P6_3/mmc (194) | ✔ | 8 | 64 | 1 | 0.3606 | 0.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K3SiTe3 | COD | 1527296 | C2/m (12) | ✔ | 14 | 98 | 1 | 1.7652 | 2.013 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K4(NiO2)3 | ICSD | 426450 | C2/m (12) | ✔ | 13 | 102 | 3 | 0.0 | 0.043 | 0.054 | (0;000) | ✗ | 02/02/17 |
| K4PbO4 | ICSD | 37268 | P-1 (2) | ✔ | 18 | 148 | 1 | 1.908 | 1.929 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K4SnO4 | COD | 2106386 | P-1 (2) | ✔ | 18 | 148 | 1 | 2.5879 | 2.661 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K4V2O7 | ICSD | 250388 | C2/m (12) | ✔ | 13 | 104 | 1 | 3.7624 | 3.802 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K4P2PdS8 | ICSD | 165312 | P-1 (2) | ✔ | 15 | 112 | 1 | 1.7253 | 1.731 | 0.000 | (0;000) | ✗ | 02/02/17 |
| K4ZnP2 | ICSD | 67261 | R-3m (166) | ✔ | 7 | 58 | 1 | 0.952 | 1.023 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ZrBrN | ICSD | 27393 | Pmmn (59) | ✔ | 6 | 32 | 2 | 1.224 | 1.224 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KLi3PbO4 | ICSD | 37084 | P-1 (2) | ✔ | 18 | 112 | 2 | 1.829 | 1.830 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KLiS | ICSD | 27465 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 1.3014 | 1.301 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaMnO2 | ICSD | 61403 | Cccm (66) | ✔ | 20 | 180 | 3 | 0.0 | 0.011 | 0.210 | (0;000) | ✗ | 02/02/17 |
| KSc(MoO4)2 | ICSD | 28019 | P-3m1 (164) | ✔ | 12 | 96 | 3 | 3.0812 | 3.081 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaZnO2 | ICSD | 38327 | P2_1/c (14) | ✔ | 20 | 168 | 3 | 1.8459 | 1.846 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaSO4 | ICSD | 77343 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 4.5117 | 4.575 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaV2O6 | COD | 2008659 | C2/c (15) | ✔ | 20 | 160 | 1 | 3.29 | 3.290 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaSe | ICSD | 67278 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.022 | 2.022 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaS | ICSD | 62658 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.6667 | 2.667 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNaTe | ICSD | 67276 | Pnma (62) | ✔ | 12 | 96 | 1 | 1.7998 | 1.800 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNO2 | ICSD | 86117 | P2_1/c (14) | ✔ | 16 | 104 | 1 | 2.4941 | 2.579 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNO3 | ICSD | 52376 | Pnma (62) | ✔ | 20 | 128 | 1 | 2.3104 | 2.310 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNO3 | COD | 9012754 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.0758 | 3.078 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KNO3 | ICSD | 85491 | Pnma (62) | ✔ | 20 | 128 | 1 | 3.5677 | 3.595 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KO3 | COD | 1518207 | I4/mcm (140) | ✔ | 16 | 108 | 1 | 0.0 | 0.000 | 0.588 | (0;000) | ✗ | 02/02/17 |
| KPO3 | ICSD | 26148 | Pnma (62) | ✔ | 20 | 128 | 1 | 4.7829 | 4.783 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KSbO3 | ICSD | 77333 | Fd-3m (227) | ✔ | 20 | 128 | 3 | 1.9306 | 2.142 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KVO3 | COD | 1527491 | Pbcm (57) | ✔ | 20 | 160 | 1 | 3.0491 | 3.071 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KReO4 | COD | 2106705 | I4_1/a (88) | ✔ | 12 | 96 | 1 | 4.3067 | 4.307 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ZrBrN | ICSD | 51771 | R-3m (166) | ✔ | 6 | 32 | 2 | 1.2522 | 1.887 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Br | COD | 1512496 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.1847 | 1.185 | 0.000 | (0;000) | ✗ | 27/01/17 |
| K(OsO3)2 | COD | 1529026 | Fd-3m (227) | ✔ | 18 | 154 | 3 | 0.0 | 0.000 | 0.427 | (0;000) | ✗ | 02/02/17 |
| KTeP2 | COD | 4105329 | P2_1/m (11) | ✔ | 16 | 100 | 1 | 1.0863 | 1.302 | 0.000 | (0;000) | ✗ | 02/02/17 |
| CsClO2 | ICSD | 162803 | Cmcm (63) | ✔ | 8 | 56 | 1 | 2.3848 | 2.676 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KPS3 | ICSD | 33278 | Immm (71) | ✔ | 10 | 64 | 1 | 1.7043 | 1.718 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KTiPS5 | ICSD | 82262 | C2/m (12) | ✔ | 16 | 112 | 1 | 1.1891 | 1.275 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KTiPSe5 | ICSD | 81297 | C2/m (12) | ✔ | 16 | 112 | 2 | 0.7848 | 0.860 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KPt2S3 | ICSD | 40062 | R-3m (166) | ✔ | 12 | 94 | 2 | 1.3757 | 1.377 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KPt2Se3 | ICSD | 69438 | R-3m (166) | ✔ | 12 | 94 | 2 | 0.768 | 0.768 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KRbS | ICSD | 72326 | Pnma (62) | ✔ | 12 | 96 | 1 | 2.3309 | 2.331 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KSbS2 | ICSD | 641324 | C2/c (15) | ✔ | 8 | 52 | 1 | 1.4975 | 1.501 | 0.000 | (0;000) | ✗ | 02/02/17 |
| BN | ICSD | 162874 | F-43m (216) | ✗ | 2 | 8 | 3 | 4.4968 | 8.945 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K(SbSe2)2 | ICSD | 402886 | P-1 (2) | ✔ | 14 | 86 | 3 | 1.0916 | 1.375 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KSb | COD | 9016016 | P2_1/c (14) | ✔ | 16 | 112 | 3 | 0.0 | 0.727 | 1.000 | (0;000) | ✗ | 02/02/17 |
| KSbSe2 | COD | 7221206 | P-1 (2) | ✔ | 16 | 104 | 1 | 1.4458 | 1.453 | 0.000 | (0;000) | ✗ | 02/02/17 |
| PbS | ICSD | 183249 | Pbm2 (28) | ✗ | 8 | 80 | 2 | 0.8462 | 1.424 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KSn2 | ICSD | 190812 | P6_3/mmc (194) | ✔ | 12 | 148 | 3 | 0.0 | 0.001 | 0.735 | (0;000) | ✗ | 02/02/17 |
| KTe | ICSD | 73174 | P6_3/mmc (194) | ✔ | 8 | 60 | 1 | 0.4835 | 0.484 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb2Li2SiO4 | ICSD | 61086 | P-1 (2) | ✔ | 18 | 104 | 2 | 4.1321 | 4.216 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KTl | ICSD | 262071 | P6_3/mmc (194) | ✔ | 8 | 88 | 1 | 0.0 | 0.030 | 0.064 | (0;000) | ✗ | 02/02/17 |
| Li2ZnSi | COD | 1528031 | P-3m1 (164) | ✔ | 16 | 88 | 1 | 0.0 | 0.245 | 0.364 | (0;000) | ✗ | 02/02/17 |
| Li2Sn5 | ICSD | 26200 | P4/mbm (127) | ✔ | 14 | 152 | 3 | 0.0 | 0.007 | 0.963 | (0;000) | ✗ | 02/02/17 |
| Sn(HgSe2)2 | ICSD | 95061 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.2537 | 0.254 | 0.000 | (0;000) | ✔ | 06/10/16 |
| Li5ReN4 | ICSD | 92467 | Pmmn (59) | ✔ | 20 | 100 | 1 | 2.0104 | 2.091 | 0.000 | (0;000) | ✗ | 02/02/17 |
| KIO3 | ICSD | 247719 | R3 (146) | ✗ | 10 | 68 | 3 | 1.9552 | 1.956 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Li7Sn3 | COD | 7221164 | P2_1/m (11) | ✔ | 20 | 126 | 1 | 0.0 | 0.000 | 0.982 | (0;000) | ✗ | 02/02/17 |
| Br | COD | 9013118 | Cmce (64) | ✔ | 4 | 28 | 1 | 1.7043 | 1.768 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Li(MoSe)3 | ICSD | 604519 | P6_3/m (176) | ✔ | 14 | 126 | 1 | 0.0 | 0.000 | 0.338 | (0;000) | ✗ | 02/02/17 |
| LiMoS2 | COD | 1531962 | P-1 (2) | ✔ | 16 | 116 | 3 | 0.2758 | 0.281 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Sr2LiReN4 | ICSD | 411454 | P2_1/m (11) | ✔ | 16 | 116 | 1 | 1.9125 | 1.944 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaLiV2O6 | ICSD | 20836 | C2/c (15) | ✔ | 20 | 148 | 1 | 3.095 | 3.183 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaLiV2O6 | ICSD | 30019 | C2/c (15) | ✔ | 20 | 148 | 1 | 2.7521 | 2.821 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaLiSe | ICSD | 67359 | Pnma (62) | ✔ | 12 | 72 | 1 | 2.3789 | 2.379 | 0.000 | (0;000) | ✗ | 02/02/17 |
| NaLiTe | ICSD | 67274 | Pnma (62) | ✔ | 12 | 72 | 1 | 1.9514 | 1.951 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiYO2 | COD | 1008941 | P2_1/c (14) | ✔ | 16 | 104 | 3 | 4.2319 | 4.232 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiSbO3 | COD | 1000141 | Pnna (52) | ✔ | 20 | 104 | 3 | 2.5446 | 2.545 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiVO3 | ICSD | 2899 | C2/c (15) | ✔ | 20 | 136 | 2 | 3.0371 | 3.197 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Rb3BrO | ICSD | 77196 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.4411 | 0.441 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiSc(SiO3)2 | COD | 9008451 | C2/c (15) | ✔ | 20 | 116 | 3 | 5.094 | 5.223 | 0.000 | (0;000) | ✗ | 02/02/17 |
| ScBrO | COD | 2206575 | Pmmn (59) | ✔ | 6 | 48 | 2 | 3.3438 | 3.344 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KIO3 | ICSD | 424864 | R3 (146) | ✗ | 10 | 68 | 3 | 2.2905 | 2.302 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbBr | ICSD | 61560 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 4.1418 | 4.159 | 0.000 | (0;000) | ✗ | 27/01/17 |
| RbLiO | ICSD | 65170 | Pnma (62) | ✔ | 12 | 72 | 1 | 2.4363 | 2.466 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiP | COD | 9015447 | P2_1/c (14) | ✔ | 16 | 64 | 1 | 0.8201 | 1.112 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiSn4Rh | ICSD | 412251 | I4/mcm (140) | ✔ | 12 | 152 | 3 | 0.0 | 0.006 | 0.402 | (0;000) | ✗ | 02/02/17 |
| RbBr | COD | 9008706 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 4.2029 | 4.203 | 0.000 | (0;000) | ✗ | 27/01/17 |
| SrLiSb | COD | 1528545 | Pnma (62) | ✔ | 12 | 72 | 1 | 0.4973 | 0.497 | 0.000 | (0;000) | ✗ | 02/02/17 |
| TlBr | ICSD | 61519 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 1.7789 | 1.779 | 0.000 | (0;000) | ✗ | 27/01/17 |
| PbS | ICSD | 183255 | P6_3mc (186) | ✗ | 4 | 40 | 2 | 0.8123 | 1.012 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiNi2 | ICSD | 105342 | P6_3/mmc (194) | ✔ | 6 | 48 | 3 | 0.0 | 0.004 | 0.711 | (0;000) | ✗ | 06/10/16 |
| KIO3 | ICSD | 97995 | R3m (160) | ✗ | 5 | 34 | 1 | 2.7686 | 2.769 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TlBr | COD | 9008825 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 1.2438 | 1.649 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiIO3 | ICSD | 14344 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.6031 | 3.690 | 0.000 | (0;000) | ✗ | 06/10/16 |
| LiIO3 | ICSD | 14377 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.4203 | 3.524 | 0.000 | (0;000) | ✗ | 06/10/16 |
| YMg2 | COD | 1522922 | P6_3/mmc (194) | ✔ | 12 | 124 | 1 | 0.0 | 0.000 | 0.439 | (0;000) | ✗ | 02/02/17 |
| Mg3Nb6O11 | COD | 1530351 | P-3m1 (164) | ✔ | 20 | 174 | 3 | 0.1754 | 0.735 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Mg3TeO6 | ICSD | 6309 | R-3 (148) | ✔ | 20 | 144 | 3 | 3.7139 | 3.936 | 0.000 | (0;000) | ✗ | 02/02/17 |
| Mg3P2 | COD | 1011277 | Pn-3m (224) | ✔ | 10 | 80 | 1 | 1.0541 | 1.179 | 0.000 | (0;000) | ✗ | 02/02/17 |
| LiIO3 | ICSD | 20012 | P6_322 (182) | ✗ | 10 | 56 | 3 | 0.0 | 0.562 | 0.201 | (0;000) | ✔ | 06/10/16 |
| KAgC2 | ICSD | 410874 | P4/mmm (123) | ✔ | 4 | 28 | 1 | 2.3634 | 2.681 | 0.000 | (0;000) | ✗ | 27/01/17 |
| Mg(AlC)2 | COD | 4030910 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 1.602 | 2.609 | 0.000 | (0;000) | ✗ | 27/01/17 |
| CdTe | ICSD | 108238 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.528 | 0.528 | 0.000 | (0;000) | ✗ | 06/10/16 |
| PbS | ICSD | 68701 | Cm2e (39) | ✗ | 4 | 40 | 2 | 1.0016 | 1.003 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MgSeO3 | ICSD | 494 | Pnma (62) | ✔ | 20 | 136 | 3 | 4.1899 | 4.512 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgSiO3 | COD | 2105685 | C2/c (15) | ✔ | 20 | 128 | 3 | 4.4588 | 4.459 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgTa2O6 | COD | 2002433 | P4_2/mnm (136) | ✔ | 18 | 144 | 3 | 2.9855 | 3.037 | 0.000 | (0;000) | ✗ | 02/02/17 |
| MgS2O7 | ICSD | 426707 | P-1 (2) | ✔ | 20 | 128 | 3 | 5.9973 | 5.997 | 0.000 | (0;000) | ✗ | 02/02/17 |
| SrMgPb | ICSD | 642747 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.019 | 0.113 | (0;000) | ✗ | 02/02/17 |
| MgPS3 | ICSD | 642729 | C2/m (12) | ✔ | 10 | 66 | 2 | 2.4505 | 2.456 | 0.000 | (0;000) | ✗ | 02/02/17 |