Plotting...
| ▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| TlTe | ICSD | 653092 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 2.4777 | 0.047 | 1.000 | (0;000) | ✗ | 02/02/17 |
| Y5Tl3 | ICSD | 653334 | P6_3/mcm (193) | ✔ | 16 | 188 | 3 | 0.0 | 0.005 | 0.456 | (0;000) | ✗ | 02/02/17 |
| ZrV2 | ICSD | 653414 | P6_3/mmc (194) | ✔ | 12 | 120 | 3 | 0.0 | 0.000 | 0.770 | (0;000) | ✗ | 02/02/17 |
| W | ICSD | 15905 | Pbcm (57) | ✔ | 4 | 56 | 1 | 0.0 | 0.014 | 0.359 | (0;000) | ✗ | 02/02/17 |
| SrPd | ICSD | 648963 | Cmcm (63) | ✔ | 4 | 56 | 3 | 0.0 | 0.052 | 0.090 | (0;000) | ✗ | 27/01/17 |
| Y | ICSD | 281365 | P2_1/m (11) | ✔ | 2 | 22 | 1 | 0.0 | 0.000 | 0.850 | (1;000) | ✗ | 02/02/17 |
| KNO3 | ICSD | 260602 | R3m (160) | ✗ | 5 | 32 | 1 | 3.0852 | 3.085 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCO3 | ICSD | 161621 | Pmmn (59) | ✔ | 10 | 64 | 1 | 4.485 | 4.872 | 0.000 | (0;000) | ✗ | 27/01/17 |
| KNO3 | ICSD | 384 | R3m (160) | ✗ | 5 | 32 | 1 | 1.7583 | 1.758 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cr2AgBiO8 | ICSD | 8224 | I-4 (82) | ✗ | 12 | 102 | 3 | 1.1891 | 1.204 | 0.000 | (0;000) | ✗ | 15/02/17 |
| SnS | ICSD | 43409 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.025 | 0.304 | (0;000) | ✔ | 06/10/16 |
| Te2Pd | ICSD | 42554 | P-3m1 (164) | ✔ | 3 | 22 | 3 | 0.0 | 0.211 | 0.316 | (1;000) | ✗ | 06/10/16 |
| KNO3 | ICSD | 71398 | R3m (160) | ✗ | 5 | 32 | 1 | 3.3139 | 3.314 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca3Pb | ICSD | 58921 | Pm-3m (221) | ✔ | 4 | 44 | 1 | 0.0 | 0.000 | 0.240 | (1;111) | ✗ | 27/01/17 |
| Ca4P2O | ICSD | 402952 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 1.2767 | 1.470 | 0.000 | (0;000) | ✗ | 27/01/17 |
| AgMoH4S4N | ICSD | 236249 | I-4 (82) | ✗ | 11 | 58 | 1 | 1.307 | 1.586 | 0.000 | (0;000) | ✗ | 15/02/17 |
| KNbO3 | ICSD | 14363 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.0944 | 2.921 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCd2 | ICSD | 58875 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.019 | 0.523 | (1;111) | ✗ | 27/01/17 |
| TiPd | ICSD | 167648 | Pmmb (51) | ✔ | 4 | 44 | 3 | 0.0 | 0.012 | 0.602 | (0;100) | ✗ | 06/10/16 |
| KNbO3 | ICSD | 190922 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.1224 | 2.960 | 0.000 | (0;000) | ✗ | 06/10/16 |
| MgAgSb | ICSD | 187149 | F-43m (216) | ✗ | 3 | 26 | 3 | 0.0 | 0.000 | 0.283 | (1;000) | ✔ | 15/02/17 |
| BaAl2B2O7 | ICSD | 409171 | R32 (155) | ✗ | 12 | 64 | 2 | 4.8336 | 4.843 | 0.000 | (0;000) | ✗ | 15/02/17 |
| KNbO3 | ICSD | 190923 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4036 | 3.267 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCd | ICSD | 619188 | Pm-3m (221) | ✔ | 2 | 22 | 3 | 0.0 | 0.000 | 0.668 | (0;111) | ✗ | 27/01/17 |
| N3Cl | ICSD | 424502 | Cmc2_1 (36) | ✗ | 8 | 44 | 1 | 2.3446 | 2.370 | 0.000 | (0;000) | ✗ | 06/10/16 |
| YAl3(BO3)4 | ICSD | 91962 | R32 (155) | ✗ | 20 | 104 | 3 | 5.4901 | 5.616 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Y3Al3NiGe2 | ICSD | 76297 | P-62m (189) | ✗ | 9 | 60 | 3 | 0.0 | 0.000 | 0.624 | ? | ✗ | 15/02/17 |
| Hf2Al3 | ICSD | 608101 | Fdd2 (43) | ✗ | 10 | 66 | 3 | 0.0 | 0.000 | 0.865 | ? | ✗ | 15/02/17 |
| Zr2Al3 | ICSD | 58232 | Fdd2 (43) | ✗ | 10 | 34 | 3 | 0.0 | 0.000 | 0.819 | ? | ✗ | 15/02/17 |
| SnS | ICSD | 67442 | Cm2e (39) | ✗ | 4 | 40 | 2 | 1.0017 | 1.005 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al5W | ICSD | 58206 | P6_322 (182) | ✗ | 12 | 58 | 3 | 0.0 | 0.000 | 0.822 | ? | ✗ | 15/02/17 |
| LiAlAs2O7 | ICSD | 161498 | C2 (5) | ✗ | 11 | 58 | 3 | 3.8176 | 3.895 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BaAlBO3F2 | ICSD | 421141 | P-62c (190) | ✗ | 16 | 96 | 2 | 6.3966 | 6.552 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BeAlB | ICSD | 43828 | F-43m (216) | ✗ | 3 | 10 | 3 | 0.0 | 2.310 | 0.095 | (0;000) | ✔ | 15/02/17 |
| Mn2AlCo | ICSD | 160703 | F-43m (216) | ✗ | 4 | 50 | 3 | 0.0 | 0.000 | 0.698 | ? | ✗ | 15/02/17 |
| YPd | ICSD | 169021 | Cmcm (63) | ✔ | 4 | 58 | 3 | 0.0 | 0.000 | 0.814 | (0;110) | ✗ | 27/01/17 |
| MnNiP | ICSD | 600852 | P-62m (189) | ✗ | 9 | 90 | 3 | 0.0 | 0.000 | 0.646 | ? | ✗ | 06/10/16 |
| Zr | ICSD | 31668 | C2/c (15) | ✔ | 6 | 24 | 1 | 0.0 | 0.022 | 0.320 | (0;000) | ✗ | 02/02/17 |
| CaFeClO2 | ICSD | 96556 | C2/m (12) | ✔ | 10 | 74 | 1 | 0.0 | 0.021 | 0.595 | (0;000) | ✗ | 27/01/17 |
| KNbO3 | ICSD | 9533 | C2mm (38) | ✗ | 5 | 40 | 3 | 2.0831 | 2.916 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZrPd | ICSD | 186411 | Ccmm (63) | ✔ | 4 | 44 | 3 | 0.0 | 0.030 | 0.330 | (1;000) | ✗ | 06/10/16 |
| KNbO3 | ICSD | 9534 | R3m (160) | ✗ | 5 | 40 | 3 | 2.4592 | 3.318 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca(CoGe)2 | ICSD | 406 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.024 | 0.628 | (1;111) | ✗ | 27/01/17 |
| LiAlSi | ICSD | 413257 | F-43m (216) | ✗ | 3 | 10 | 3 | 0.0 | 1.721 | 0.008 | (0;000) | ✔ | 15/02/17 |
| Ca(CoP)2 | ICSD | 10462 | I4/mmm (139) | ✔ | 5 | 54 | 2 | 0.0 | 0.019 | 0.401 | (0;111) | ✗ | 27/01/17 |
| NaAlO2 | ICSD | 79404 | Pna2_1 (33) | ✗ | 16 | 96 | 3 | 3.9693 | 4.020 | 0.000 | (0;000) | ✗ | 15/02/17 |
| KSnSb | ICSD | 33933 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.2551 | 0.301 | 0.000 | (0;000) | ✔ | 06/10/16 |
| CdGeAs2 | ICSD | 16736 | I-42d (122) | ✗ | 8 | 52 | 3 | 0.0 | 0.051 | 0.027 | (1;000) | ✔ | 15/02/17 |
| CdSiAs2 | ICSD | 609979 | I-42d (122) | ✗ | 8 | 52 | 3 | 0.7925 | 0.794 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiGaAs2O7 | ICSD | 161500 | C2 (5) | ✗ | 11 | 68 | 3 | 3.2297 | 3.364 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiScAs2O7 | ICSD | 161499 | C2 (5) | ✗ | 11 | 66 | 3 | 4.194 | 4.317 | 0.000 | (0;000) | ✗ | 15/02/17 |
| NaScAs2O7 | ICSD | 161501 | C2 (5) | ✗ | 11 | 72 | 3 | 4.1616 | 4.227 | 0.000 | (0;000) | ✗ | 15/02/17 |
| ZnSiAs2 | ICSD | 611417 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.0819 | 1.082 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Ca(CoSi)2 | ICSD | 420974 | I4/mmm (139) | ✔ | 5 | 52 | 3 | 0.0 | 0.022 | 0.623 | (1;111) | ✗ | 27/01/17 |
| BAsO4 | ICSD | 413436 | P3_121 (152) | ✗ | 18 | 96 | 3 | 4.7353 | 4.824 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiCdAs | ICSD | 609965 | F-43m (216) | ✗ | 3 | 20 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 15/02/17 |
| LiCdAs | ICSD | 609966 | F-43m (216) | ✗ | 3 | 20 | 3 | 0.0 | 0.000 | 0.270 | (1;011) | ✔ | 15/02/17 |
| NaLi2AsO4 | ICSD | 73200 | Pmn2_1 (31) | ✗ | 16 | 88 | 1 | 4.4022 | 4.531 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Li3AsO4 | ICSD | 75927 | Pmn2_1 (31) | ✗ | 16 | 76 | 1 | 4.7571 | 4.821 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiMgAs | ICSD | 107954 | F-43m (216) | ✗ | 3 | 18 | 3 | 1.2653 | 1.565 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiZnAs | ICSD | 74504 | F-43m (216) | ✗ | 3 | 20 | 3 | 0.5178 | 0.518 | 0.000 | (0;000) | ✗ | 15/02/17 |
| AsPd5 | ICSD | 44042 | C2 (5) | ✗ | 12 | 190 | 3 | 0.0 | 0.004 | 0.719 | ? | ✗ | 15/02/17 |
| CaCoSi | ICSD | 428148 | P4/nmm (129) | ✔ | 6 | 62 | 1 | 0.0 | 0.000 | 0.814 | (0;001) | ✗ | 27/01/17 |
| BaH4O3 | ICSD | 63017 | Pmc2_1 (26) | ✗ | 16 | 64 | 1 | 4.418 | 4.429 | 0.000 | (0;000) | ✗ | 15/02/17 |
| SnS | ICSD | 79374 | C2me (39) | ✗ | 4 | 40 | 2 | 1.0723 | 1.072 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiPt | ICSD | 248491 | Pmnb (62) | ✔ | 8 | 56 | 1 | 0.0138 | 0.018 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KSnSb | ICSD | 40816 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.3258 | 0.378 | 0.000 | (0;000) | ✔ | 06/10/16 |
| CaCuSb | ICSD | 42137 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.463 | 0.122 | (0;000) | ✗ | 27/01/17 |
| KZnSb | ICSD | 44680 | P-6m2 (187) | ✗ | 3 | 26 | 2 | 0.2326 | 0.390 | 0.000 | (0;000) | ✔ | 06/10/16 |
| TiPt | ICSD | 184442 | Pmma (51) | ✔ | 4 | 44 | 3 | 0.0 | 0.021 | 0.686 | (1;001) | ✗ | 27/01/17 |
| K2PbO3 | ICSD | 22063 | Cmc2_1 (36) | ✗ | 12 | 100 | 1 | 0.9829 | 0.983 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Cs2CaF4 | ICSD | 82616 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 6.3925 | 6.507 | 0.000 | (0;000) | ✗ | 27/01/17 |
| LiMgSnAu | ICSD | 16477 | F-43m (216) | ✗ | 4 | 38 | 3 | 0.0 | 0.000 | 0.293 | (1;000) | ✔ | 15/02/17 |
| MnSnAu | ICSD | 54465 | F-43m (216) | ✗ | 3 | 40 | 3 | 0.0 | 0.000 | 0.114 | (0;000) | ✔ | 15/02/17 |
| ScNi4Au | ICSD | 612227 | F-43m (216) | ✗ | 6 | 62 | 3 | 0.0 | 0.004 | 0.942 | ? | ✗ | 15/02/17 |
| YNi4Au | ICSD | 612233 | F-43m (216) | ✗ | 6 | 62 | 3 | 0.0 | 0.009 | 0.950 | ? | ✗ | 15/02/17 |
| Ca(CuGe)2 | ICSD | 619230 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.030 | 0.787 | (0;000) | ✗ | 27/01/17 |
| MgNi3B2 | ICSD | 156018 | P6_422 (181) | ✗ | 18 | 138 | 3 | 0.0 | 0.000 | 0.428 | ? | ✗ | 15/02/17 |
| K2Sn2O3 | ICSD | 2216 | R3 (146) | ✗ | 7 | 64 | 2 | 0.8749 | 0.875 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca(CuP)2 | ICSD | 41756 | I4/mmm (139) | ✔ | 5 | 42 | 2 | 0.0 | 0.004 | 0.354 | (1;111) | ✗ | 27/01/17 |
| B5H9 | ICSD | 24636 | I4mm (107) | ✗ | 14 | 24 | 1 | 4.3882 | 4.531 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Ba2TlCuHgO5 | ICSD | 86200 | I4mm (107) | ✗ | 10 | 86 | 3 | 0.0 | 0.000 | 0.592 | ? | ✗ | 15/02/17 |
| BaBePO4F | ICSD | 200922 | P1 (1) | ✗ | 16 | 100 | 1 | 6.2132 | 6.473 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BaBeSiO4 | ICSD | 86792 | Cm (8) | ✗ | 7 | 42 | 1 | 4.4044 | 4.449 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BP | ICSD | 181291 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.2188 | 3.369 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaCo2P2H2O9 | ICSD | 84830 | C2 (5) | ✗ | 16 | 110 | 2 | 0.0 | 0.007 | 0.518 | ? | ✗ | 15/02/17 |
| BaYFeCuO5 | ICSD | 71355 | P4mm (99) | ✗ | 9 | 70 | 3 | 0.0 | 0.001 | 0.784 | ? | ✗ | 15/02/17 |
| BaSb2F12 | ICSD | 39346 | P1 (1) | ✗ | 15 | 104 | 1 | 0.0 | 6.180 | 1.000 | ? | ✗ | 15/02/17 |
| BaGaH5 | ICSD | 240693 | P2_1 (4) | ✗ | 14 | 56 | 1 | 3.2526 | 3.526 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BaSi6N8O | ICSD | 415272 | Imm2 (44) | ✗ | 16 | 80 | 3 | 4.3246 | 4.411 | 0.000 | (0;000) | ✗ | 15/02/17 |
| Ba(Si3N4)2 | ICSD | 417444 | Imm2 (44) | ✗ | 15 | 74 | 3 | 3.1372 | 3.321 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BaSO4 | ICSD | 62368 | F-43m (216) | ✗ | 6 | 40 | 1 | 4.4829 | 4.488 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BaZnBO3F | ICSD | 248042 | P-6 (174) | ✗ | 7 | 50 | 3 | 3.7899 | 4.365 | 0.000 | (0;000) | ✗ | 15/02/17 |
| KBe2BO3F2 | ICSD | 77277 | R32 (155) | ✗ | 9 | 52 | 1 | 6.2765 | 6.286 | 0.000 | (0;000) | ✗ | 15/02/17 |
| LiCdBO3 | ICSD | 20191 | P-6 (174) | ✗ | 18 | 108 | 3 | 2.2699 | 2.533 | 0.000 | (0;000) | ✗ | 15/02/17 |
| BH5NCl | ICSD | 248875 | Cmc2_1 (36) | ✗ | 16 | 40 | 1 | 6.0688 | 6.228 | 0.000 | (0;000) | ✗ | 15/02/17 |
| SrBe3O4 | ICSD | 26179 | P-62c (190) | ✗ | 16 | 92 | 1 | 4.1894 | 4.189 | 0.000 | (0;000) | ✗ | 15/02/17 |
| MgCl2 | ICSD | 51245 | P-4m2 (115) | ✗ | 3 | 24 | 2 | 4.679 | 5.054 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Be5Fe | ICSD | 616267 | F-43m (216) | ✗ | 6 | 28 | 1 | 0.0 | 0.000 | 0.556 | ? | ✗ | 15/02/17 |
| KLiBeF4 | ICSD | 2939 | P6_3 (173) | ✗ | 14 | 88 | 1 | 6.9444 | 7.012 | 0.000 | (0;000) | ✗ | 15/02/17 |