Plotting...
| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| ZnO | ICSD | 162753 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.6019 | 0.602 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BiTePd | ICSD | 70060 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.727 | ? | ✗ | 06/10/16 |
| ZnO | ICSD | 290968 | P2_1 (4) | ✗ | 4 | 36 | 0 | 0.7688 | 0.769 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ZrTe | ICSD | 410867 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.093 | (1;100) | ✔ | 04/10/16 |
| PtO2 | ICSD | 24923 | P6_3mc (186) | ✗ | 6 | 44 | 2 | 1.4599 | 1.605 | 0.000 | (0;000) | ✗ | 06/10/16 |
| HgIBr | ICSD | 109010 | Ccm2_1 (36) | ✗ | 6 | 52 | 2 | 1.3842 | 1.389 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 100341 | P3_221 (154) | ✗ | 9 | 48 | 3 | 6.0022 | 6.297 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al4C3 | ICSD | 14397 | R3m (160) | ✗ | 7 | 24 | 3 | 0.8906 | 1.617 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 153453 | P3_1 (144) | ✗ | 9 | 48 | 0 | 5.9943 | 6.284 | 0.000 | (0;000) | ✗ | 06/10/16 |
| RbBrO3 | ICSD | 74768 | R3m (160) | ✗ | 5 | 34 | 1 | 4.0343 | 4.035 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 153886 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 5.6311 | 5.636 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C3N4 | ICSD | 246660 | R3m (160) | ✗ | 7 | 32 | 2 | 1.2528 | 1.275 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 154289 | P3_121 (152) | ✗ | 9 | 48 | 3 | 5.9953 | 6.285 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca3SiBr2 | ICSD | 89542 | R3m (160) | ✗ | 6 | 48 | 1 | 0.0 | 0.004 | 0.425 | ? | ✗ | 06/10/16 |
| SiO2 | ICSD | 162612 | P6_222 (180) | ✗ | 9 | 48 | 3 | 5.633 | 5.840 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CuN | ICSD | 161756 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.009 | 0.871 | (0;000) | ✔ | 06/10/16 |
| SiO2 | ICSD | 162660 | I-42d (122) | ✗ | 6 | 32 | 3 | 5.8944 | 5.894 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaCdPb | ICSD | 58877 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.000 | 0.383 | (1;000) | ✔ | 05/12/16 |
| SiO2 | ICSD | 170510 | I4_122 (98) | ✗ | 12 | 64 | 3 | 5.05 | 5.050 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C3N4 | ICSD | 248430 | P-6 (174) | ✗ | 7 | 32 | 1 | 0.0 | 0.001 | 0.871 | (0;000) | ✔ | 06/10/16 |
| SiO2 | ICSD | 170513 | R3 (146) | ✗ | 9 | 48 | 0 | 5.7129 | 5.713 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AgCN | ICSD | 85783 | R3m (160) | ✗ | 3 | 20 | 1 | 2.5177 | 3.110 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 413210 | Cc (9) | ✗ | 12 | 64 | 3 | 5.8723 | 5.872 | 0.000 | (0;000) | ✗ | 06/10/16 |
| C3N4 | ICSD | 83264 | P-43m (215) | ✗ | 7 | 32 | 3 | 2.5786 | 2.579 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75647 | I-4 (82) | ✗ | 12 | 64 | 3 | 5.8931 | 5.968 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BaCO3 | ICSD | 158389 | R3m (160) | ✗ | 5 | 32 | 1 | 3.7206 | 3.786 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75651 | P4_32_12 (96) | ✗ | 12 | 64 | 3 | 5.7082 | 5.708 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BeAu | ICSD | 58396 | P2_13 (198) | ✗ | 8 | 60 | 3 | 0.0 | 0.000 | 0.475 | (1;111) | ✔ | 06/10/16 |
| CaCl2 | ICSD | 51238 | Pm2_1n (31) | ✗ | 6 | 48 | 1 | 0.051 | 0.084 | 0.000 | (0;000) | ✔ | 06/10/16 |
| CdCN2 | ICSD | 95265 | R3m (160) | ✗ | 4 | 26 | 3 | 2.021 | 2.021 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75657 | C2 (5) | ✗ | 12 | 64 | 3 | 5.553 | 5.591 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaF2 | ICSD | 51239 | Pmc2_1 (26) | ✗ | 6 | 48 | 1 | 6.5997 | 6.813 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75665 | Pm (6) | ✗ | 12 | 64 | 3 | 3.8179 | 4.380 | 0.000 | (0;000) | ✗ | 06/10/16 |
| KCN | ICSD | 27350 | Cm (8) | ✗ | 3 | 18 | 1 | 4.9473 | 5.716 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75668 | Pc (7) | ✗ | 12 | 64 | 3 | 3.4494 | 3.876 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaSe | ICSD | 167834 | F-43m (216) | ✗ | 2 | 16 | 1 | 3.0584 | 3.136 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 75669 | P2 (3) | ✗ | 12 | 64 | 3 | 1.7784 | 1.964 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245418 | R3m (160) | ✗ | 9 | 64 | 3 | 2.2834 | 2.355 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiO2 | ICSD | 93975 | P6_422 (181) | ✗ | 9 | 48 | 3 | 5.9324 | 6.151 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca2Sb | ICSD | 154 | I4mm (107) | ✗ | 6 | 50 | 1 | 0.0 | 0.091 | 0.055 | (0;000) | ✔ | 06/10/16 |
| TeO2 | ICSD | 161691 | P4_12_12 (92) | ✗ | 12 | 72 | 3 | 2.4087 | 2.488 | 0.000 | (0;000) | ✗ | 06/10/16 |
| K4CO4 | ICSD | 245425 | I-4 (82) | ✗ | 9 | 64 | 3 | 3.5033 | 3.565 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdI2 | ICSD | 38116 | P6_3mc (186) | ✗ | 6 | 52 | 2 | 1.9181 | 2.127 | 0.000 | (0;000) | ✗ | 06/10/16 |
| AuN | ICSD | 167882 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.871 | (0;000) | ✔ | 06/10/16 |
| TeO2 | ICSD | 62897 | P4_32_12 (96) | ✗ | 12 | 72 | 3 | 2.9657 | 3.040 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Li4CO4 | ICSD | 245389 | R3m (160) | ✗ | 9 | 40 | 1 | 1.9001 | 1.995 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiO2 | ICSD | 189324 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.9234 | 0.923 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na4CO4 | ICSD | 245406 | P-43m (215) | ✗ | 9 | 64 | 1 | 2.7579 | 3.161 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TiO2 | ICSD | 41493 | P3_121 (152) | ✗ | 9 | 72 | 3 | 3.8185 | 3.903 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na4CO4 | ICSD | 245411 | C2 (5) | ✗ | 9 | 64 | 2 | 2.5966 | 2.872 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ReO3 | ICSD | 202338 | P6_322 (182) | ✗ | 8 | 66 | 3 | 0.0 | 0.001 | 0.569 | (1;101) | ✔ | 06/10/16 |
| CdPo | ICSD | 102047 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
| OsO4 | ICSD | 24672 | C2 (5) | ✗ | 5 | 40 | 1 | 4.2187 | 4.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Na4CO4 | ICSD | 245415 | R3 (146) | ✗ | 9 | 64 | 3 | 2.8246 | 3.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ta2O5 | ICSD | 280397 | C2 (5) | ✗ | 7 | 56 | 3 | 0.4534 | 1.346 | 0.000 | (0;000) | ✔ | 06/10/16 |
| LiB11 | ICSD | 164842 | R3m (160) | ✗ | 12 | 36 | 0 | 0.0 | 0.261 | 0.254 | (0;000) | ✔ | 06/10/16 |
| CdS | ICSD | 159379 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.1498 | 1.150 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Rb4CO4 | ICSD | 245433 | Cm (8) | ✗ | 9 | 64 | 3 | 1.0307 | 1.136 | 0.000 | (0;000) | ✗ | 06/10/16 |
| SiOs | ICSD | 15692 | P2_13 (198) | ✗ | 8 | 80 | 3 | 0.0821 | 0.090 | 0.000 | (0;000) | ✔ | 06/10/16 |
| Rb4CO4 | ICSD | 245437 | R3 (146) | ✗ | 9 | 64 | 3 | 2.8509 | 2.870 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdS | ICSD | 600773 | I2mm (44) | ✗ | 2 | 18 | 3 | 0.0 | 2.665 | 0.027 | (0;000) | ✔ | 06/10/16 |
| Rb4CO4 | ICSD | 245439 | I222 (23) | ✗ | 9 | 64 | 3 | 2.2513 | 2.375 | 0.000 | (0;000) | ✗ | 06/10/16 |
| ScP | ICSD | 188693 | F-43m (216) | ✗ | 2 | 16 | 3 | 1.5616 | 1.562 | 0.000 | (0;000) | ✗ | 06/10/16 |
| WN2 | ICSD | 290433 | P-6m2 (187) | ✗ | 3 | 24 | 3 | 0.8125 | 1.046 | 0.000 | (0;000) | ✗ | 06/10/16 |
| TaP | ICSD | 648185 | I4_1md (109) | ✗ | 4 | 36 | 3 | 0.0 | 0.050 | 0.015 | (1;001) | ✔ | 06/10/16 |
| LiAuC2 | ICSD | 411253 | P-6m2 (187) | ✗ | 4 | 22 | 1 | 1.3575 | 1.469 | 0.000 | (0;000) | ✗ | 06/10/16 |
| YMgAg | ICSD | 104477 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.002 | 0.929 | ? | ✗ | 06/10/16 |
| TlP | ICSD | 184576 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.014 | (1;000) | ✔ | 06/10/16 |
| CdS | ICSD | 60629 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 1.2121 | 1.212 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BC2N | ICSD | 191799 | P-4m2 (115) | ✗ | 4 | 16 | 3 | 1.4495 | 2.182 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdSe | ICSD | 180931 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3656 | 0.366 | 0.000 | (0;000) | ✔ | 06/10/16 |
| BC2N | ICSD | 93040 | P2_122 (17) | ✗ | 8 | 32 | 3 | 1.9946 | 1.995 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Fe2B | ICSD | 16809 | I-42m (121) | ✗ | 6 | 38 | 3 | 0.0 | 0.009 | 0.613 | (0;000) | ✔ | 06/10/16 |
| Cd(CN)2 | ICSD | 20748 | P-43m (215) | ✗ | 10 | 60 | 3 | 6.5073 | 6.601 | 0.000 | (0;000) | ✗ | 06/10/16 |
| PbS | ICSD | 183243 | R3m (160) | ✗ | 2 | 20 | 2 | 0.9607 | 0.966 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdSe | ICSD | 415786 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.5591 | 0.559 | 0.000 | (0;000) | ✗ | 06/10/16 |
| PbS | ICSD | 183245 | P-6m2 (187) | ✗ | 2 | 20 | 3 | 0.0 | 0.584 | 0.111 | (0;000) | ✔ | 06/10/16 |
| YCoC2 | ICSD | 617468 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.032 | 0.257 | (0;000) | ✔ | 06/10/16 |
| PbS | ICSD | 183249 | Pbm2 (28) | ✗ | 8 | 80 | 2 | 0.8462 | 1.424 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdTe | ICSD | 108237 | Pm2m (25) | ✗ | 2 | 18 | 3 | 0.0 | 0.032 | 0.374 | (0;110) | ✔ | 06/10/16 |
| PbS | ICSD | 183255 | P6_3mc (186) | ✗ | 4 | 40 | 2 | 0.8123 | 1.012 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Al6C3N2 | ICSD | 654993 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.000 | 0.475 | (0;000) | ✔ | 06/10/16 |
| PbS | ICSD | 68701 | Cm2e (39) | ✗ | 4 | 40 | 2 | 1.0016 | 1.003 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdTe | ICSD | 108238 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.528 | 0.528 | 0.000 | (0;000) | ✗ | 06/10/16 |
| PbS | ICSD | 68712 | C2 (5) | ✗ | 4 | 40 | 2 | 1.0591 | 1.094 | 0.000 | (0;000) | ✗ | 06/10/16 |
| Ca3ZnSe4 | ICSD | 167833 | P-43m (215) | ✗ | 8 | 66 | 1 | 1.9339 | 2.000 | 0.000 | (0;000) | ✗ | 06/10/16 |
| PbSe | ICSD | 74334 | F2mm (42) | ✗ | 4 | 40 | 2 | 0.9339 | 0.934 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BN | ICSD | 162877 | Cm (8) | ✗ | 8 | 32 | 3 | 1.5525 | 1.567 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CdTe | ICSD | 150941 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.5613 | 0.561 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaIrO3 | ICSD | 159031 | Cmc2_1 (36) | ✗ | 10 | 74 | 2 | 0.0 | 0.000 | 0.393 | ? | ✗ | 06/10/16 |
| ZnPo | ICSD | 105771 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
| Mn2Ge | ICSD | 184947 | F-43m (216) | ✗ | 3 | 34 | 3 | 0.0 | 0.020 | 0.242 | (1;000) | ✔ | 04/10/16 |
| CdTe | ICSD | 67862 | P3_121 (152) | ✗ | 6 | 54 | 3 | 0.5051 | 0.741 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CaSiPt | ICSD | 72640 | P2_13 (198) | ✗ | 12 | 96 | 3 | 0.0 | 0.000 | 0.533 | (0;000) | ✔ | 05/12/16 |
| CuCl | ICSD | 23988 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3607 | 0.361 | 0.000 | (0;000) | ✔ | 06/10/16 |
| HgO | ICSD | 16627 | Im2m (44) | ✗ | 2 | 18 | 3 | 0.0 | 0.002 | 0.206 | (1;000) | ✔ | 04/10/16 |
| RbSb | ICSD | 191491 | F-43m (216) | ✗ | 2 | 14 | 1 | 0.0 | 0.000 | 0.134 | (0;000) | ✔ | 06/10/16 |
| Cd(GaTe2)2 | ICSD | 603660 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9356 | 0.936 | 0.000 | (0;000) | ✗ | 06/10/16 |
| BN | ICSD | 162880 | Cc (9) | ✗ | 8 | 32 | 3 | 3.3515 | 4.168 | 0.000 | (0;000) | ✗ | 06/10/16 |
| CsNO2 | ICSD | 50328 | P3_121 (152) | ✗ | 12 | 78 | 1 | 2.8488 | 3.021 | 0.000 | (0;000) | ✗ | 28/10/16 |