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| ▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| KZn4(SbO4)3 | ICSD | 421547 | R3 (146) | ✗ | 20 | 144 | 3 | 2.0098 | 2.183 | 0.000 | (0;000) | ✗ | 29/03/17 |
| KP | COD | 1528278 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 1.2133 | 1.213 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Li2Si2O5 | COD | 2003027 | Ccc2 (37) | ✗ | 18 | 88 | 1 | 5.4712 | 5.559 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Li4SiPt3 | ICSD | 186537 | R32 (155) | ✗ | 16 | 92 | 3 | 0.0 | 0.008 | 0.538 | ? | ✗ | 29/03/17 |
| LiVO3 | ICSD | 23477 | Cc (9) | ✗ | 20 | 136 | 3 | 0.8008 | 0.885 | 0.000 | (0;000) | ✗ | 29/03/17 |
| MgTeMoO6 | ICSD | 184714 | P2_12_12 (18) | ✗ | 18 | 132 | 2 | 3.1056 | 3.166 | 0.000 | (0;000) | ✗ | 29/03/17 |
| MgPt | ICSD | 109237 | P2_13 (198) | ✗ | 8 | 80 | 3 | 0.0 | 0.032 | 0.308 | (1;000) | ✔ | 29/03/17 |
| Hg | ICSD | 31091 | I-42d (122) | ✗ | 4 | 48 | 1 | 3.9013 | 3.933 | 0.000 | (0;000) | ✗ | 29/03/17 |
| TaMnSi | ICSD | 643652 | Ima2 (46) | ✗ | 18 | 192 | 3 | 0.0 | 0.007 | 0.448 | ? | ✗ | 29/03/17 |
| N2O3 | ICSD | 80890 | P2_12_12_1 (19) | ✗ | 20 | 112 | 1 | 1.128 | 1.175 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na2ZnSiO4 | COD | 1009030 | Pc (7) | ✗ | 16 | 116 | 3 | 3.1876 | 3.392 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnO3 | ICSD | 49624 | Cc (9) | ✗ | 16 | 136 | 1 | 1.9151 | 2.076 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Na4SnSe4 | ICSD | 72384 | P-42_1c (114) | ✗ | 18 | 148 | 1 | 1.5747 | 1.575 | 0.000 | (0;000) | ✗ | 29/03/17 |
| NaSb(PS3)2 | ICSD | 155270 | P2_1 (4) | ✗ | 20 | 120 | 2 | 1.9131 | 2.022 | 0.000 | (0;000) | ✗ | 29/03/17 |
| NaSn5 | ICSD | 408045 | P-42_1m (113) | ✗ | 12 | 158 | 3 | 0.0 | 0.000 | 0.851 | ? | ✗ | 29/03/17 |
| Nb3VSe6 | ICSD | 645400 | P6_322 (182) | ✗ | 20 | 176 | 3 | 0.0 | 0.001 | 0.427 | ? | ✗ | 29/03/17 |
| Nb3P | ICSD | 626510 | I-4 (82) | ✗ | 16 | 176 | 3 | 0.0 | 0.005 | 0.557 | ? | ✗ | 29/03/17 |
| NbSe2 | COD | 2310534 | P-6m2 (187) | ✗ | 12 | 100 | 1 | 0.0 | 0.000 | 0.950 | ? | ✗ | 29/03/17 |
| TePbO3 | ICSD | 61343 | P4_1 (76) | ✗ | 20 | 152 | 3 | 2.5754 | 2.799 | 0.000 | (0;000) | ✗ | 29/03/17 |
| SiO2 | ICSD | 155251 | P3_221 (154) | ✗ | 9 | 48 | 1 | 2.2214 | 2.340 | 0.000 | (0;000) | ✗ | 29/03/17 |
| SiO2 | COD | 9006289 | Ima2 (46) | ✗ | 12 | 64 | 3 | 5.7343 | 6.013 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Pb3SeO5 | COD | 9015251 | Cmc2_1 (36) | ✗ | 18 | 156 | 3 | 2.4974 | 2.498 | 0.000 | (0;000) | ✗ | 29/03/17 |
| SiP2O7 | ICSD | 75116 | P6_3 (173) | ✗ | 20 | 112 | 3 | 5.2461 | 5.246 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Te2SO7 | COD | 7035628 | Pmn2_1 (31) | ✗ | 20 | 120 | 3 | 3.4249 | 3.454 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Ti(PS3)2 | COD | 1528603 | Fdd2 (43) | ✗ | 18 | 116 | 3 | 1.3284 | 1.359 | 0.000 | (0;000) | ✗ | 29/03/17 |
| P4S5 | ICSD | 16681 | P2_1 (4) | ✗ | 18 | 100 | 1 | 2.3253 | 2.383 | 0.000 | (0;000) | ✗ | 29/03/17 |
| ScSnPd | ICSD | 418976 | P-62c (190) | ✗ | 18 | 258 | 3 | 0.0 | 0.000 | 0.486 | ? | ✗ | 29/03/17 |
| SrSiPt | ICSD | 604437 | P2_13 (198) | ✗ | 12 | 96 | 3 | 0.0 | 0.000 | 0.544 | ? | ✗ | 29/03/17 |
| RbSbS2 | COD | 1530127 | P1 (1) | ✗ | 16 | 104 | 1 | 1.8665 | 1.867 | 0.000 | (0;000) | ✗ | 29/03/17 |
| TaReSi | ICSD | 600060 | Ima2 (46) | ✗ | 18 | 192 | 3 | 0.0 | 0.002 | 0.418 | ? | ✗ | 29/03/17 |
| TiSiRu | COD | 1523929 | Ima2 (46) | ✗ | 18 | 192 | 3 | 0.0 | 0.023 | 0.597 | ? | ✗ | 29/03/17 |
| TlV5S8 | COD | 1524378 | C2 (5) | ✗ | 14 | 126 | 3 | 0.0 | 0.001 | 0.550 | ? | ✗ | 29/03/17 |
| Y4Sb3 | ICSD | 651736 | I-43d (220) | ✗ | 14 | 118 | 3 | 0.0 | 0.000 | 0.865 | ? | ✗ | 29/03/17 |
| TaSe2 | ICSD | 26249 | P6_3mc (186) | ✗ | 12 | 100 | 1 | 0.0 | 0.046 | 0.847 | ? | ✗ | 29/03/17 |
| ZnS | ICSD | 107134 | P3m1 (156) | ✗ | 16 | 144 | 3 | 2.1006 | 2.101 | 0.000 | (0;000) | ✗ | 29/03/17 |
| Tl2Te3 | ICSD | 26282 | Cc (9) | ✗ | 10 | 88 | 3 | 0.0 | 0.015 | 1.000 | ? | ✗ | 29/03/17 |
| SrP | ICSD | 26262 | P-62m (189) | ✗ | 12 | 90 | 1 | 0.4592 | 1.096 | 0.000 | (0;000) | ✔ | 10/04/17 |
| SnRh | COD | 7221174 | P2_13 (198) | ✗ | 8 | 124 | 3 | 0.0 | 0.000 | 0.365 | (0;100) | ✔ | 10/04/17 |
| AgH4WS4N | ICSD | 84370 | I-4 (82) | ✗ | 11 | 72 | 1 | 1.6977 | 1.953 | 0.000 | (0;000) | ✗ | 11/04/17 |
| BiRhSe | ICSD | 617014 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.1987 | 0.640 | 0.000 | (0;000) | ✔ | 11/04/17 |
| Sr2CaMoO6 | ICSD | 72816 | Pmm2 (25) | ✗ | 20 | 160 | 1 | 1.9934 | 1.993 | 0.000 | (0;000) | ✗ | 11/04/17 |
| CS2 | COD | 9014813 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 0.2875 | 0.641 | 0.000 | (0;000) | ✔ | 11/04/17 |
| SiCu2HgTe4 | ICSD | 656152 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.014 | 0.110 | (1;000) | ✔ | 11/04/17 |
| Na2MnP2O7F3 | ICSD | 424943 | P1 (1) | ✗ | 15 | 106 | 1 | 0.0 | 0.012 | 0.059 | (1;100) | ✔ | 11/04/17 |
| NaFeO2 | COD | 1009034 | Pna2_1 (33) | ✗ | 16 | 116 | 3 | 0.0 | 0.002 | 0.324 | (0;101) | ✔ | 11/04/17 |
| Tl2HgGeTe4 | COD | 4000659 | I-42m (121) | ✗ | 8 | 66 | 3 | 0.0 | 0.076 | 0.127 | (0;000) | ✔ | 11/04/17 |
| ZrI2 | ICSD | 24807 | Pmn2_1 (31) | ✗ | 12 | 72 | 2 | 0.173 | 0.239 | 0.000 | (0;000) | ✔ | 11/04/17 |
| W3O8 | COD | 2101049 | C222 (21) | ✗ | 11 | 132 | 3 | 0.0 | 0.000 | 0.791 | ? | ✗ | 11/04/17 |
| RbSbSe2 | ICSD | 602244 | P1 (1) | ✗ | 16 | 104 | 3 | 0.0 | 0.017 | 0.026 | (0;101) | ✔ | 11/04/17 |
| TlSbSe2 | ICSD | 36537 | P2_1 (4) | ✗ | 16 | 120 | 3 | 0.475 | 0.475 | 0.000 | (0;000) | ✔ | 11/04/17 |
| In5AgSe8 | COD | 1509418 | P-42m (111) | ✗ | 14 | 124 | 3 | 0.2057 | 0.231 | 0.000 | (0;000) | ✔ | 13/04/17 |
| Bi2PdO4 | COD | 2002219 | I4cm (108) | ✗ | 14 | 144 | 3 | 0.0 | 0.002 | 0.167 | (0;000) | ✔ | 13/04/17 |
| BaAs2 | ICSD | 414139 | Pc (7) | ✗ | 18 | 120 | 1 | 0.3452 | 0.346 | 0.000 | (0;000) | ✔ | 24/04/17 |
| CsSO3 | COD | 9015381 | P-62c (190) | ✗ | 20 | 132 | 3 | 0.0 | 0.025 | 0.071 | (0;000) | ✔ | 24/04/17 |
| W3O10 | COD | 9014468 | Fmm2 (42) | ✗ | 13 | 144 | 3 | 0.0 | 0.002 | 0.261 | (0;010) | ✔ | 24/04/17 |
| AgAsS | ICSD | 604740 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.029 | 0.147 | (1;000) | ✔ | 26/04/17 |
| BaAsPt | ICSD | 59192 | P2_13 (198) | ✗ | 12 | 100 | 3 | 0.0 | 0.000 | 0.396 | (0;111) | ✔ | 26/04/17 |
| Bi4Te2Br2O9 | ICSD | 79508 | Pmm2 (25) | ✗ | 17 | 140 | 1 | 0.0 | 0.086 | 0.192 | (0;000) | ✔ | 26/04/17 |
| CdSi(CuS2)2 | ICSD | 16924 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.4888 | 0.489 | 0.000 | (0;000) | ✔ | 26/04/17 |
| GePd2 | ICSD | 637541 | P-62m (189) | ✗ | 9 | 120 | 3 | 0.0 | 0.000 | 0.358 | (0;000) | ✔ | 26/04/17 |
| SiPt2 | ICSD | 649614 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.0 | 0.000 | 0.290 | (1;000) | ✔ | 26/04/17 |
| Ag2Se | COD | 1509714 | P222_1 (17) | ✗ | 12 | 112 | 3 | 0.0 | 0.007 | 0.173 | ? | ✗ | 04/08/17 |
| RbAgSe4 | COD | 1509517 | P2_12_12_1 (19) | ✗ | 24 | 176 | 1 | 1.1675 | 1.168 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ca4Al6O13 | COD | 1527947 | I-43m (217) | ✗ | 23 | 136 | 3 | 3.3952 | 3.473 | 0.000 | (0;000) | ✗ | 04/08/17 |
| KAlCl4 | COD | 1004038 | P2_1 (4) | ✗ | 24 | 160 | 1 | 5.4874 | 5.504 | 0.000 | (0;000) | ✗ | 04/08/17 |
| K7TaAs4 | ICSD | 380110 | Pmn2_1 (31) | ✗ | 24 | 192 | 1 | 1.1533 | 1.155 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Cd3Au | COD | 1510082 | P6_3cm (185) | ✗ | 24 | 282 | 3 | 0.0 | 0.000 | 0.689 | ? | ✗ | 04/08/17 |
| NaB3H8 | COD | 4337144 | Pmn2_1 (31) | ✗ | 24 | 52 | 1 | 6.0511 | 6.152 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Zr(BH4)4 | COD | 1508533 | P-43m (215) | ✗ | 21 | 32 | 1 | 5.126 | 5.409 | 0.000 | (0;000) | ✗ | 04/08/17 |
| SrB4O7 | COD | 1511501 | Pmn2_1 (31) | ✗ | 24 | 128 | 3 | 4.9996 | 5.180 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ba4Br6O | ICSD | 391435 | P6_3mc (186) | ✗ | 22 | 176 | 1 | 4.3875 | 4.435 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BaSO4 | ICSD | 186427 | P2_12_12_1 (19) | ✗ | 24 | 160 | 3 | 6.0821 | 6.211 | 0.000 | (0;000) | ✗ | 04/08/17 |
| BaPt2S3 | COD | 1530109 | P4_12_12 (92) | ✗ | 24 | 192 | 3 | 1.0174 | 1.212 | 0.000 | (0;000) | ✗ | 04/08/17 |
| NaInBr4 | ICSD | 65462 | P2_12_12_1 (19) | ✗ | 24 | 200 | 1 | 2.8544 | 2.854 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Pb7(BrF6)2 | COD | 1519065 | P-6 (174) | ✗ | 21 | 196 | 3 | 3.5865 | 3.621 | 0.000 | (0;000) | ✗ | 04/08/17 |
| H3C2O | COD | 2005623 | Fdd2 (43) | ✗ | 24 | 68 | 2 | 4.9086 | 5.077 | 0.000 | (0;000) | ✗ | 04/08/17 |
| H5C4N3 | COD | 2015716 | P2_1 (4) | ✗ | 24 | 72 | 1 | 4.7935 | 4.813 | 0.000 | (0;000) | ✗ | 04/08/17 |
| H10C9O4 | COD | 2229064 | P1 (1) | ✗ | 23 | 70 | 1 | 3.3437 | 3.523 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ca7(H6Cl)2 | ICSD | 420927 | P-6 (174) | ✗ | 21 | 96 | 1 | 3.6609 | 3.728 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CdI2 | ICSD | 35258 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9696 | 2.157 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CdI2 | ICSD | 42283 | P3m1 (156) | ✗ | 24 | 208 | 1 | 1.9296 | 2.144 | 0.000 | (0;000) | ✗ | 04/08/17 |
| H2CO | ICSD | 151343 | R3c (161) | ✗ | 24 | 72 | 3 | 6.4755 | 6.532 | 0.000 | (0;000) | ✗ | 04/08/17 |
| PW6Cl17 | ICSD | 422270 | Imm2 (44) | ✗ | 24 | 292 | 2 | 0.0 | 0.003 | 0.428 | ? | ✗ | 04/08/17 |
| RbCuCl3 | COD | 1527259 | C2 (5) | ✗ | 20 | 164 | 1 | 0.0 | 0.024 | 0.396 | ? | ✗ | 04/08/17 |
| RuCl3 | ICSD | 20717 | P3_112 (151) | ✗ | 24 | 222 | 2 | 0.0 | 0.009 | 0.598 | ? | ✗ | 04/08/17 |
| SbCl4F | ICSD | 74783 | I-4 (82) | ✗ | 24 | 160 | 1 | 1.7328 | 1.733 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Sn2ClF3 | COD | 4031432 | P2_12_12_1 (19) | ✗ | 24 | 224 | 3 | 3.5136 | 3.539 | 0.000 | (0;000) | ✗ | 04/08/17 |
| CoSI | COD | 9016371 | F-43m (216) | ✗ | 3 | 30 | 1 | 0.0 | 0.001 | 0.251 | ? | ✗ | 04/08/17 |
| CrSbPt | ICSD | 626558 | P2_13 (198) | ✗ | 12 | 116 | 3 | 0.0 | 0.000 | 0.335 | ? | ✗ | 04/08/17 |
| NaCu5S3 | ICSD | 61514 | P6_322 (182) | ✗ | 18 | 164 | 3 | 0.0 | 0.000 | 0.127 | ? | ✗ | 04/08/17 |
| Sr4Zn3F14 | COD | 4030525 | Cm (8) | ✗ | 21 | 174 | 2 | 4.8861 | 4.909 | 0.000 | (0;000) | ✗ | 04/08/17 |
| K3TaF8 | COD | 2017527 | P6_3mc (186) | ✗ | 24 | 192 | 1 | 3.6455 | 3.650 | 0.000 | (0;000) | ✗ | 04/08/17 |
| FeSbPt | ICSD | 633196 | P2_13 (198) | ✗ | 12 | 92 | 3 | 0.0 | 0.000 | 0.392 | ? | ✗ | 04/08/17 |
| Ga4SnS7 | COD | 4001920 | Pc (7) | ✗ | 24 | 216 | 3 | 2.3502 | 2.560 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Ta3Ge | ICSD | 637967 | I-4 (82) | ✗ | 16 | 172 | 3 | 0.0 | 0.024 | 0.284 | ? | ✗ | 04/08/17 |
| Ta3SeI7 | ICSD | 82791 | P6_3mc (186) | ✗ | 22 | 188 | 2 | 0.5635 | 0.581 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Mg3Ir | ICSD | 106871 | P6_3cm (185) | ✗ | 24 | 282 | 3 | 0.0 | 0.000 | 0.680 | ? | ✗ | 04/08/17 |
| K3NiO2 | COD | 1517826 | P4_12_12 (92) | ✗ | 24 | 196 | 3 | 0.0 | 0.000 | 0.581 | ? | ✗ | 04/08/17 |
| Li8TeN2 | ICSD | 247257 | I4_1md (109) | ✗ | 22 | 80 | 1 | 2.2789 | 2.280 | 0.000 | (0;000) | ✗ | 04/08/17 |
| Mg3Rh | ICSD | 413720 | P6_3cm (185) | ✗ | 24 | 282 | 3 | 0.0 | 0.000 | 0.706 | ? | ✗ | 04/08/17 |