▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Zr6Ga2Ni | ICSD | 635001 | P-62m (189) | ✗ | 9 | 60 | 3 | 0.0 | 0.000 | 0.836 | ? | ✗ | 06/10/16 |
CaSiPt | ICSD | 63555 | P2_13 (198) | ✗ | 12 | 96 | 3 | 0.0 | 0.000 | 0.533 | ? | ✗ | 22/03/17 |
Nb3B3C | ICSD | 411622 | Cmcm (63) | ✔ | 14 | 104 | 3 | 0.0 | 0.012 | 0.523 | (1;110) | ✗ | 22/03/17 |
Sr2ZnCu2(SO)2 | ICSD | 84735 | I4/mmm (139) | ✔ | 9 | 78 | 3 | 0.6692 | 1.036 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 44886 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.4117 | 2.412 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cr3C | ICSD | 617486 | Pnma (62) | ✔ | 16 | 184 | 3 | 0.0 | 0.011 | 0.371 | (1;000) | ✗ | 22/03/17 |
Cr5Si3C | ICSD | 617535 | P6_3/mcm (193) | ✔ | 18 | 172 | 3 | 0.0 | 0.005 | 0.862 | (0;000) | ✗ | 22/03/17 |
SiO2 | ICSD | 93975 | P6_422 (181) | ✗ | 9 | 48 | 3 | 5.9324 | 6.151 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsC | ICSD | 51533 | P-62m (189) | ✗ | 12 | 78 | 3 | 2.1594 | 2.159 | 0.000 | (0;000) | ✗ | 22/03/17 |
V2Cd2O7 | ICSD | 62081 | C2/m (12) | ✔ | 11 | 92 | 3 | 2.6098 | 2.817 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ti3Hg | COD | 1523041 | Pm-3n (223) | ✔ | 8 | 96 | 3 | 0.0 | 0.009 | 0.349 | (1;000) | ✗ | 27/01/17 |
Tl2(CdSb)3 | ICSD | 76500 | C2/m (12) | ✔ | 16 | 154 | 3 | 0.0 | 0.146 | 0.038 | (0;000) | ✗ | 22/03/17 |
HgTe | ICSD | 56658 | Cmcm (63) | ✔ | 4 | 36 | 3 | 0.0 | 0.062 | 0.439 | (0;110) | ✗ | 27/01/17 |
Cs4CdNi3F12 | COD | 1008268 | R-3m (166) | ✔ | 20 | 162 | 3 | 0.0 | 0.009 | 0.207 | (1;111) | ✗ | 22/03/17 |
Co3C | ICSD | 43521 | Pnma (62) | ✔ | 16 | 220 | 3 | 0.0 | 0.000 | 0.581 | (0;110) | ✗ | 22/03/17 |
CdCu2GeS4 | ICSD | 26150 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.6433 | 0.644 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdCu2GeTe4 | ICSD | 656154 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0 | 0.009 | 0.129 | (1;000) | ✔ | 22/03/17 |
CdSi(CuSe2)2 | ICSD | 619783 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.5507 | 0.551 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdSi(CuTe2)2 | ICSD | 656151 | I-42m (121) | ✗ | 8 | 62 | 3 | 0.0221 | 0.022 | 0.000 | (0;000) | ✔ | 22/03/17 |
CdCu2SnTe4 | ICSD | 656157 | I-42m (121) | ✗ | 8 | 72 | 3 | 0.0068 | 0.021 | 0.000 | (1;000) | ✔ | 22/03/17 |
Zn(GaS2)2 | ICSD | 53604 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2825 | 2.283 | 0.000 | (0;000) | ✗ | 06/10/16 |
LaSn2 | ICSD | 657383 | Cmmm (65) | ✔ | 6 | 62 | 3 | 0.0 | 0.011 | 0.391 | (1;000) | ✗ | 06/10/16 |
Tl2CdGeTe4 | COD | 4000657 | I-42m (121) | ✗ | 8 | 66 | 3 | 0.0 | 0.139 | 0.086 | (0;000) | ✔ | 22/03/17 |
Ti3Hg | COD | 1522698 | Pm-3m (221) | ✔ | 4 | 48 | 3 | 0.0 | 0.014 | 0.459 | (1;000) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 63242 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.316 | 2.316 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgTe | COD | 1010537 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.386 | (0;000) | ✗ | 27/01/17 |
Zr3Hg | ICSD | 104375 | Pm-3n (223) | ✔ | 8 | 48 | 3 | 0.0 | 0.009 | 0.473 | (1;000) | ✗ | 27/01/17 |
AuN | ICSD | 167882 | F-43m (216) | ✗ | 2 | 16 | 3 | 0.0 | 0.000 | 0.871 | (0;000) | ✔ | 06/10/16 |
Zn(GaS2)2 | ICSD | 635295 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.5013 | 2.501 | 0.000 | (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 |
Cu2PbO2 | ICSD | 400657 | C2/c (15) | ✔ | 10 | 96 | 3 | 0.7561 | 0.900 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 635296 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2727 | 2.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cu2NiSn | COD | 1525227 | Fm-3m (225) | ✔ | 4 | 46 | 3 | 0.0 | 0.007 | 0.909 | (0;000) | ✗ | 27/01/17 |
La2O3 | ICSD | 56166 | P-3m1 (164) | ✔ | 5 | 24 | 3 | 3.0056 | 3.250 | 0.000 | (0;000) | ✗ | 06/10/16 |
CdBiClO2 | COD | 2012362 | P2_1/m (11) | ✔ | 10 | 92 | 3 | 2.8582 | 3.016 | 0.000 | (0;000) | ✗ | 05/01/17 |
Zn(GaS2)2 | ICSD | 635305 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2683 | 2.268 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrHg | COD | 1522699 | P4/mmm (123) | ✔ | 2 | 16 | 3 | 0.0 | 0.021 | 0.404 | (1;001) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 635306 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.5119 | 2.512 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnCu2Ni | COD | 2310325 | P4/mmm (123) | ✔ | 4 | 44 | 3 | 0.0 | 0.019 | 0.327 | (1;000) | ✗ | 27/01/17 |
Na2CdSnS4 | COD | 7011307 | C2 (5) | ✗ | 8 | 68 | 3 | 2.0139 | 2.014 | 0.000 | (0;000) | ✗ | 22/03/17 |
TiCdO3 | ICSD | 51698 | Pmc2_1 (26) | ✗ | 20 | 168 | 3 | 0.0 | 0.005 | 0.548 | ? | ✗ | 22/03/17 |
TiCdO3 | COD | 2310616 | Pna2_1 (33) | ✗ | 20 | 168 | 3 | 1.9899 | 1.990 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdP2 | ICSD | 42732 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 1.4322 | 1.723 | 0.000 | (0;000) | ✗ | 22/03/17 |
Tl2CdSnTe4 | COD | 4000658 | I-42m (121) | ✗ | 8 | 76 | 3 | 0.0 | 0.255 | 0.021 | (0;000) | ✔ | 22/03/17 |
Na3MgP2HO8 | COD | 2004175 | P-1 (2) | ✔ | 15 | 96 | 3 | 5.0699 | 5.070 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrCu2O3 | COD | 1532418 | Pmmn (59) | ✔ | 12 | 100 | 3 | 0.0 | 0.002 | 0.729 | (0;000) | ✗ | 27/01/17 |
Tl(CuO)2 | ICSD | 36535 | Imma (74) | ✔ | 10 | 94 | 3 | 0.0 | 0.004 | 0.531 | (1;101) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 656808 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.427 | 2.427 | 0.000 | (0;000) | ✗ | 06/10/16 |
TeO2 | ICSD | 166847 | P2_1/m (11) | ✔ | 12 | 72 | 3 | 2.4449 | 2.506 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr(CuO)2 | ICSD | 25002 | I4_1/amd (141) | ✔ | 10 | 88 | 3 | 1.8259 | 1.826 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(GaS2)2 | ICSD | 659772 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.4135 | 2.414 | 0.000 | (0;000) | ✗ | 06/10/16 |
CuBiSeO | ICSD | 75128 | P4/nmm (129) | ✔ | 8 | 76 | 3 | 0.0992 | 0.171 | 0.000 | (0;000) | ✗ | 05/01/17 |
SrCu2O3 | ICSD | 416903 | Cmmm (65) | ✔ | 6 | 50 | 3 | 0.0 | 0.005 | 0.916 | (0;000) | ✗ | 27/01/17 |
CuBiTeO | ICSD | 187824 | P4/nmm (129) | ✔ | 8 | 76 | 3 | 0.0 | 0.011 | 0.156 | (1;001) | ✗ | 05/01/17 |
Zn(GaSe2)2 | ICSD | 168594 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.5712 | 1.571 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr2YTlCu2O7 | ICSD | 74164 | P4/mmm (123) | ✔ | 13 | 108 | 3 | 0.0 | 0.012 | 0.953 | (1;111) | ✗ | 27/01/17 |
BiF3 | COD | 7202532 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 3.1637 | 3.298 | 0.000 | (0;000) | ✗ | 05/01/17 |
Zn(GaSe2)2 | ICSD | 44887 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.5742 | 1.574 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cu2SO5 | COD | 9009694 | C2/m (12) | ✔ | 16 | 116 | 3 | 0.0 | 0.068 | 0.073 | (0;000) | ✗ | 27/01/17 |
Hg3(SCl)2 | COD | 9011080 | I2_13 (199) | ✗ | 14 | 124 | 3 | 2.0084 | 2.031 | 0.000 | (0;000) | ✗ | 22/03/17 |
Hg3(SeCl)2 | ICSD | 27400 | I2_13 (199) | ✗ | 14 | 124 | 3 | 2.016 | 2.044 | 0.000 | (0;000) | ✗ | 22/03/17 |
Hg3(TeCl)2 | ICSD | 27401 | I2_13 (199) | ✗ | 14 | 124 | 3 | 2.0054 | 2.047 | 0.000 | (0;000) | ✗ | 22/03/17 |
TeO2 | ICSD | 62897 | P4_32_12 (96) | ✗ | 12 | 72 | 3 | 2.9657 | 3.040 | 0.000 | (0;000) | ✗ | 06/10/16 |
Pb(ClO3)2 | ICSD | 40286 | Fdd2 (43) | ✗ | 18 | 128 | 3 | 3.7072 | 3.713 | 0.000 | (0;000) | ✗ | 22/03/17 |
Zn(GaTe2)2 | ICSD | 290911 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.7463 | 0.848 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mg3Sn | ICSD | 70069 | P-1 (2) | ✔ | 8 | 88 | 3 | 0.0 | 0.000 | 0.622 | (1;001) | ✗ | 06/10/16 |
ZnCl2 | COD | 4343817 | Pna2_1 (33) | ✗ | 12 | 104 | 3 | 3.8314 | 3.832 | 0.000 | (0;000) | ✗ | 22/03/17 |
Y(CuO2)2 | ICSD | 83493 | C2/c (15) | ✔ | 14 | 114 | 3 | 0.0 | 0.000 | 0.368 | (1;101) | ✗ | 27/01/17 |
Zn(GaTe2)2 | ICSD | 44888 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.8143 | 0.814 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cu2SO4 | ICSD | 40452 | Fddd (70) | ✔ | 14 | 104 | 3 | 1.4434 | 1.459 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cu2P2O7 | ICSD | 27436 | C2/m (12) | ✔ | 11 | 74 | 3 | 0.0 | 0.008 | 0.529 | (0;000) | ✗ | 27/01/17 |
Zn(GaTe2)2 | ICSD | 635531 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.7942 | 0.794 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi | ICSD | 42679 | P2_1/m (11) | ✔ | 4 | 60 | 3 | 0.0 | 0.015 | 0.308 | (1;111) | ✗ | 05/01/17 |
GaCuCl4 | ICSD | 300103 | P-42c (112) | ✗ | 12 | 104 | 3 | 1.9742 | 2.030 | 0.000 | (0;000) | ✗ | 22/03/17 |
Bi | ICSD | 51674 | I4/mcm (140) | ✔ | 4 | 60 | 3 | 0.0 | 0.037 | 0.408 | (1;100) | ✗ | 05/01/17 |
MnO2 | ICSD | 20227 | I4/m (87) | ✔ | 12 | 108 | 3 | 0.0 | 0.001 | 0.936 | (1;000) | ✗ | 06/10/16 |
In2Bi | COD | 1527697 | P6_3/mmc (194) | ✔ | 6 | 82 | 3 | 0.0 | 0.000 | 0.715 | (0;000) | ✗ | 05/01/17 |
Ga3PO7 | ICSD | 162060 | P1 (1) | ✗ | 11 | 86 | 3 | 3.5259 | 3.528 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrIn2Ir | ICSD | 410401 | Cmcm (63) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.784 | (0;110) | ✗ | 27/01/17 |
Cu3Ge | ICSD | 627678 | Pmmn (59) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.936 | (1;010) | ✗ | 27/01/17 |
Cu2S | ICSD | 166578 | P6_3/mmc (194) | ✔ | 6 | 56 | 3 | 0.0 | 0.031 | 0.151 | (0;000) | ✗ | 27/01/17 |
TiO2 | ICSD | 189324 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.9234 | 0.923 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs3Mg2Cl7 | ICSD | 66828 | I4/mmm (139) | ✔ | 12 | 96 | 3 | 4.7144 | 4.868 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ga3PO7 | ICSD | 59364 | R3m (160) | ✗ | 11 | 86 | 3 | 3.6094 | 3.626 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnP | ICSD | 30412 | Pmnb (62) | ✔ | 8 | 80 | 3 | 0.0 | 0.004 | 0.259 | (1;000) | ✗ | 06/10/16 |
Cu2Se | ICSD | 56025 | Fm-3m (225) | ✔ | 3 | 28 | 3 | 0.0 | 0.000 | 0.022 | (1;000) | ✗ | 27/01/17 |
Rb3Mn2Cl7 | COD | 1531071 | I4/mmm (139) | ✔ | 12 | 106 | 3 | 0.0 | 0.001 | 0.860 | (0;000) | ✗ | 22/03/17 |
LiYGa4 | ICSD | 98666 | P-6m2 (187) | ✗ | 6 | 66 | 3 | 0.0 | 0.004 | 0.244 | (0;000) | ✔ | 05/12/16 |
Cu2Sb | COD | 9008317 | P4/nmm (129) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.769 | (0;000) | ✗ | 27/01/17 |
Cu2Te | ICSD | 77055 | P6/mmm (191) | ✔ | 6 | 56 | 3 | 0.0 | 0.006 | 0.376 | (0;000) | ✗ | 27/01/17 |
MnP4 | ICSD | 100786 | P-1 (2) | ✔ | 10 | 70 | 3 | 0.3988 | 0.496 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfGeOs | ICSD | 636578 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.788 | (0;001) | ✔ | 20/12/16 |
MnBi | COD | 9008899 | P6_3/mmc (194) | ✔ | 4 | 60 | 3 | 0.0 | 0.004 | 0.449 | (0;000) | ✗ | 05/01/17 |
Sr(SiCu)2 | ICSD | 25313 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.008 | 0.778 | (0;000) | ✗ | 27/01/17 |
HfGeRu | ICSD | 636584 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.759 | (0;000) | ✔ | 05/12/16 |
NaBiO2 | COD | 8103708 | C2/c (15) | ✔ | 8 | 72 | 3 | 1.311 | 1.317 | 0.000 | (0;000) | ✗ | 05/01/17 |
Zn2NCl | ICSD | 425734 | Pna2_1 (33) | ✗ | 16 | 144 | 3 | 2.0638 | 2.072 | 0.000 | (0;000) | ✗ | 22/03/17 |
Hf3(SiCu)4 | ICSD | 87201 | Immm (71) | ✔ | 11 | 96 | 3 | 0.0 | 0.017 | 0.509 | (0;111) | ✗ | 27/01/17 |
RePbClO4 | COD | 2208194 | Pmn2_1 (31) | ✗ | 14 | 120 | 3 | 3.0966 | 3.176 | 0.000 | (0;000) | ✗ | 22/03/17 |
Mn3C | ICSD | 618248 | Pnma (62) | ✔ | 16 | 196 | 3 | 0.0 | 0.000 | 0.874 | (0;110) | ✗ | 22/03/17 |