▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MnRe(PbO3)2 | ICSD | 182001 | Fm-3m (225) | ✔ | 10 | 94 | 3 | 0.0 | 0.130 | 0.255 | (0;000) | ✗ | 27/01/17 |
MnSnO3 | COD | 1004021 | R-3 (148) | ✔ | 10 | 94 | 3 | 0.0 | 0.002 | 0.322 | (0;111) | ✗ | 27/01/17 |
Ge2N2O | ICSD | 200843 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.9558 | 3.277 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge2N2O | ICSD | 200844 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.8949 | 3.231 | 0.000 | (0;000) | ✗ | 06/10/16 |
RbTiCl3 | ICSD | 49747 | P6_3/mmc (194) | ✔ | 10 | 84 | 1 | 0.0 | 0.016 | 0.517 | (0;000) | ✗ | 02/02/17 |
RbVCl3 | COD | 1530068 | P6_3/mmc (194) | ✔ | 10 | 86 | 1 | 0.0 | 0.000 | 0.711 | (0;000) | ✗ | 02/02/17 |
Ge2N2O | ICSD | 200845 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.9087 | 3.213 | 0.000 | (0;000) | ✗ | 06/10/16 |
Y2Cl3 | ICSD | 23337 | C2/m (12) | ✔ | 10 | 86 | 3 | 0.7252 | 0.793 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ge2N2O | ICSD | 200846 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.9302 | 3.250 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge2N2O | ICSD | 200847 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.7469 | 3.045 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge2N2O | ICSD | 200848 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.5818 | 2.896 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ge2N2O | ICSD | 200849 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.2545 | 2.593 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnP4 | COD | 1524612 | P-1 (2) | ✔ | 10 | 70 | 3 | 0.4031 | 0.499 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ge2N2O | ICSD | 34793 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 3.0353 | 3.257 | 0.000 | (0;000) | ✗ | 06/10/16 |
Y(GePt)2 | ICSD | 637662 | P2_1 (4) | ✗ | 10 | 78 | 3 | 0.0 | 0.000 | 0.977 | ? | ✗ | 06/10/16 |
Ga2O3 | COD | 2004987 | C2/m (12) | ✔ | 10 | 88 | 3 | 2.4198 | 2.448 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li6Br3N | COD | 1528848 | Fm-3m (225) | ✔ | 10 | 44 | 1 | 2.9029 | 3.244 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2O3 | COD | 1010583 | R-3c (167) | ✔ | 10 | 88 | 3 | 1.8896 | 1.890 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb(MoS)2 | COD | 4002550 | P2_1/m (11) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.609 | (1;001) | ✗ | 27/01/17 |
KClO3 | ICSD | 26409 | P2_1/m (11) | ✔ | 10 | 68 | 1 | 5.6268 | 5.635 | 0.000 | (0;000) | ✗ | 27/01/17 |
MnCoO3 | ICSD | 31854 | R-3 (148) | ✔ | 10 | 100 | 3 | 0.0 | 0.006 | 0.610 | (1;000) | ✗ | 27/01/17 |
P4Ru | ICSD | 648018 | P2_1/c (14) | ✔ | 10 | 72 | 3 | 0.7523 | 0.752 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiHgO3 | ICSD | 19005 | R-3c (167) | ✔ | 10 | 84 | 3 | 1.4258 | 1.426 | 0.000 | (0;000) | ✗ | 06/10/16 |
NbTe4 | ICSD | 645526 | P4/mcc (124) | ✔ | 10 | 74 | 3 | 0.0 | 0.000 | 0.577 | (1;110) | ✗ | 06/10/16 |
Mo2S3 | COD | 1527605 | P2_1/m (11) | ✔ | 10 | 92 | 3 | 0.0 | 0.021 | 0.866 | (1;001) | ✗ | 27/01/17 |
KClO3 | COD | 1010217 | P2_1/m (11) | ✔ | 10 | 68 | 1 | 1.326 | 1.347 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaPb2IO6 | ICSD | 427115 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.155 | (0;000) | ✗ | 30/01/17 |
HfCl4 | ICSD | 402054 | P2/c (13) | ✔ | 10 | 80 | 1 | 4.0299 | 4.070 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2NiMoO6 | ICSD | 28600 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.768 | (0;000) | ✗ | 27/01/17 |
Zr3Ga2 | COD | 1522710 | P4/mbm (127) | ✔ | 10 | 76 | 3 | 0.0 | 0.006 | 0.823 | (0;001) | ✗ | 27/01/17 |
Ta3Ga2 | ICSD | 635467 | P4/mbm (127) | ✔ | 10 | 130 | 3 | 0.0 | 0.000 | 0.881 | (0;111) | ✗ | 27/01/17 |
KIO3 | ICSD | 247719 | R3 (146) | ✗ | 10 | 68 | 3 | 1.9552 | 1.956 | 0.000 | (0;000) | ✗ | 06/10/16 |
KIO3 | ICSD | 424864 | R3 (146) | ✗ | 10 | 68 | 3 | 2.2905 | 2.302 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbPbClO2 | COD | 9010005 | Cmcm (63) | ✔ | 10 | 76 | 1 | 0.0 | 1.773 | 1.000 | (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 |
Sr2ZnMoO6 | ICSD | 28602 | Fm-3m (225) | ✔ | 10 | 82 | 3 | 1.3459 | 1.555 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2TiMoO6 | ICSD | 189335 | P-1 (2) | ✔ | 10 | 82 | 3 | 0.0 | 0.048 | 0.745 | (0;000) | ✗ | 27/01/17 |
LiIO3 | ICSD | 20012 | P6_322 (182) | ✗ | 10 | 56 | 3 | 0.0 | 0.562 | 0.201 | (0;000) | ✔ | 06/10/16 |
NbCl4 | COD | 4343693 | C2/m (12) | ✔ | 10 | 82 | 1 | 0.8567 | 0.889 | 0.000 | (0;000) | ✗ | 02/02/17 |
MoP4 | COD | 2106092 | C2/c (15) | ✔ | 10 | 68 | 2 | 0.0 | 0.019 | 0.126 | (1;000) | ✗ | 27/01/17 |
LiIO3 | ICSD | 35472 | P6_3 (173) | ✗ | 10 | 56 | 3 | 0.4539 | 0.635 | 0.000 | (0;000) | ✔ | 06/10/16 |
PbCl4 | COD | 9007926 | C2/c (15) | ✔ | 10 | 84 | 1 | 2.1044 | 2.104 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiIO3 | ICSD | 40358 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.6715 | 3.741 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsAuI3 | COD | 2006239 | I4/mmm (139) | ✔ | 10 | 82 | 3 | 0.7154 | 0.730 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiIO3 | ICSD | 46025 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.7353 | 3.809 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiIO3 | ICSD | 46026 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.706 | 3.793 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiIO3 | ICSD | 46027 | P6_3 (173) | ✗ | 10 | 56 | 0 | 3.8029 | 3.878 | 0.000 | (0;000) | ✗ | 06/10/16 |
TaCl4 | ICSD | 402406 | C2/m (12) | ✔ | 10 | 82 | 1 | 1.0671 | 1.181 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrCl4 | ICSD | 26049 | P2/c (13) | ✔ | 10 | 64 | 1 | 3.4913 | 3.573 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca(BC)2 | ICSD | 88019 | I4/mcm (140) | ✔ | 10 | 48 | 2 | 0.4846 | 1.005 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg(BC)2 | ICSD | 421839 | Pnnm (58) | ✔ | 10 | 48 | 3 | 1.1081 | 1.531 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiIO3 | ICSD | 80025 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.6161 | 3.692 | 0.000 | (0;000) | ✗ | 06/10/16 |
Y(BC)2 | ICSD | 427155 | P4/mbm (127) | ✔ | 10 | 50 | 3 | 0.0 | 0.000 | 0.546 | (0;000) | ✗ | 27/01/17 |
Y(BC)2 | ICSD | 612672 | P4_2/mmc (131) | ✔ | 10 | 50 | 3 | 0.0 | 0.000 | 0.731 | (0;101) | ✗ | 27/01/17 |
LiIO3 | ICSD | 80026 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.9069 | 3.948 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaMg(CO3)2 | COD | 9011458 | R-3m (166) | ✔ | 10 | 64 | 2 | 4.0954 | 4.178 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiIO3 | ICSD | 9508 | P6_3 (173) | ✗ | 10 | 56 | 1 | 3.8139 | 3.877 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zr2SeN2 | ICSD | 424266 | P6_3/mmc (194) | ✔ | 10 | 48 | 3 | 0.0 | 1.360 | 0.034 | (0;000) | ✗ | 27/01/17 |
CaMg(CO3)2 | COD | 1200014 | R-3 (148) | ✔ | 10 | 64 | 2 | 5.1415 | 5.552 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaMg(CO3)2 | COD | 9001415 | R-3 (148) | ✔ | 10 | 64 | 2 | 5.1156 | 5.545 | 0.000 | (0;000) | ✗ | 27/01/17 |
MgCd(CO3)2 | COD | 9000106 | R-3 (148) | ✔ | 10 | 66 | 3 | 0.0 | 0.013 | 0.276 | (1;111) | ✗ | 27/01/17 |
Ti2Ga3 | COD | 1522704 | P4/m (83) | ✔ | 10 | 126 | 3 | 0.0 | 0.000 | 0.704 | (1;111) | ✗ | 27/01/17 |
Cr3C2 | ICSD | 57009 | Cmcm (63) | ✔ | 10 | 100 | 3 | 0.0 | 0.007 | 0.781 | (0;000) | ✗ | 27/01/17 |
Cs2HgPdCl6 | ICSD | 36616 | I4/mmm (139) | ✔ | 10 | 90 | 2 | 1.417 | 1.502 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2KScCl6 | ICSD | 59196 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 3.2291 | 3.229 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2LiYCl6 | ICSD | 65731 | Fm-3m (225) | ✔ | 10 | 74 | 2 | 4.9066 | 4.907 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsAuSe3 | COD | 1510105 | C2/c (15) | ✔ | 10 | 76 | 2 | 1.1162 | 1.357 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NaYCl6 | ICSD | 245354 | Fm-3m (225) | ✔ | 10 | 80 | 2 | 5.0966 | 5.097 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs(CO)2 | ICSD | 154357 | C2/m (12) | ✔ | 10 | 58 | 1 | 2.7093 | 2.798 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbAuI3 | COD | 2206809 | C2/m (12) | ✔ | 10 | 82 | 1 | 0.64 | 0.778 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiScI3 | ICSD | 73339 | P-6c2 (188) | ✗ | 10 | 70 | 1 | 0.0 | 0.000 | 0.689 | ? | ✗ | 06/10/16 |
NbI3O | ICSD | 418088 | C2 (5) | ✗ | 10 | 80 | 2 | 0.8135 | 0.850 | 0.000 | (0;000) | ✗ | 06/10/16 |
Li(CO)2 | ICSD | 154354 | C2/m (12) | ✔ | 10 | 46 | 1 | 2.1698 | 2.525 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zn(BrN)2 | COD | 9016192 | Imma (74) | ✔ | 10 | 72 | 1 | 0.0 | 0.001 | 0.725 | (1;000) | ✗ | 02/02/17 |
MnCO3 | COD | 1011228 | R-3c (167) | ✔ | 10 | 74 | 3 | 0.0 | 0.000 | 0.716 | (0;000) | ✗ | 27/01/17 |
Rb(CO)2 | ICSD | 154356 | C2/m (12) | ✔ | 10 | 58 | 1 | 2.7302 | 2.822 | 0.000 | (0;000) | ✗ | 27/01/17 |
POF3 | ICSD | 250498 | P-3m1 (164) | ✔ | 10 | 64 | 1 | 6.2121 | 6.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr2SN2 | COD | 4124514 | P6_3/mmc (194) | ✔ | 10 | 48 | 3 | 0.1779 | 1.455 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc2Ni2Sn | ICSD | 658917 | P4/mbm (127) | ✔ | 10 | 112 | 3 | 0.0 | 0.002 | 0.732 | (0;000) | ✗ | 27/01/17 |
Li2Sn2Au | ICSD | 192982 | I4_1/amd (141) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.914 | (1;111) | ✗ | 02/02/17 |
Rb2Se3 | ICSD | 14093 | Ccm2_1 (36) | ✗ | 10 | 72 | 1 | 0.7189 | 0.828 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mg2C3 | ICSD | 71941 | Pnnm (58) | ✔ | 10 | 64 | 3 | 1.6804 | 2.671 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sn2OF2 | COD | 2106752 | C2/m (12) | ✔ | 10 | 96 | 1 | 2.5696 | 2.686 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiO | COD | 9016272 | C2/m (12) | ✔ | 10 | 90 | 3 | 0.0 | 0.007 | 0.640 | (1;000) | ✗ | 27/01/17 |
Zr2NiP2 | ICSD | 646195 | P6_3/mmc (194) | ✔ | 10 | 56 | 3 | 0.0 | 0.004 | 0.299 | (0;000) | ✗ | 27/01/17 |
Ca2FeN2 | ICSD | 72389 | C2/m (12) | ✔ | 10 | 76 | 1 | 0.0 | 0.006 | 0.480 | (0;111) | ✗ | 27/01/17 |
CoPS3 | ICSD | 624616 | C2/m (12) | ✔ | 10 | 80 | 2 | 0.0 | 0.006 | 0.364 | (0;000) | ✗ | 27/01/17 |
Ca2FeWO6 | ICSD | 81203 | Fm-3m (225) | ✔ | 10 | 78 | 3 | 0.625 | 0.627 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2PdWO6 | ICSD | 83258 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 0.0 | 0.000 | 0.719 | (0;000) | ✗ | 27/01/17 |
Ca2TiSiO6 | COD | 9006455 | Fm-3m (225) | ✔ | 10 | 72 | 3 | 3.211 | 3.211 | 0.000 | (0;000) | ✗ | 27/01/17 |
InGaO3 | ICSD | 30339 | P6_3/mmc (194) | ✔ | 10 | 88 | 3 | 1.6994 | 1.915 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca3N2 | ICSD | 419865 | R-3c (167) | ✔ | 10 | 80 | 1 | 0.792 | 0.955 | 0.000 | (0;000) | ✗ | 27/01/17 |
VP4 | ICSD | 38315 | C2/c (15) | ✔ | 10 | 66 | 2 | 0.0 | 0.000 | 0.729 | (1;011) | ✗ | 27/01/17 |
NaSbO3 | COD | 9005220 | R-3 (148) | ✔ | 10 | 64 | 1 | 3.1157 | 3.254 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaFeF3 | COD | 4341415 | Cmcm (63) | ✔ | 10 | 76 | 2 | 0.5613 | 0.591 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaFeClO2 | ICSD | 96556 | C2/m (12) | ✔ | 10 | 74 | 1 | 0.0 | 0.021 | 0.595 | (0;000) | ✗ | 27/01/17 |
V3GaN | ICSD | 634723 | Cmcm (63) | ✔ | 10 | 114 | 3 | 0.0 | 0.000 | 0.670 | (0;110) | ✗ | 27/01/17 |
Sr2GaSbO6 | ICSD | 157019 | Fm-3m (225) | ✔ | 10 | 74 | 3 | 0.2848 | 0.285 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2TaGaO6 | COD | 2100516 | I4/m (87) | ✔ | 10 | 82 | 3 | 4.0011 | 4.001 | 0.000 | (0;000) | ✗ | 27/01/17 |