▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
HfIN | ICSD | 190384 | R-3m (166) | ✔ | 6 | 48 | 2 | 0.6678 | 1.802 | 0.000 | (0;000) | ✗ | 29/03/17 |
MnAlPt2 | ICSD | 57985 | Fm-3m (225) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.570 | (0;000) | ✗ | 05/01/17 |
MnAlPt | ICSD | 57984 | P6_3/mmc (194) | ✔ | 6 | 56 | 3 | 0.0 | 0.002 | 0.466 | (0;000) | ✗ | 05/01/17 |
Nb2CrSe4 | COD | 1527788 | C2/m (12) | ✔ | 7 | 64 | 3 | 0.0 | 0.018 | 0.298 | (1;001) | ✗ | 27/01/17 |
MnAlRh2 | ICSD | 57986 | Fm-3m (225) | ✔ | 4 | 52 | 3 | 0.0 | 0.003 | 0.220 | (0;000) | ✗ | 05/01/17 |
AlTl(MoO4)2 | ICSD | 250339 | P-3m1 (164) | ✔ | 12 | 92 | 2 | 3.8281 | 3.985 | 0.000 | (0;000) | ✗ | 05/01/17 |
Tl2Hg3Te4 | COD | 4000819 | C2/c (15) | ✔ | 18 | 172 | 3 | 0.3354 | 0.335 | 0.000 | (0;000) | ✗ | 29/03/17 |
SrCrO3 | ICSD | 245834 | Pm-3m (221) | ✔ | 5 | 42 | 3 | 0.0 | 0.000 | 0.770 | (0;000) | ✗ | 27/01/17 |
NbCrN | COD | 1528599 | P4/nmm (129) | ✔ | 6 | 64 | 3 | 0.0 | 0.010 | 0.490 | (0;001) | ✗ | 27/01/17 |
HgI | COD | 9016417 | I4/mmm (139) | ✔ | 4 | 38 | 3 | 1.0965 | 1.460 | 0.000 | (0;000) | ✗ | 29/03/17 |
Bi4O7 | ICSD | 51778 | P-1 (2) | ✔ | 22 | 124 | 3 | 1.173 | 1.280 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlMo3 | ICSD | 57999 | Pm-3n (223) | ✔ | 8 | 90 | 3 | 0.0 | 0.000 | 0.955 | (1;000) | ✗ | 05/01/17 |
NaAl(SiO3)2 | COD | 9010377 | C2/c (15) | ✔ | 20 | 112 | 3 | 5.953 | 5.965 | 0.000 | (0;000) | ✗ | 05/01/17 |
CrSiNi | ICSD | 165255 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.005 | 0.316 | (0;000) | ✗ | 27/01/17 |
NaAlSe2 | ICSD | 44704 | I4/mcm (140) | ✔ | 8 | 48 | 1 | 2.2881 | 2.395 | 0.000 | (0;000) | ✗ | 05/01/17 |
NaAlSi | COD | 7221265 | P4/nmm (129) | ✔ | 6 | 32 | 1 | 0.0 | 0.002 | 0.188 | (0;000) | ✗ | 05/01/17 |
CrPbO3 | ICSD | 160196 | Pm-3m (221) | ✔ | 5 | 46 | 3 | 0.0 | 0.000 | 0.739 | (0;000) | ✗ | 27/01/17 |
SrHI | COD | 9009184 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 2.138 | 2.138 | 0.000 | (0;000) | ✗ | 29/03/17 |
Bi4Se3 | ICSD | 20319 | R-3m (166) | ✔ | 7 | 38 | 2 | 0.0 | 0.081 | 0.168 | (0;111) | ✗ | 06/10/16 |
Nb3Al | ICSD | 608653 | Pm-3n (223) | ✔ | 8 | 84 | 3 | 0.0 | 0.012 | 0.550 | (0;000) | ✗ | 05/01/17 |
NbAlNi2 | ICSD | 58016 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.014 | 0.246 | (1;000) | ✗ | 05/01/17 |
CrO2 | COD | 1516110 | P4_2/mnm (136) | ✔ | 6 | 52 | 3 | 0.0 | 0.001 | 0.616 | (0;000) | ✗ | 27/01/17 |
NbAlO4 | ICSD | 24078 | C2/m (12) | ✔ | 12 | 80 | 3 | 3.5921 | 3.832 | 0.000 | (0;000) | ✗ | 05/01/17 |
NbAlRu2 | COD | 1523383 | Fm-3m (225) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.145 | (1;000) | ✗ | 05/01/17 |
Cr(Te2Rh)2 | ICSD | 626579 | C2/m (12) | ✔ | 7 | 72 | 3 | 0.0 | 0.042 | 0.404 | (0;111) | ✗ | 27/01/17 |
MnTlI3 | ICSD | 26421 | Pnma (62) | ✔ | 20 | 196 | 2 | 0.0 | 0.000 | 0.258 | (0;011) | ✗ | 29/03/17 |
YCrO4 | COD | 1008143 | I4_1/amd (141) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.930 | (1;111) | ✗ | 27/01/17 |
VCrO4 | ICSD | 36244 | Cmcm (63) | ✔ | 12 | 102 | 3 | 0.0 | 0.000 | 0.572 | (0;000) | ✗ | 27/01/17 |
Bi4Te3 | ICSD | 30526 | R-3m (166) | ✔ | 7 | 78 | 0 | 0.0 | 0.012 | 0.112 | (0;111) | ✗ | 06/10/16 |
ScAlNi2 | ICSD | 58050 | Fm-3m (225) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.637 | (0;000) | ✗ | 05/01/17 |
TaAlNi2 | ICSD | 608870 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.260 | (1;000) | ✗ | 05/01/17 |
Sr4In2N | ICSD | 62536 | I4_1/amd (141) | ✔ | 14 | 142 | 1 | 0.0 | 0.000 | 0.891 | (1;111) | ✗ | 29/03/17 |
Sr2CrO4 | ICSD | 245595 | I4/mmm (139) | ✔ | 7 | 58 | 2 | 0.0 | 0.021 | 0.786 | (0;000) | ✗ | 27/01/17 |
AlVNi2 | ICSD | 58071 | Fm-3m (225) | ✔ | 4 | 36 | 3 | 0.0 | 0.007 | 0.267 | (1;000) | ✗ | 05/01/17 |
Ti2AlN | ICSD | 184882 | P6_3/mmc (194) | ✔ | 8 | 64 | 3 | 0.0 | 0.009 | 0.549 | (1;000) | ✗ | 05/01/17 |
ZrIn2 | ICSD | 640720 | I4_1/amd (141) | ✔ | 12 | 120 | 3 | 0.0 | 0.016 | 0.551 | (1;111) | ✗ | 29/03/17 |
TlIn3S5 | ICSD | 402124 | C2/m (12) | ✔ | 18 | 164 | 3 | 1.729 | 1.829 | 0.000 | (0;000) | ✗ | 29/03/17 |
K2SrIn7 | ICSD | 165188 | Cmcm (63) | ✔ | 20 | 238 | 3 | 0.0 | 0.000 | 0.850 | (1;110) | ✗ | 29/03/17 |
YCrO4 | ICSD | 157934 | I4_1/a (88) | ✔ | 12 | 98 | 3 | 0.0 | 0.000 | 0.671 | (1;111) | ✗ | 27/01/17 |
Bi8Se9 | ICSD | 42665 | R-3m (166) | ✔ | 17 | 94 | 2 | 0.0 | 0.024 | 0.183 | (0;111) | ✗ | 06/10/16 |
Ti3AlN | ICSD | 52642 | Pm-3m (221) | ✔ | 5 | 44 | 3 | 0.0 | 0.000 | 0.240 | (0;111) | ✗ | 05/01/17 |
Zr3AlN | ICSD | 29521 | Cmcm (63) | ✔ | 10 | 40 | 3 | 0.0 | 0.000 | 0.916 | (0;000) | ✗ | 05/01/17 |
CrWO4 | ICSD | 8269 | Cmmm (65) | ✔ | 6 | 52 | 3 | 0.0 | 0.036 | 0.669 | (0;110) | ✗ | 27/01/17 |
AlO2 | COD | 9014565 | Pnma (62) | ✔ | 12 | 60 | 3 | 0.0 | 0.000 | 0.538 | (1;011) | ✗ | 05/01/17 |
RbAlO2 | ICSD | 28373 | Fd-3m (227) | ✔ | 8 | 48 | 3 | 3.7643 | 3.769 | 0.000 | (0;000) | ✗ | 05/01/17 |
CrSnRh2 | ICSD | 626578 | I4/mmm (139) | ✔ | 4 | 62 | 3 | 0.0 | 0.016 | 0.453 | (0;111) | ✗ | 27/01/17 |
CrPt3 | COD | 1524103 | Pm-3m (221) | ✔ | 4 | 44 | 3 | 0.0 | 0.000 | 0.886 | (0;000) | ✗ | 27/01/17 |
Bi8Te9 | ICSD | 106330 | R-3m (166) | ✔ | 17 | 94 | 1 | 0.0 | 0.033 | 0.669 | (0;111) | ✗ | 06/10/16 |
Sn4Ir | ICSD | 412573 | I4_1/acd (142) | ✔ | 20 | 292 | 3 | 0.0 | 0.003 | 0.491 | (1;111) | ✗ | 29/03/17 |
AlTlO2 | ICSD | 29010 | R-3m (166) | ✔ | 8 | 56 | 3 | 1.3755 | 1.384 | 0.000 | (0;000) | ✗ | 05/01/17 |
ScAlO3 | COD | 9005885 | Pnma (62) | ✔ | 20 | 128 | 3 | 4.6104 | 4.791 | 0.000 | (0;000) | ✗ | 05/01/17 |
CrP | COD | 9008930 | Pnma (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.480 | (1;011) | ✗ | 27/01/17 |
YAlO3 | COD | 1008923 | P6_3/mmc (194) | ✔ | 10 | 64 | 3 | 3.0644 | 3.469 | 0.000 | (0;000) | ✗ | 05/01/17 |
AlPO4 | ICSD | 159272 | Cmcm (63) | ✔ | 12 | 64 | 3 | 6.2169 | 6.335 | 0.000 | (0;000) | ✗ | 05/01/17 |
K2SrTa2O7 | ICSD | 93492 | I4/mmm (139) | ✔ | 12 | 96 | 1 | 2.1211 | 2.584 | 0.000 | (0;000) | ✗ | 29/03/17 |
K2Pd3S4 | ICSD | 41885 | Fddd (70) | ✔ | 18 | 192 | 1 | 1.2068 | 1.313 | 0.000 | (0;000) | ✗ | 29/03/17 |
K2Pd3Se4 | ICSD | 641300 | Fddd (70) | ✔ | 18 | 192 | 1 | 0.994 | 1.098 | 0.000 | (0;000) | ✗ | 29/03/17 |
Cr(RhSe2)2 | ICSD | 626577 | C2/m (12) | ✔ | 7 | 72 | 3 | 0.0 | 0.013 | 0.349 | (0;111) | ✗ | 27/01/17 |
Bi9I2 | ICSD | 39257 | P2_1/m (11) | ✔ | 22 | 118 | 3 | 0.0 | 0.000 | 0.931 | (1;011) | ✗ | 06/10/16 |
TaAlO4 | COD | 2002498 | C2/m (12) | ✔ | 12 | 80 | 3 | 4.1642 | 4.519 | 0.000 | (0;000) | ✗ | 05/01/17 |
AlV2O4 | COD | 9012337 | Fd-3m (227) | ✔ | 14 | 106 | 3 | 0.0 | 0.000 | 0.645 | (0;000) | ✗ | 05/01/17 |
ZrCrP | ICSD | 626529 | Pnma (62) | ✔ | 12 | 92 | 3 | 0.0 | 0.000 | 0.608 | (0;011) | ✗ | 27/01/17 |
AlPd2 | ICSD | 58115 | Pnma (62) | ✔ | 12 | 156 | 3 | 0.0 | 0.001 | 0.462 | (0;011) | ✗ | 05/01/17 |
ScAlPd2 | ICSD | 58120 | Fm-3m (225) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.644 | (0;000) | ✗ | 05/01/17 |
Cs2KVF6 | ICSD | 27344 | Fm-3m (225) | ✔ | 10 | 82 | 1 | 0.0 | 0.000 | 0.464 | (0;000) | ✗ | 27/01/17 |
CrTe | COD | 1525990 | P6_3/mmc (194) | ✔ | 4 | 40 | 3 | 0.0 | 0.009 | 0.342 | (1;000) | ✗ | 27/01/17 |
CrSb | COD | 9008889 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.659 | (0;000) | ✗ | 27/01/17 |
CrSb2 | ICSD | 86811 | I4/mcm (140) | ✔ | 6 | 48 | 3 | 0.0 | 0.006 | 0.448 | (0;000) | ✗ | 27/01/17 |
InBr | ICSD | 23126 | Ccmm (63) | ✔ | 4 | 40 | 3 | 1.3218 | 1.469 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlPPt5 | ICSD | 609024 | P4/mmm (123) | ✔ | 7 | 58 | 3 | 0.0 | 0.014 | 0.471 | (1;000) | ✗ | 05/01/17 |
AlPt2 | ICSD | 656680 | Pnma (62) | ✔ | 12 | 92 | 3 | 0.0 | 0.003 | 0.416 | (0;011) | ✗ | 05/01/17 |
Li2Ta3N5 | ICSD | 40568 | C2/m (12) | ✔ | 20 | 140 | 3 | 0.0 | 0.029 | 0.624 | (0;000) | ✗ | 29/03/17 |
SrLi2Nb2O7 | ICSD | 88463 | I4/mmm (139) | ✔ | 12 | 84 | 2 | 1.7886 | 2.155 | 0.000 | (0;000) | ✗ | 29/03/17 |
Li2Ni(WO4)2 | ICSD | 92853 | P-1 (2) | ✔ | 13 | 92 | 3 | 0.0 | 0.055 | 1.000 | (0;001) | ✗ | 29/03/17 |
Li2WO4 | COD | 1527546 | C2/c (15) | ✔ | 14 | 88 | 1 | 10.5063 | 0.003 | 1.000 | (0;000) | ✗ | 29/03/17 |
PdBr2 | ICSD | 27443 | C2/c (15) | ✔ | 6 | 64 | 1 | 0.509 | 0.945 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrAlPt2 | ICSD | 58139 | P6_3/mmc (194) | ✔ | 8 | 54 | 3 | 0.0 | 0.000 | 0.927 | (0;000) | ✗ | 05/01/17 |
SrLi2Ta2O7 | ICSD | 88464 | I4/mmm (139) | ✔ | 12 | 84 | 2 | 2.1506 | 2.600 | 0.000 | (0;000) | ✗ | 29/03/17 |
TiAlPt | ICSD | 163350 | P6_3/mmc (194) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.904 | (0;000) | ✗ | 05/01/17 |
CrSb2 | COD | 9012573 | Pnnm (58) | ✔ | 6 | 48 | 3 | 0.0 | 0.003 | 0.370 | (0;000) | ✗ | 27/01/17 |
TlBr | ICSD | 109144 | Cmcm (63) | ✔ | 4 | 40 | 2 | 1.8054 | 1.828 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr3Li2 | COD | 1528178 | P4_2/mnm (136) | ✔ | 20 | 144 | 1 | 0.0 | 0.000 | 0.522 | (1;000) | ✗ | 29/03/17 |
Li3Ni2SbO6 | ICSD | 183999 | C2/m (12) | ✔ | 12 | 70 | 2 | 0.0 | 0.005 | 0.390 | (0;000) | ✗ | 29/03/17 |
Rb2LiVS4 | ICSD | 414185 | Fddd (70) | ✔ | 16 | 116 | 1 | 1.553 | 1.553 | 0.000 | (0;000) | ✗ | 29/03/17 |
Li3(ZnSn2)2 | COD | 4334091 | P6_3/mmc (194) | ✔ | 18 | 178 | 3 | 0.0 | 0.000 | 0.930 | (0;000) | ✗ | 29/03/17 |
SrLi4N2 | ICSD | 87413 | I4_1/amd (141) | ✔ | 14 | 64 | 1 | 0.9167 | 1.149 | 0.000 | (0;000) | ✗ | 29/03/17 |
Li4TeO5 | COD | 1530934 | P-1 (2) | ✔ | 20 | 96 | 3 | 0.0 | 0.023 | 0.455 | (0;000) | ✗ | 29/03/17 |
Li4WO5 | ICSD | 108819 | P-1 (2) | ✔ | 20 | 112 | 1 | 10.2285 | 3.381 | 1.000 | (0;000) | ✗ | 29/03/17 |
Sc2Al | ICSD | 58100 | P6_3/mmc (194) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.761 | (1;000) | ✗ | 05/01/17 |
LiMnO2 | COD | 1513963 | I4_1/amd (141) | ✔ | 16 | 120 | 3 | 0.0 | 0.001 | 0.726 | (1;111) | ✗ | 29/03/17 |
Sc2AlSi2 | ICSD | 52653 | P4/mbm (127) | ✔ | 10 | 66 | 3 | 0.0 | 0.000 | 0.847 | (1;111) | ✗ | 05/01/17 |
Na3LiWO5 | ICSD | 49027 | P-1 (2) | ✔ | 20 | 148 | 1 | 10.5658 | 0.029 | 1.000 | (0;000) | ✗ | 29/03/17 |
Cs2LiGaF6 | ICSD | 9004 | P-3m1 (164) | ✔ | 10 | 76 | 1 | 6.3658 | 6.378 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiTiO2 | ICSD | 48128 | Fd-3m (227) | ✔ | 16 | 108 | 3 | 0.0 | 0.008 | 0.631 | (1;111) | ✗ | 29/03/17 |
YAlSi | COD | 1533018 | Cmcm (63) | ✔ | 6 | 36 | 3 | 0.0 | 0.015 | 0.313 | (0;110) | ✗ | 05/01/17 |
Ti3Al | ICSD | 181338 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.474 | (1;000) | ✗ | 05/01/17 |
LiTi2O4 | ICSD | 180011 | C2/m (12) | ✔ | 14 | 102 | 3 | 0.0 | 0.003 | 0.478 | (1;001) | ✗ | 29/03/17 |
LiSn | ICSD | 107516 | I4_1/amd (141) | ✔ | 12 | 102 | 3 | 0.0 | 0.000 | 0.856 | (1;111) | ✗ | 29/03/17 |
CrS | COD | 9008888 | P6_3/mmc (194) | ✔ | 4 | 40 | 3 | 0.0 | 0.007 | 0.658 | (0;000) | ✗ | 27/01/17 |
CrSe | COD | 9008890 | P6_3/mmc (194) | ✔ | 4 | 40 | 3 | 0.0 | 0.001 | 0.577 | (0;000) | ✗ | 27/01/17 |