▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CdPt3 | ICSD | 24931 | Cmmm (65) | ✔ | 4 | 42 | 3 | 0.0 | 0.014 | 0.848 | (1;111) | ✗ | 27/01/17 |
Ta2Se3 | ICSD | 42982 | P2_1/m (11) | ✔ | 10 | 88 | 3 | 0.0 | 0.066 | 0.151 | (1;010) | ✗ | 27/01/17 |
V2CdO6 | COD | 1527174 | C2/m (12) | ✔ | 9 | 74 | 3 | 2.1666 | 2.225 | 0.000 | (0;000) | ✗ | 27/01/17 |
B2AsP | ICSD | 181293 | P-4m2 (115) | ✗ | 4 | 16 | 3 | 1.104 | 1.257 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ti3Se4 | ICSD | 652044 | C2/m (12) | ✔ | 7 | 60 | 3 | 0.0 | 0.014 | 0.422 | (0;111) | ✗ | 27/01/17 |
Si3NiP4 | ICSD | 39452 | I-42m (121) | ✗ | 8 | 42 | 3 | 0.3269 | 0.532 | 0.000 | (0;000) | ✔ | 07/10/16 |
SrSi3Ni | ICSD | 174268 | I4mm (107) | ✗ | 5 | 32 | 3 | 0.0 | 0.039 | 0.440 | (0;111) | ✔ | 07/10/16 |
ZrSiSe | COD | 9008350 | P4/nmm (129) | ✔ | 6 | 28 | 3 | 0.0 | 0.018 | 0.063 | (0;001) | ✗ | 27/01/17 |
CdPd5Se | ICSD | 620273 | P4/mmm (123) | ✔ | 7 | 108 | 3 | 0.0 | 0.007 | 0.509 | (1;000) | ✗ | 27/01/17 |
SnSe | COD | 9008725 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.0 | 0.223 | 0.011 | (0;000) | ✗ | 27/01/17 |
BMo | ICSD | 191907 | Cmcm (63) | ✔ | 4 | 34 | 3 | 0.0 | 0.000 | 0.777 | (0;110) | ✗ | 06/10/16 |
ZnSiP2 | ICSD | 191069 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.3437 | 1.344 | 0.000 | (0;000) | ✗ | 07/10/16 |
TiSe | COD | 9008919 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.000 | 0.450 | (0;000) | ✗ | 27/01/17 |
VSe | COD | 9008923 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.838 | (0;000) | ✗ | 27/01/17 |
SrSi2 | COD | 1527358 | I4_1/amd (141) | ✔ | 6 | 36 | 3 | 0.0 | 0.014 | 0.249 | (1;111) | ✗ | 27/01/17 |
TiSi2 | COD | 1009012 | Fmmm (69) | ✔ | 3 | 20 | 3 | 0.0 | 0.005 | 0.728 | (1;000) | ✗ | 27/01/17 |
TiSi2 | COD | 1010453 | Fddd (70) | ✔ | 6 | 40 | 3 | 0.0 | 0.012 | 0.449 | (1;111) | ✗ | 27/01/17 |
Si2W | COD | 1010283 | I4/mmm (139) | ✔ | 3 | 22 | 3 | 0.0 | 0.047 | 0.269 | (0;000) | ✗ | 27/01/17 |
YSi2 | ICSD | 150662 | I4_1/amd (141) | ✔ | 6 | 38 | 3 | 0.0 | 0.000 | 0.683 | (1;111) | ✗ | 27/01/17 |
ZrSi2 | COD | 1010265 | Cmcm (63) | ✔ | 6 | 24 | 3 | 0.0 | 0.009 | 0.697 | (1;110) | ✗ | 27/01/17 |
ZrSi2 | COD | 1528853 | Cmcm (63) | ✔ | 6 | 24 | 3 | 0.0 | 0.014 | 0.331 | (1;110) | ✗ | 27/01/17 |
NbFeP | ICSD | 632794 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.003 | 0.138 | (0;000) | ✗ | 27/01/17 |
Si | COD | 4507226 | Fd-3m (227) | ✔ | 4 | 16 | 3 | 0.0 | 0.001 | 0.383 | (0;000) | ✗ | 27/01/17 |
Si | COD | 9011056 | Ia3 (206) | ✔ | 8 | 32 | 3 | 0.0 | 0.000 | 0.092 | (1;111) | ✗ | 27/01/17 |
Si | COD | 9011644 | Cmce (64) | ✔ | 8 | 32 | 3 | 0.0 | 0.010 | 0.416 | (1;000) | ✗ | 27/01/17 |
Si | COD | 9011656 | Imma (74) | ✔ | 2 | 8 | 3 | 0.0 | 0.018 | 0.449 | (1;000) | ✗ | 27/01/17 |
Si | COD | 9012724 | Fm-3m (225) | ✔ | 1 | 4 | 3 | 0.0 | 0.000 | 0.610 | (1;000) | ✗ | 27/01/17 |
Si | COD | 9012918 | P6/mmm (191) | ✔ | 1 | 4 | 3 | 0.0 | 0.022 | 0.518 | (0;001) | ✗ | 27/01/17 |
Si | COD | 9012919 | P6_3/mmc (194) | ✔ | 2 | 8 | 3 | 0.0 | 0.008 | 0.744 | (0;000) | ✗ | 27/01/17 |
Si | COD | 9013107 | Fd-3m (227) | ✔ | 2 | 8 | 3 | 0.5742 | 2.519 | 0.000 | (0;000) | ✗ | 27/01/17 |
BN | ICSD | 162876 | Pmnb (62) | ✔ | 8 | 32 | 3 | 5.9754 | 6.508 | 0.000 | (0;000) | ✗ | 06/10/16 |
CoNiAs | ICSD | 610094 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.0 | 0.000 | 0.345 | ? | ✗ | 06/10/16 |
Ta2Si | ICSD | 652302 | I4/mcm (140) | ✔ | 6 | 60 | 3 | 0.0 | 0.075 | 0.341 | (1;000) | ✗ | 27/01/17 |
Ta2V3Si | ICSD | 652343 | P6_3/mmc (194) | ✔ | 12 | 138 | 3 | 0.0 | 0.000 | 0.803 | (1;000) | ✗ | 27/01/17 |
ZnSnP2 | ICSD | 184466 | I-42d (122) | ✗ | 8 | 72 | 3 | 1.1304 | 1.130 | 0.000 | (0;000) | ✗ | 07/10/16 |
YTiSi | ICSD | 88113 | P4/nmm (129) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.677 | (0;001) | ✗ | 27/01/17 |
V3Si | COD | 1011299 | Pm-3n (223) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.901 | (1;000) | ✗ | 27/01/17 |
ZrVSi | COD | 9008332 | P4/nmm (129) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.805 | (0;000) | ✗ | 27/01/17 |
YSi | ICSD | 42949 | Cmcm (63) | ✔ | 4 | 30 | 3 | 0.0 | 0.000 | 0.699 | (0;110) | ✗ | 27/01/17 |
Zr2Si | ICSD | 652618 | I4/mcm (140) | ✔ | 6 | 24 | 3 | 0.0 | 0.004 | 0.346 | (1;000) | ✗ | 27/01/17 |
ZrSi | ICSD | 31084 | I4_1/amd (141) | ✔ | 4 | 16 | 3 | 0.0 | 0.000 | 0.536 | (1;111) | ✗ | 27/01/17 |
ZrSi | COD | 1528852 | Pnma (62) | ✔ | 8 | 32 | 3 | 0.0 | 0.018 | 0.214 | (1;000) | ✗ | 27/01/17 |
YZnSn2 | ICSD | 183309 | P4/nmm (129) | ✔ | 8 | 102 | 3 | 0.0 | 0.000 | 0.809 | (0;001) | ✗ | 27/01/17 |
Sn | ICSD | 236751 | Im-3m (229) | ✔ | 1 | 14 | 3 | 0.0 | 0.000 | 0.755 | (1;111) | ✗ | 27/01/17 |
Sn | COD | 9008568 | Fd-3m (227) | ✔ | 2 | 28 | 3 | 0.0 | 0.000 | 0.107 | (0;000) | ✗ | 27/01/17 |
Sn | COD | 9008570 | I4_1/amd (141) | ✔ | 2 | 28 | 3 | 0.0 | 0.083 | 0.441 | (1;111) | ✗ | 27/01/17 |
ZnSnSb2 | ICSD | 42669 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.007 | 0.020 | (1;000) | ✔ | 07/10/16 |
CoAsS | ICSD | 36395 | P2_1 (4) | ✗ | 6 | 40 | 3 | 0.0 | 0.596 | 0.136 | (0;000) | ✔ | 06/10/16 |
CrWN2 | ICSD | 84639 | R3m (160) | ✗ | 4 | 38 | 3 | 0.0 | 0.022 | 1.000 | (1;110) | ✔ | 05/12/16 |
Ta3Sn | COD | 4123983 | Pm-3n (223) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.838 | (1;000) | ✗ | 27/01/17 |
SnTe | COD | 9008726 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.1954 | 0.233 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrSnTe | ICSD | 80190 | P4/nmm (129) | ✔ | 6 | 48 | 3 | 0.0 | 0.016 | 0.042 | (0;001) | ✗ | 27/01/17 |
Ti2Sn | COD | 1527932 | P6_3/mmc (194) | ✔ | 6 | 76 | 3 | 0.0 | 0.016 | 0.013 | (0;000) | ✗ | 27/01/17 |
Ti3Sn | ICSD | 106087 | Pm-3m (221) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.524 | (1;000) | ✗ | 27/01/17 |
Ti3Sn | ICSD | 182427 | P6_3/mmc (194) | ✔ | 8 | 100 | 3 | 0.0 | 0.000 | 0.727 | (1;000) | ✗ | 27/01/17 |
V3Sn | COD | 1527071 | Pm-3n (223) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.923 | (1;000) | ✗ | 27/01/17 |
V3Sn | COD | 1527123 | P6_3/mmc (194) | ✔ | 8 | 106 | 3 | 0.0 | 0.000 | 0.724 | (1;000) | ✗ | 27/01/17 |
Zr3Sn | COD | 1528001 | Pm-3n (223) | ✔ | 8 | 52 | 3 | 0.0 | 0.002 | 0.932 | (1;000) | ✗ | 27/01/17 |
BiAsO4 | ICSD | 30636 | I4_1/a (88) | ✔ | 12 | 88 | 3 | 2.5964 | 2.603 | 0.000 | (0;000) | ✗ | 29/11/16 |
Fe3Se4 | ICSD | 15043 | C2/m (12) | ✔ | 7 | 48 | 3 | 0.0 | 0.011 | 0.357 | (0;000) | ✔ | 06/10/16 |
S | COD | 9011640 | R-3m (166) | ✔ | 1 | 6 | 3 | 0.0 | 0.000 | 0.717 | (1;000) | ✗ | 27/01/17 |
NbB | ICSD | 191899 | Cmcm (63) | ✔ | 4 | 32 | 3 | 0.0 | 0.026 | 0.365 | (1;000) | ✗ | 06/10/16 |
CoAsS | ICSD | 41757 | Pca2_1 (29) | ✗ | 12 | 80 | 3 | 0.9749 | 1.154 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiBiF4 | ICSD | 65404 | I4_1/a (88) | ✔ | 12 | 92 | 3 | 4.0319 | 4.162 | 0.000 | (0;000) | ✗ | 05/01/17 |
CoAsS | ICSD | 41758 | Pca2_1 (29) | ✗ | 12 | 80 | 3 | 0.9695 | 1.147 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrGeO4 | ICSD | 29262 | I4_1/a (88) | ✔ | 12 | 64 | 3 | 3.8336 | 4.048 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiGe2N3 | ICSD | 636887 | Ccm2_1 (36) | ✗ | 12 | 52 | 3 | 1.5113 | 1.513 | 0.000 | (0;000) | ✗ | 29/11/16 |
FeSnRu2 | COD | 1523355 | Fm-3m (225) | ✔ | 4 | 54 | 3 | 0.0 | 0.003 | 0.496 | (0;000) | ✗ | 27/01/17 |
Sr2FeOsO6 | ICSD | 251068 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.467 | (0;000) | ✗ | 27/01/17 |
FeSiNi | ICSD | 165244 | Pnma (62) | ✔ | 12 | 88 | 3 | 0.0 | 0.004 | 0.250 | (1;000) | ✗ | 27/01/17 |
SrTl2 | COD | 1527561 | P6_3/mmc (194) | ✔ | 6 | 72 | 3 | 0.0 | 0.007 | 0.086 | (0;000) | ✗ | 27/01/17 |
SrZn2 | COD | 2310343 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.011 | 0.504 | (0;111) | ✗ | 27/01/17 |
SrZn5 | ICSD | 418615 | P6/mmm (191) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.653 | (1;000) | ✗ | 27/01/17 |
ZrSiS | COD | 1527641 | P4/nmm (129) | ✔ | 6 | 28 | 3 | 0.0 | 0.040 | 0.037 | (0;001) | ✗ | 27/01/17 |
SnS | COD | 9008295 | Cmcm (63) | ✔ | 4 | 40 | 3 | 0.5955 | 0.596 | 0.000 | (0;000) | ✗ | 27/01/17 |
SnS | COD | 9008785 | Pnma (62) | ✔ | 8 | 80 | 3 | 0.6586 | 0.838 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdGeO3 | ICSD | 30971 | R-3 (148) | ✔ | 10 | 68 | 3 | 1.7638 | 1.904 | 0.000 | (0;000) | ✗ | 27/01/17 |
CdSO4 | ICSD | 60571 | Cmcm (63) | ✔ | 12 | 84 | 3 | 2.6303 | 3.091 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiS | COD | 9008918 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.002 | 0.326 | (0;000) | ✗ | 27/01/17 |
Tl2S | COD | 9012278 | P-3m1 (164) | ✔ | 3 | 32 | 3 | 0.0 | 0.015 | 0.183 | (0;000) | ✗ | 27/01/17 |
VS | COD | 9008922 | P6_3/mmc (194) | ✔ | 4 | 38 | 3 | 0.0 | 0.000 | 0.834 | (0;000) | ✗ | 27/01/17 |
ZrS | COD | 9008781 | Fm-3m (225) | ✔ | 2 | 10 | 3 | 0.0 | 0.000 | 0.539 | (0;000) | ✗ | 27/01/17 |
V2CdO4 | COD | 9012330 | Fd-3m (227) | ✔ | 14 | 124 | 3 | 0.0 | 0.009 | 0.528 | (0;000) | ✗ | 27/01/17 |
TaTc | COD | 1527277 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.028 | 0.247 | (0;111) | ✗ | 27/01/17 |
TaZn2 | ICSD | 652937 | P6_3/mmc (194) | ✔ | 12 | 148 | 3 | 0.0 | 0.024 | 0.315 | (1;000) | ✗ | 27/01/17 |
Tc | ICSD | 76953 | P6_3/mmc (194) | ✔ | 2 | 30 | 3 | 0.0 | 0.000 | 0.631 | (1;000) | ✗ | 27/01/17 |
VTc | COD | 1527275 | Pm-3m (221) | ✔ | 2 | 28 | 3 | 0.0 | 0.020 | 0.250 | (0;111) | ✗ | 27/01/17 |
CoAsS | ICSD | 41857 | Pca2_1 (29) | ✗ | 12 | 80 | 3 | 0.0 | 0.001 | 0.519 | ? | ✗ | 06/10/16 |
YTlTe2 | ICSD | 653098 | R-3m (166) | ✔ | 4 | 36 | 3 | 0.5801 | 1.161 | 0.000 | (0;000) | ✗ | 27/01/17 |
YTe2 | ICSD | 653179 | P4/nmm (129) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.663 | (0;000) | ✗ | 27/01/17 |
SrHfO3 | ICSD | 161594 | P4mm (99) | ✗ | 5 | 40 | 3 | 3.9464 | 4.190 | 0.000 | (0;000) | ✗ | 29/11/16 |
Ti3Te4 | ICSD | 653076 | C2/m (12) | ✔ | 7 | 60 | 3 | 0.0 | 0.021 | 0.318 | (0;110) | ✗ | 27/01/17 |
Ti5Te4 | COD | 2310397 | I4/m (87) | ✔ | 9 | 84 | 3 | 0.0 | 0.002 | 0.609 | (1;111) | ✗ | 27/01/17 |
Ag3Hg4 | COD | 5910050 | Im-3m (229) | ✔ | 14 | 162 | 3 | 0.0 | 0.000 | 0.571 | (1;111) | ✗ | 30/01/17 |
Ti(VTe2)2 | ICSD | 653087 | C2/m (12) | ✔ | 7 | 62 | 3 | 0.0 | 0.009 | 0.663 | (1;000) | ✗ | 27/01/17 |
LiIO3 | ICSD | 35473 | P6_3 (173) | ✗ | 10 | 56 | 3 | 0.4522 | 0.636 | 0.000 | (0;000) | ✔ | 29/11/16 |
Te | ICSD | 52499 | R-3m (166) | ✔ | 2 | 12 | 3 | 0.0 | 0.136 | 0.557 | (1;000) | ✗ | 27/01/17 |
Te | ICSD | 97742 | C2/m (12) | ✔ | 3 | 18 | 3 | 0.0 | 0.040 | 0.497 | (1;000) | ✗ | 27/01/17 |
TiTe | COD | 1522489 | P6_3/mmc (194) | ✔ | 4 | 36 | 3 | 0.0 | 0.003 | 0.456 | (1;000) | ✗ | 27/01/17 |
Te | ICSD | 52500 | R-3m (166) | ✔ | 1 | 6 | 3 | 0.0 | 0.003 | 0.762 | (0;000) | ✗ | 27/01/17 |