▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TaSe2 | ICSD | 651956 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.809 | (0;000) | ✗ | 27/01/17 |
TaO2 | ICSD | 603572 | P4_2/mnm (136) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.903 | (0;000) | ✗ | 27/01/17 |
TaSe2 | COD | 2310532 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.841 | (0;001) | ✗ | 27/01/17 |
BaSb2 | COD | 8100903 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.056 | 0.102 | (0;010) | ✗ | 02/02/17 |
CaSnAu | COD | 2019618 | Imm2 (44) | ✗ | 6 | 70 | 3 | 0.0 | 0.035 | 0.553 | ? | ✗ | 15/02/17 |
Sr2PdO3 | COD | 1531926 | Immm (71) | ✔ | 6 | 56 | 2 | 0.1836 | 0.627 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaS2 | ICSD | 24757 | R-3m (166) | ✔ | 6 | 50 | 1 | 0.0 | 0.002 | 0.929 | (1;000) | ✗ | 27/01/17 |
CoTeMo | COD | 1521136 | Pmmn (59) | ✔ | 6 | 74 | 1 | 0.0 | 0.000 | 0.828 | (0;000) | ✗ | 02/02/17 |
CsNaSe | ICSD | 41322 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 2.1205 | 2.274 | 0.000 | (0;000) | ✗ | 02/02/17 |
YZrSb | ICSD | 107067 | I4/mmm (139) | ✔ | 6 | 40 | 3 | 0.0 | 0.006 | 0.722 | (0;111) | ✗ | 27/01/17 |
CsNaTe | ICSD | 405538 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 1.9586 | 2.076 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zr2Sb | ICSD | 107691 | I4/mmm (139) | ✔ | 6 | 26 | 3 | 0.0 | 0.016 | 0.568 | (0;111) | ✗ | 27/01/17 |
Sc2Sb | COD | 8100587 | P4/nmm (129) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.836 | (1;000) | ✗ | 27/01/17 |
BaHI | COD | 9009160 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 2.2911 | 2.291 | 0.000 | (0;000) | ✗ | 21/03/17 |
TiO2 | COD | 9007432 | P4_2/mnm (136) | ✔ | 6 | 48 | 3 | 1.9813 | 1.981 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaH2 | ICSD | 615913 | Cmcm (63) | ✔ | 6 | 24 | 1 | 1.7224 | 2.854 | 0.000 | (0;000) | ✗ | 02/02/17 |
VSb2 | COD | 8100157 | I4/mcm (140) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.536 | (1;000) | ✗ | 27/01/17 |
SrZn2 | COD | 2310343 | Imma (74) | ✔ | 6 | 68 | 3 | 0.0 | 0.011 | 0.504 | (0;111) | ✗ | 27/01/17 |
TiO2 | COD | 1511015 | P4_2/mnm (136) | ✔ | 6 | 48 | 3 | 1.8907 | 1.891 | 0.000 | (0;000) | ✗ | 27/01/17 |
SiO2 | COD | 9007154 | P4_2/mnm (136) | ✔ | 6 | 32 | 3 | 6.8678 | 6.868 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaS2 | COD | 9007815 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.863 | (1;000) | ✗ | 27/01/17 |
Rb2Te | ICSD | 55158 | P6_3/mmc (194) | ✔ | 6 | 48 | 2 | 1.8381 | 1.838 | 0.000 | (0;000) | ✗ | 02/02/17 |
BW2 | COD | 1511333 | I4/mcm (140) | ✔ | 6 | 118 | 3 | 0.0 | 0.000 | 0.564 | (1;000) | ✗ | 11/04/17 |
Te2Ru | COD | 1528256 | Pnnm (58) | ✔ | 6 | 56 | 3 | 0.2 | 1.021 | 0.000 | (0;000) | ✗ | 27/01/17 |
CuO2 | ICSD | 54129 | Cmcm (63) | ✔ | 6 | 46 | 1 | 0.0 | 0.000 | 0.927 | (0;110) | ✗ | 02/02/17 |
Sn2Ru | COD | 1522876 | I4/mcm (140) | ✔ | 6 | 88 | 3 | 0.0 | 0.011 | 0.476 | (0;000) | ✗ | 27/01/17 |
AlBW | COD | 4343329 | Cmcm (63) | ✔ | 6 | 68 | 3 | 0.0 | 0.097 | 0.225 | (1;110) | ✗ | 11/04/17 |
Sb2Ru | COD | 9012559 | Pnnm (58) | ✔ | 6 | 52 | 3 | 0.0 | 0.545 | 0.010 | (0;000) | ✗ | 27/01/17 |
CsHg2 | ICSD | 408695 | Imma (74) | ✔ | 6 | 66 | 3 | 0.0 | 0.000 | 0.434 | (0;011) | ✗ | 02/02/17 |
Zr2Rh | COD | 1524522 | I4/mcm (140) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.779 | (0;111) | ✗ | 27/01/17 |
Sn2Rh | COD | 1523795 | I4/mcm (140) | ✔ | 6 | 90 | 3 | 0.0 | 0.000 | 0.681 | (1;111) | ✗ | 27/01/17 |
TiO2 | COD | 9008216 | I4_1/amd (141) | ✔ | 6 | 48 | 3 | 2.1406 | 2.472 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ti2CuSb3 | COD | 1526687 | P-4m2 (115) | ✗ | 6 | 50 | 3 | 0.0 | 0.001 | 0.797 | ? | ✗ | 15/02/17 |
YInCu4 | ICSD | 628179 | F-43m (216) | ✗ | 6 | 68 | 3 | 0.0 | 0.502 | 0.123 | (0;000) | ✔ | 15/02/17 |
YRh5 | COD | 1523668 | P6/mmm (191) | ✔ | 6 | 96 | 3 | 0.0 | 0.005 | 0.709 | (0;000) | ✗ | 27/01/17 |
CsAuSe | COD | 1510104 | Cmcm (63) | ✔ | 6 | 52 | 1 | 1.5866 | 1.850 | 0.000 | (0;000) | ✗ | 02/02/17 |
PdO2 | ICSD | 647283 | P4_2/mnm (136) | ✔ | 6 | 60 | 3 | 0.0 | 0.006 | 0.207 | (0;000) | ✗ | 27/01/17 |
YSi2Rh3 | ICSD | 52080 | P6/mmm (191) | ✔ | 6 | 70 | 3 | 0.0 | 0.011 | 0.841 | (1;000) | ✗ | 27/01/17 |
ScInCu4 | ICSD | 416528 | F-43m (216) | ✗ | 6 | 68 | 3 | 0.0 | 0.413 | 0.159 | (0;000) | ✔ | 15/03/17 |
CaHI | COD | 9009167 | P4/nmm (129) | ✔ | 6 | 36 | 1 | 3.1277 | 3.128 | 0.000 | (0;000) | ✗ | 21/03/17 |
SrRh2 | COD | 1523824 | Fd-3m (227) | ✔ | 6 | 88 | 3 | 0.0 | 0.001 | 0.615 | (0;000) | ✗ | 27/01/17 |
RbTeAu | COD | 1510283 | Pmma (51) | ✔ | 6 | 52 | 1 | 0.7785 | 0.779 | 0.000 | (0;000) | ✗ | 02/02/17 |
TaSe2 | ICSD | 24318 | R3m (160) | ✗ | 6 | 50 | 1 | 0.0 | 0.012 | 0.796 | ? | ✗ | 15/02/17 |
Zr2Ni | COD | 2310220 | I4/mcm (140) | ✔ | 6 | 36 | 3 | 0.0 | 0.003 | 0.228 | (0;111) | ✗ | 27/01/17 |
Cs2S | ICSD | 27463 | P6_3/mmc (194) | ✔ | 6 | 48 | 1 | 1.3455 | 1.346 | 0.000 | (0;000) | ✗ | 02/02/17 |
YRh2 | COD | 1523667 | Fd-3m (227) | ✔ | 6 | 90 | 3 | 0.0 | 0.000 | 0.574 | (0;000) | ✗ | 27/01/17 |
Be5Fe | ICSD | 616267 | F-43m (216) | ✗ | 6 | 28 | 1 | 0.0 | 0.000 | 0.556 | ? | ✗ | 15/02/17 |
Ta2Ni | COD | 1524530 | I4/mcm (140) | ✔ | 6 | 72 | 3 | 0.0 | 0.008 | 0.544 | (0;111) | ✗ | 27/01/17 |
SrTl2 | COD | 1527561 | P6_3/mmc (194) | ✔ | 6 | 72 | 3 | 0.0 | 0.007 | 0.086 | (0;000) | ✗ | 27/01/17 |
YPt2 | COD | 1523663 | Fd-3m (227) | ✔ | 6 | 62 | 3 | 0.0 | 0.000 | 0.339 | (0;000) | ✗ | 27/01/17 |
Cs2Pt | ICSD | 413241 | P6_3/mmc (194) | ✔ | 6 | 56 | 2 | 1.2769 | 1.369 | 0.000 | (0;000) | ✗ | 02/02/17 |
HgI2 | COD | 9014434 | P4_2/nmc (137) | ✔ | 6 | 52 | 2 | 0.8955 | 0.896 | 0.000 | (0;000) | ✗ | 02/02/17 |
YNi4Au | ICSD | 612233 | F-43m (216) | ✗ | 6 | 62 | 3 | 0.0 | 0.009 | 0.950 | ? | ✗ | 15/02/17 |
CdHgS4 | ICSD | 26857 | I-4 (82) | ✗ | 6 | 48 | 1 | 0.0 | 0.009 | 0.786 | ? | ✗ | 22/03/17 |
TaPt2 | COD | 1523693 | Cmcm (63) | ✔ | 6 | 66 | 3 | 0.0 | 0.000 | 0.632 | (1;110) | ✗ | 27/01/17 |
SrPt2 | ICSD | 108148 | Fd-3m (227) | ✔ | 6 | 60 | 3 | 0.0 | 0.004 | 0.478 | (0;000) | ✗ | 27/01/17 |
SrPt5 | COD | 1523823 | P6/mmm (191) | ✔ | 6 | 60 | 3 | 0.0 | 0.013 | 0.495 | (1;000) | ✗ | 27/01/17 |
TaPS | ICSD | 648183 | Immm (71) | ✔ | 6 | 48 | 3 | 0.0 | 0.050 | 0.506 | (0;000) | ✗ | 27/01/17 |
SrSnP | ICSD | 63594 | P4/nmm (129) | ✔ | 6 | 58 | 2 | 0.0 | 0.000 | 0.832 | (0;000) | ✗ | 27/01/17 |
SrZn5 | ICSD | 418615 | P6/mmm (191) | ✔ | 6 | 70 | 3 | 0.0 | 0.000 | 0.653 | (1;000) | ✗ | 27/01/17 |
ReO2 | ICSD | 154021 | P4_2/mnm (136) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.836 | (0;000) | ✗ | 27/01/17 |
ZrZnNi4 | COD | 1523279 | F-43m (216) | ✗ | 6 | 56 | 3 | 0.0 | 0.000 | 0.408 | ? | ✗ | 15/02/17 |
NClO4 | COD | 9015836 | F-43m (216) | ✗ | 6 | 36 | 1 | 0.0 | 0.003 | 0.207 | (0;000) | ✔ | 15/02/17 |
K2Zr | ICSD | 27670 | P6_3/mmc (194) | ✔ | 6 | 44 | 1 | 0.0 | 0.000 | 0.174 | (1;000) | ✗ | 02/02/17 |
AlPO4 | COD | 1010142 | I-4 (82) | ✗ | 6 | 32 | 3 | 2.4343 | 2.620 | 0.000 | (0;000) | ✗ | 15/02/17 |
Tl2Pd | COD | 1524515 | I4/mcm (140) | ✔ | 6 | 88 | 3 | 0.0 | 0.003 | 0.430 | (1;000) | ✗ | 27/01/17 |
ZrO2 | COD | 1526427 | P4_2/nmc (137) | ✔ | 6 | 32 | 3 | 3.4892 | 3.667 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrNi5 | ICSD | 647157 | F-43m (216) | ✗ | 6 | 54 | 3 | 0.0 | 0.001 | 0.892 | ? | ✗ | 15/02/17 |
NaClO4 | COD | 1010573 | F-43m (216) | ✗ | 6 | 40 | 1 | 2.3653 | 2.366 | 0.000 | (0;000) | ✗ | 15/02/17 |
ZrV2 | COD | 1527368 | Fd-3m (227) | ✔ | 6 | 60 | 3 | 0.0 | 0.000 | 0.683 | (0;000) | ✗ | 27/01/17 |
ScZnPd | ICSD | 424601 | Cmcm (63) | ✔ | 6 | 82 | 3 | 0.0 | 0.000 | 0.674 | (0;110) | ✗ | 27/01/17 |
RhO2 | ICSD | 647367 | P4_2/mnm (136) | ✔ | 6 | 58 | 3 | 0.0 | 0.000 | 0.664 | (0;000) | ✗ | 27/01/17 |
AgClO4 | COD | 1010574 | F-43m (216) | ✗ | 6 | 42 | 1 | 2.4263 | 2.431 | 0.000 | (0;000) | ✗ | 15/02/17 |
WSe2 | COD | 9012193 | P6_3/mmc (194) | ✔ | 6 | 80 | 2 | 0.8573 | 1.336 | 0.000 | (0;000) | ✗ | 11/04/17 |
WO2 | ICSD | 647647 | P4_2/mnm (136) | ✔ | 6 | 52 | 3 | 0.0 | 0.002 | 0.158 | (0;000) | ✗ | 27/01/17 |
SrPd5 | COD | 1523822 | P6/mmm (191) | ✔ | 6 | 100 | 3 | 0.0 | 0.003 | 0.597 | (0;000) | ✗ | 27/01/17 |
ZrIN | ICSD | 36119 | Pmmn (59) | ✔ | 6 | 32 | 2 | 1.1231 | 1.123 | 0.000 | (0;000) | ✗ | 30/01/17 |
P2Ru | COD | 9012557 | Pnnm (58) | ✔ | 6 | 52 | 3 | 0.369 | 1.245 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrSiO | ICSD | 25731 | P4/nmm (129) | ✔ | 6 | 28 | 2 | 0.0 | 0.041 | 0.027 | (0;001) | ✗ | 27/01/17 |
RbHg2 | ICSD | 408698 | Imma (74) | ✔ | 6 | 66 | 3 | 0.0 | 0.000 | 0.587 | (1;110) | ✗ | 02/02/17 |
HfNi5 | ICSD | 150940 | F-43m (216) | ✗ | 6 | 62 | 3 | 0.0 | 0.011 | 0.883 | ? | ✗ | 15/02/17 |
CuO2 | ICSD | 157553 | Cmcm (63) | ✔ | 6 | 46 | 1 | 0.0 | 0.000 | 0.943 | (0;110) | ✗ | 02/02/17 |
CdClO | COD | 9016472 | P6_3mc (186) | ✗ | 6 | 50 | 2 | 0.0 | 0.000 | 0.749 | ? | ✗ | 15/02/17 |
Sr2Bi | COD | 9008355 | I4/mmm (139) | ✔ | 6 | 70 | 1 | 0.0 | 0.033 | 0.051 | (0;111) | ✗ | 02/02/17 |
OsO2 | COD | 9007542 | P4_2/mnm (136) | ✔ | 6 | 56 | 3 | 0.0 | 0.008 | 0.316 | (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 |
SrPd2 | COD | 1523821 | Fd-3m (227) | ✔ | 6 | 92 | 3 | 0.0 | 0.000 | 0.310 | (0;000) | ✗ | 27/01/17 |
ReNCl4 | COD | 7221223 | P1 (1) | ✗ | 6 | 48 | 1 | 1.2934 | 1.382 | 0.000 | (0;000) | ✗ | 22/03/17 |
Tl2S | ICSD | 27464 | P6_3/mmc (194) | ✔ | 6 | 64 | 1 | 0.5041 | 0.613 | 0.000 | (0;000) | ✗ | 02/02/17 |
HfIN | ICSD | 190384 | R-3m (166) | ✔ | 6 | 48 | 2 | 0.6678 | 1.802 | 0.000 | (0;000) | ✗ | 29/03/17 |
Sr2H3I | ICSD | 422181 | P-3m1 (164) | ✔ | 6 | 30 | 1 | 1.7868 | 2.196 | 0.000 | (0;000) | ✗ | 29/03/17 |
Hf2CuSb3 | COD | 1526691 | P-4m2 (115) | ✗ | 6 | 50 | 3 | 0.0 | 0.003 | 0.820 | ? | ✗ | 15/02/17 |
Zr2CuSb3 | COD | 1526689 | P-4m2 (115) | ✗ | 6 | 34 | 3 | 0.0 | 0.001 | 0.844 | ? | ✗ | 15/02/17 |
PtO2 | ICSD | 77654 | Pn-3m (224) | ✔ | 6 | 44 | 3 | 0.0 | 0.000 | 0.528 | (0;000) | ✗ | 27/01/17 |
Ga | COD | 9012484 | I-43d (220) | ✗ | 6 | 78 | 3 | 0.0 | 0.000 | 0.972 | ? | ✗ | 15/02/17 |
RhPb2 | COD | 1524519 | I4/mcm (140) | ✔ | 6 | 90 | 3 | 0.0 | 0.000 | 0.660 | (1;111) | ✗ | 27/01/17 |
Ba2Sb | ICSD | 41837 | I4/mmm (139) | ✔ | 6 | 50 | 1 | 0.0 | 0.024 | 0.277 | (0;111) | ✗ | 02/02/17 |
NbTe2 | COD | 2101235 | P4/m (83) | ✔ | 6 | 50 | 1 | 0.0 | 0.007 | 0.538 | (1;001) | ✗ | 02/02/17 |
YGaI | ICSD | 417149 | P-3m1 (164) | ✔ | 6 | 62 | 2 | 0.0 | 0.781 | 0.317 | (0;000) | ✗ | 22/03/17 |
KLiS | ICSD | 27465 | P6_3/mmc (194) | ✔ | 6 | 36 | 1 | 1.3014 | 1.301 | 0.000 | (0;000) | ✗ | 02/02/17 |