▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
KCN | ICSD | 27351 | Cm (8) | ✗ | 3 | 18 | 1 | 4.6894 | 5.539 | 0.000 | (0;000) | ✗ | 06/10/16 |
InAs | ICSD | 165462 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
TiB2 | COD | 2002799 | P6/mmm (191) | ✔ | 3 | 18 | 3 | 0.0 | 0.010 | 0.123 | (0;001) | ✗ | 05/01/17 |
CaGe2 | ICSD | 77316 | R-3m (166) | ✔ | 3 | 18 | 1 | 0.0 | 0.016 | 0.347 | (0;000) | ✗ | 27/01/17 |
YHSe | ICSD | 72008 | P-6m2 (187) | ✗ | 3 | 18 | 3 | 1.4698 | 1.846 | 0.000 | (0;000) | ✗ | 15/02/17 |
AgI | COD | 9011695 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.287 | 2.140 | 0.000 | (0;000) | ✗ | 16/03/17 |
LiMgAs | ICSD | 107954 | F-43m (216) | ✗ | 3 | 18 | 3 | 1.2653 | 1.565 | 0.000 | (0;000) | ✗ | 15/02/17 |
GaAs | ICSD | 43951 | Pm2m (25) | ✗ | 2 | 18 | 3 | 0.0 | 0.019 | 0.600 | (0;011) | ✔ | 06/10/16 |
GaAs | ICSD | 43950 | I2mm (44) | ✗ | 2 | 18 | 3 | 0.0 | 0.036 | 0.463 | (0;111) | ✔ | 06/10/16 |
CrC | ICSD | 181709 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.443 | (0;100) | ✔ | 06/10/16 |
AgI | COD | 9011694 | P6mm (183) | ✗ | 2 | 18 | 1 | 0.0 | 0.240 | 0.249 | (0;000) | ✔ | 15/02/17 |
LaS | ICSD | 69581 | Cm2e (39) | ✗ | 4 | 18 | 2 | 0.0 | 0.001 | 0.772 | (0;010) | ✔ | 06/10/16 |
LiAlO2 | COD | 9009880 | R-3m (166) | ✔ | 4 | 18 | 2 | 6.4953 | 6.634 | 0.000 | (0;000) | ✗ | 05/01/17 |
Cs | ICSD | 150187 | I4_1/amd (141) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.599 | (1;111) | ✗ | 27/01/17 |
LiAlTe2 | COD | 4321120 | P3m1 (156) | ✗ | 4 | 18 | 1 | 0.0 | 0.021 | 0.162 | (0;000) | ✔ | 15/02/17 |
GaAs | ICSD | 107946 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.4268 | 0.427 | 0.000 | (0;000) | ✔ | 06/10/16 |
InSb | ICSD | 44642 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.015 | 0.582 | (1;000) | ✗ | 27/01/17 |
Cs | COD | 9012725 | Cmcm (63) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.898 | (1;000) | ✗ | 27/01/17 |
InSb | ICSD | 57396 | Pmm2 (25) | ✗ | 2 | 18 | 3 | 0.0 | 0.047 | 0.593 | (0;011) | ✔ | 06/10/16 |
InSb | ICSD | 162196 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0313 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
InSb | ICSD | 10021 | Pm2m (25) | ✗ | 2 | 18 | 3 | 0.0 | 0.061 | 0.615 | (0;001) | ✔ | 06/10/16 |
InP | ICSD | 165466 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3939 | 0.394 | 0.000 | (0;000) | ✔ | 06/10/16 |
InN | ICSD | 157514 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.007 | (1;000) | ✔ | 06/10/16 |
TaN | ICSD | 290395 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.080 | (1;100) | ✔ | 04/10/16 |
HRh | ICSD | 56168 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.615 | (0;000) | ✗ | 27/01/17 |
AgF | COD | 9008598 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.869 | 0.118 | (0;000) | ✗ | 05/01/17 |
HgTe | ICSD | 162602 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.018 | (1;000) | ✔ | 06/10/16 |
CuBr | ICSD | 23989 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3072 | 0.310 | 0.000 | (0;000) | ✔ | 06/10/16 |
HgSe | ICSD | 24175 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.023 | (1;000) | ✔ | 06/10/16 |
InN | ICSD | 41501 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.5638 | 1.567 | 0.000 | (0;000) | ✗ | 27/01/17 |
TaN | ICSD | 167876 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.290 | (1;000) | ✔ | 04/10/16 |
HgS | ICSD | 104340 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.087 | 0.008 | (1;000) | ✔ | 06/10/16 |
NbN | ICSD | 167868 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.347 | (0;000) | ✔ | 04/10/16 |
AgCl | COD | 9011666 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.8363 | 2.918 | 0.000 | (0;000) | ✗ | 05/01/17 |
InP | ICSD | 188692 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.031 | 0.246 | (0;000) | ✗ | 27/01/17 |
AgBr | COD | 9011682 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.5659 | 2.359 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZnTe | COD | 1010535 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.283 | (0;000) | ✗ | 27/01/17 |
AgBr | ICSD | 31109 | P4/mmm (123) | ✔ | 2 | 18 | 1 | 0.0473 | 0.348 | 0.000 | (0;000) | ✗ | 05/01/17 |
AgCl | ICSD | 31108 | P4/mmm (123) | ✔ | 2 | 18 | 1 | 0.4513 | 0.682 | 0.000 | (0;000) | ✗ | 05/01/17 |
HfB2 | COD | 1510711 | P6/mmm (191) | ✔ | 3 | 18 | 3 | 0.0 | 0.020 | 0.133 | (0;001) | ✗ | 05/01/17 |
BiTeI | ICSD | 263109 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.1819 | 0.182 | 0.000 | (0;000) | ✔ | 06/10/16 |
InBi | ICSD | 184573 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.245 | (1;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 10500 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.255 | (0;000) | ✔ | 06/10/16 |
BiTeI | ICSD | 74501 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.003 | 0.261 | (0;000) | ✔ | 06/10/16 |
GeI2 | ICSD | 27674 | P-6m2 (187) | ✗ | 3 | 18 | 3 | 0.7466 | 0.838 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiTeI | ICSD | 79364 | P3m1 (156) | ✗ | 3 | 18 | 2 | 0.0 | 0.006 | 0.006 | (1;100) | ✔ | 06/10/16 |
HgTe | COD | 1010537 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.000 | 0.386 | (0;000) | ✗ | 27/01/17 |
GaSb | ICSD | 190414 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3208 | 0.324 | 0.000 | (0;000) | ✔ | 06/10/16 |
GaN | ICSD | 155050 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.7442 | 3.044 | 0.000 | (0;000) | ✗ | 27/01/17 |
GaP | ICSD | 103795 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.5678 | 1.791 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaN | ICSD | 156260 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.9043 | 1.904 | 0.000 | (0;000) | ✗ | 06/10/16 |
HgSe | ICSD | 56210 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.0 | 0.779 | 0.318 | (0;000) | ✗ | 27/01/17 |
MnAl | ICSD | 608581 | Pm-3m (221) | ✔ | 2 | 18 | 3 | 0.0 | 0.001 | 0.693 | (1;111) | ✗ | 05/01/17 |
InSb | ICSD | 44641 | Pm-3m (221) | ✔ | 2 | 18 | 3 | 0.0 | 0.033 | 0.511 | (1;000) | ✗ | 27/01/17 |
BaLiP | ICSD | 56444 | P-6m2 (187) | ✗ | 3 | 18 | 1 | 0.6342 | 0.634 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaSi2 | COD | 1527353 | P-3m1 (164) | ✔ | 3 | 18 | 2 | 0.0 | 0.020 | 0.229 | (0;001) | ✗ | 05/01/17 |
HgS | COD | 9000004 | R-3m (166) | ✔ | 2 | 18 | 3 | 0.0 | 0.083 | 0.269 | (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 |
Sr | COD | 9011726 | I4_1/amd (141) | ✔ | 2 | 20 | 1 | 0.0 | 0.003 | 0.174 | (1;111) | ✗ | 27/01/17 |
MnSb | ICSD | 191175 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.000 | 0.062 | (1;000) | ✔ | 04/10/16 |
N2 | COD | 9012477 | P6_3/mmc (194) | ✔ | 4 | 20 | 1 | 6.0626 | 6.531 | 0.000 | (0;000) | ✗ | 27/01/17 |
N2 | COD | 9012475 | P4_2/mnm (136) | ✔ | 4 | 20 | 1 | 7.1756 | 7.385 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr | COD | 9012728 | P6_3/mmc (194) | ✔ | 2 | 20 | 1 | 0.0 | 0.009 | 0.365 | (0;000) | ✗ | 27/01/17 |
Be2Zn | ICSD | 168955 | Fmmm (69) | ✔ | 3 | 20 | 2 | 0.0 | 0.043 | 0.231 | (1;000) | ✗ | 06/10/16 |
NiPt | ICSD | 646297 | P4/mmm (123) | ✔ | 2 | 20 | 3 | 0.0 | 0.008 | 0.525 | (0;000) | ✗ | 27/01/17 |
Ni | COD | 9013007 | P6_3/mmc (194) | ✔ | 2 | 20 | 3 | 0.0 | 0.001 | 0.590 | (1;000) | ✗ | 27/01/17 |
CrB2 | COD | 1510641 | P6/mmm (191) | ✔ | 3 | 20 | 3 | 0.0 | 0.008 | 0.696 | (0;001) | ✗ | 05/01/17 |
MnP | ICSD | 191788 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.028 | 0.137 | (0;000) | ✔ | 04/10/16 |
SnTe | ICSD | 53956 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.063 | 0.313 | (0;000) | ✔ | 06/10/16 |
Li2MgSi | ICSD | 181255 | F-43m (216) | ✗ | 4 | 20 | 3 | 0.1016 | 2.053 | 0.000 | (0;000) | ✔ | 06/10/16 |
SnTe | ICSD | 52488 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.308 | 0.567 | (1;111) | ✗ | 27/01/17 |
MnN | ICSD | 236787 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0222 | 0.393 | 0.000 | (0;000) | ✔ | 04/10/16 |
Zr2Cd | ICSD | 620613 | I4/mmm (139) | ✔ | 3 | 20 | 3 | 0.0 | 0.011 | 0.205 | (0;111) | ✗ | 27/01/17 |
SnTe | COD | 9008726 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.1954 | 0.233 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiSi2 | ICSD | 86810 | Fmmm (69) | ✔ | 3 | 20 | 3 | 0.0 | 0.003 | 0.728 | (1;000) | ✗ | 06/10/16 |
SnS | ICSD | 43409 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.025 | 0.304 | (0;000) | ✔ | 06/10/16 |
RbAu | COD | 1517938 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 0.1979 | 1.158 | 0.000 | (0;000) | ✗ | 05/01/17 |
Li3Au | COD | 1510223 | Fm-3m (225) | ✔ | 4 | 20 | 3 | 0.0 | 0.253 | 0.656 | (0;000) | ✗ | 05/01/17 |
SnTe | ICSD | 52489 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.1897 | 0.223 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrN2 | ICSD | 423722 | I4/mmm (139) | ✔ | 3 | 20 | 1 | 0.0 | 0.005 | 0.580 | (0;000) | ✗ | 27/01/17 |
TiFe | COD | 1522778 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.017 | 0.224 | (1;111) | ✗ | 27/01/17 |
As | COD | 9008573 | Cmce (64) | ✔ | 4 | 20 | 2 | 0.0 | 0.219 | 0.019 | (0;000) | ✗ | 05/01/17 |
CaN2 | ICSD | 423721 | I4/mmm (139) | ✔ | 3 | 20 | 1 | 0.0 | 0.006 | 0.578 | (0;000) | ✗ | 27/01/17 |
PbS | ICSD | 183245 | P-6m2 (187) | ✗ | 2 | 20 | 3 | 0.0 | 0.584 | 0.111 | (0;000) | ✔ | 06/10/16 |
PbS | ICSD | 183243 | R3m (160) | ✗ | 2 | 20 | 2 | 0.9607 | 0.966 | 0.000 | (0;000) | ✗ | 06/10/16 |
MnN | ICSD | 236808 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.0 | 0.000 | 0.287 | (1;000) | ✗ | 27/01/17 |
LiBC | ICSD | 245288 | P6_3/mmc (194) | ✔ | 6 | 20 | 2 | 0.87 | 1.372 | 0.000 | (0;000) | ✗ | 27/01/17 |
AlRh | ICSD | 609214 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 0.0 | 0.047 | 0.337 | (0;000) | ✗ | 05/01/17 |
CrTe | ICSD | 169766 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.024 | 0.243 | (1;000) | ✔ | 04/10/16 |
SrMg | COD | 1522615 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 0.0 | 0.000 | 0.620 | (0;111) | ✗ | 27/01/17 |
Ca | COD | 9012730 | P6_3/mmc (194) | ✔ | 2 | 20 | 1 | 0.0 | 0.004 | 0.399 | (0;000) | ✗ | 27/01/17 |
Bi2Pd | ICSD | 56280 | I4/mmm (139) | ✔ | 3 | 20 | 2 | 0.0 | 0.386 | 0.383 | (1;000) | ✗ | 06/10/16 |
SnSe | COD | 9008725 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.0 | 0.223 | 0.011 | (0;000) | ✗ | 27/01/17 |
Fe2Ge | ICSD | 108442 | P6/mmm (191) | ✔ | 3 | 20 | 3 | 0.0 | 0.002 | 0.572 | (0;000) | ✗ | 27/01/17 |
TlF | COD | 1010462 | Fmmm (69) | ✔ | 2 | 20 | 2 | 1.7688 | 1.769 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb | ICSD | 42678 | P2_1/m (11) | ✔ | 4 | 20 | 2 | 0.0 | 0.099 | 0.336 | (0;000) | ✗ | 27/01/17 |
CsAu | COD | 1517937 | Pm-3m (221) | ✔ | 2 | 20 | 3 | 1.0321 | 1.117 | 0.000 | (0;000) | ✗ | 05/01/17 |
SnS | ICSD | 52107 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 0.0 | 0.104 | 0.037 | (0;000) | ✗ | 27/01/17 |
Mg | COD | 4111965 | P6_3/mmc (194) | ✔ | 2 | 20 | 0 | 0.0 | 0.011 | 0.445 | (1;000) | ✗ | 27/01/17 |
TiSi2 | COD | 1009012 | Fmmm (69) | ✔ | 3 | 20 | 3 | 0.0 | 0.005 | 0.728 | (1;000) | ✗ | 27/01/17 |