▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▴ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
KSnSb | ICSD | 33933 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.2551 | 0.301 | 0.000 | (0;000) | ✔ | 06/10/16 |
TaTlSe3 | ICSD | 415528 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.1437 | 0.210 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl2Se3 | ICSD | 652069 | C2/c (15) | ✔ | 10 | 88 | 1 | 0.546 | 0.716 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2Se3 | ICSD | 652183 | Fddd (70) | ✔ | 20 | 160 | 3 | 1.0568 | 1.111 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ti3Se4 | ICSD | 79629 | P6_3/m (176) | ✔ | 14 | 120 | 3 | 0.0 | 0.004 | 0.245 | (0;000) | ✗ | 02/02/17 |
Y2ZnSe4 | ICSD | 652188 | Fd-3m (227) | ✔ | 14 | 116 | 3 | 0.1048 | 0.105 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnS | ICSD | 79374 | C2me (39) | ✗ | 4 | 40 | 2 | 1.0723 | 1.072 | 0.000 | (0;000) | ✗ | 06/10/16 |
Zr5Sn3Se | ICSD | 656302 | P6_3/mcm (193) | ✔ | 18 | 136 | 3 | 0.0 | 0.006 | 0.243 | (0;000) | ✗ | 02/02/17 |
SnSe | COD | 9008786 | Pnma (62) | ✔ | 8 | 80 | 2 | 0.4969 | 0.652 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlSe | COD | 9008952 | I4/mcm (140) | ✔ | 8 | 76 | 1 | 0.0 | 0.367 | 0.043 | (0;000) | ✗ | 02/02/17 |
SiPt | ICSD | 248491 | Pmnb (62) | ✔ | 8 | 56 | 1 | 0.0138 | 0.018 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr5Si3 | COD | 8101453 | I4/mcm (140) | ✔ | 16 | 124 | 1 | 0.0 | 0.011 | 0.586 | (0;000) | ✗ | 02/02/17 |
Ta5Si3 | ICSD | 652304 | I4/mcm (140) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.365 | (0;000) | ✗ | 02/02/17 |
Ta5Si3 | ICSD | 652335 | P6_3/mcm (193) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.654 | (0;000) | ✗ | 02/02/17 |
KSnSb | ICSD | 40816 | P6_3mc (186) | ✗ | 6 | 56 | 1 | 0.3258 | 0.378 | 0.000 | (0;000) | ✔ | 06/10/16 |
CaCuSb | ICSD | 42137 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.463 | 0.122 | (0;000) | ✗ | 27/01/17 |
V5Si3 | ICSD | 652495 | I4/mcm (140) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.323 | (0;000) | ✗ | 02/02/17 |
V5Si3 | ICSD | 652501 | P6_3/mcm (193) | ✔ | 16 | 154 | 3 | 0.0 | 0.000 | 0.744 | (0;000) | ✗ | 02/02/17 |
Y5Si3 | ICSD | 602005 | P6_3/mcm (193) | ✔ | 16 | 134 | 3 | 0.0 | 0.000 | 0.794 | (0;000) | ✗ | 02/02/17 |
YSi3 | ICSD | 263005 | I4/mmm (139) | ✔ | 16 | 92 | 3 | 0.0 | 0.004 | 0.638 | (0;000) | ✗ | 02/02/17 |
KZnSb | ICSD | 44680 | P-6m2 (187) | ✗ | 3 | 26 | 2 | 0.2326 | 0.390 | 0.000 | (0;000) | ✔ | 06/10/16 |
CaCrF6 | COD | 1525280 | R-3 (148) | ✔ | 8 | 66 | 1 | 0.0 | 0.021 | 0.350 | (0;000) | ✗ | 27/01/17 |
Zr5SiSn3 | ICSD | 656294 | P6_3/mcm (193) | ✔ | 18 | 132 | 3 | 0.0 | 0.000 | 0.562 | (0;000) | ✗ | 02/02/17 |
Sr2Si | COD | 1520913 | Pnma (62) | ✔ | 12 | 96 | 1 | 0.3629 | 0.363 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrSi | ICSD | 42140 | Immm (71) | ✔ | 20 | 140 | 1 | 0.0 | 0.004 | 0.379 | (0;000) | ✗ | 02/02/17 |
CaCrO4 | COD | 1010939 | I4_1/amd (141) | ✔ | 12 | 96 | 1 | 2.8326 | 2.833 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2PbO3 | ICSD | 22063 | Cmc2_1 (36) | ✗ | 12 | 100 | 1 | 0.9829 | 0.983 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs2CaF4 | ICSD | 82616 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 6.3925 | 6.507 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca(CuGe)2 | ICSD | 619230 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.030 | 0.787 | (0;000) | ✗ | 27/01/17 |
K2Sn2O3 | ICSD | 2216 | R3 (146) | ✗ | 7 | 64 | 2 | 0.8749 | 0.875 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaCu2O3 | COD | 2002243 | Pmmn (59) | ✔ | 12 | 100 | 3 | 0.0 | 0.009 | 0.954 | (0;000) | ✗ | 27/01/17 |
BP | ICSD | 181291 | F-43m (216) | ✗ | 2 | 8 | 3 | 1.2188 | 3.369 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgCl2 | ICSD | 51245 | P-4m2 (115) | ✗ | 3 | 24 | 2 | 4.679 | 5.054 | 0.000 | (0;000) | ✗ | 06/10/16 |
K3SbS4 | ICSD | 41895 | I-43m (217) | ✗ | 8 | 56 | 1 | 2.2119 | 2.258 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ca(CuS)2 | COD | 4001658 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 1.0638 | 1.064 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr5Sn4 | ICSD | 652856 | P6_3/mcm (193) | ✔ | 18 | 152 | 3 | 0.0 | 0.003 | 0.672 | (0;000) | ✗ | 02/02/17 |
Ca(SiCu)2 | ICSD | 619238 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.025 | 0.779 | (0;000) | ✗ | 27/01/17 |
CaCuF4 | ICSD | 9928 | I4/mcm (140) | ✔ | 12 | 98 | 1 | 0.0 | 0.001 | 0.620 | (0;000) | ✗ | 27/01/17 |
Sn | ICSD | 35503 | C2/m (12) | ✔ | 1 | 14 | 1 | 0.0 | 0.300 | 0.504 | (0;000) | ✗ | 02/02/17 |
Sr2Sn | COD | 1528200 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.1881 | 0.188 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl4SnTe3 | COD | 1523050 | I4/mcm (140) | ✔ | 16 | 168 | 3 | 0.0 | 0.057 | 0.193 | (0;000) | ✗ | 02/02/17 |
Tl2SnTe5 | ICSD | 73666 | I4/mcm (140) | ✔ | 16 | 140 | 3 | 0.0 | 0.012 | 0.128 | (0;000) | ✗ | 02/02/17 |
YZnSn | ICSD | 152622 | P6_3/mmc (194) | ✔ | 12 | 148 | 3 | 0.0 | 0.012 | 0.430 | (0;000) | ✗ | 02/02/17 |
S | COD | 9012364 | C2/c (15) | ✔ | 20 | 120 | 1 | 1.9556 | 2.174 | 0.000 | (0;000) | ✗ | 02/02/17 |
CaCuP | ICSD | 49740 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.0 | 0.861 | 0.050 | (0;000) | ✗ | 27/01/17 |
SrZn2 | ICSD | 246194 | P6_3/mmc (194) | ✔ | 12 | 136 | 3 | 0.0 | 0.007 | 0.815 | (0;000) | ✗ | 02/02/17 |
CaF2 | ICSD | 656449 | Pnma (62) | ✔ | 12 | 96 | 1 | 8.4981 | 8.498 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr5Sb3S | ICSD | 650833 | P6_3/mcm (193) | ✔ | 18 | 82 | 3 | 0.0 | 0.000 | 0.871 | (0;000) | ✗ | 02/02/17 |
Zr5Sn3S | ICSD | 656296 | P6_3/mcm (193) | ✔ | 18 | 136 | 3 | 0.0 | 0.004 | 0.229 | (0;000) | ✗ | 02/02/17 |
SrS | COD | 9016565 | Pnma (62) | ✔ | 8 | 64 | 1 | 1.1672 | 1.167 | 0.000 | (0;000) | ✗ | 02/02/17 |