▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▴ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Cs2Te3As | ICSD | 405235 | P2_1/c (14) | ✔ | 24 | 164 | 3 | 0.8153 | 0.910 | 0.000 | (0;000) | ✗ | 04/08/17 |
Tl3AsS3 | ICSD | 100292 | R3m (160) | ✗ | 7 | 62 | 3 | 0.8209 | 0.911 | 0.000 | (0;000) | ✗ | 06/10/16 |
V4Ag2O11 | COD | 1509687 | C2/m (12) | ✔ | 17 | 140 | 3 | 0.6709 | 0.911 | 0.000 | (0;000) | ✗ | 30/01/17 |
HfTlCuS3 | ICSD | 82562 | Cmcm (63) | ✔ | 12 | 108 | 3 | 0.9041 | 0.911 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb2PtC2 | COD | 1526414 | P-3m1 (164) | ✔ | 5 | 36 | 3 | 0.9106 | 0.913 | 0.000 | (0;000) | ✗ | 27/01/17 |
BiIrSe | ICSD | 616741 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.4071 | 0.913 | 0.000 | (0;000) | ✔ | 13/04/17 |
NaH2N | ICSD | 14007 | Fddd (70) | ✔ | 16 | 64 | 1 | 0.8969 | 0.913 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg(ScSe2)2 | ICSD | 642814 | Fd-3m (227) | ✔ | 14 | 112 | 3 | 0.9141 | 0.914 | 0.000 | (0;000) | ✗ | 02/02/17 |
CuBi(WO4)2 | ICSD | 67569 | P1 (1) | ✗ | 12 | 130 | 3 | 0.9085 | 0.914 | 0.000 | (0;000) | ✗ | 11/04/17 |
Ba(AgS)2 | COD | 1509711 | P-3m1 (164) | ✔ | 5 | 44 | 2 | 0.9156 | 0.916 | 0.000 | (0;000) | ✗ | 05/01/17 |
NaP | COD | 1528277 | P2_12_12_1 (19) | ✗ | 16 | 112 | 1 | 0.8664 | 0.916 | 0.000 | (0;000) | ✗ | 29/03/17 |
CdHgAsBr | ICSD | 240354 | Pmma (51) | ✔ | 16 | 144 | 3 | 0.6512 | 0.918 | 0.000 | (0;000) | ✗ | 21/03/17 |
LiBeSb | ICSD | 100114 | P6_3mc (186) | ✗ | 6 | 24 | 1 | 0.477 | 0.920 | 0.000 | (0;000) | ✔ | 06/10/16 |
LiBeSb | ICSD | 616318 | P6_3mc (186) | ✗ | 6 | 24 | 1 | 0.4792 | 0.920 | 0.000 | (0;000) | ✔ | 06/10/16 |
Sr2CrN3 | COD | 7012865 | P-1 (2) | ✔ | 12 | 98 | 1 | 0.7771 | 0.921 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cs6AlSb3 | ICSD | 300128 | P2_1/m (11) | ✔ | 20 | 144 | 1 | 0.8041 | 0.922 | 0.000 | (0;000) | ✗ | 16/03/17 |
AlAgO2 | COD | 1509215 | Pna2_1 (33) | ✗ | 16 | 104 | 3 | 0.784 | 0.922 | 0.000 | (0;000) | ✗ | 16/03/17 |
CoHO2 | COD | 9009449 | P6_3/mmc (194) | ✔ | 8 | 60 | 3 | 0.7607 | 0.923 | 0.000 | (0;000) | ✗ | 27/01/17 |
WO3 | ICSD | 86144 | P-42_1m (113) | ✗ | 16 | 184 | 3 | 0.7896 | 0.923 | 0.000 | (0;000) | ✗ | 11/04/17 |
TiO2 | ICSD | 189324 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.9234 | 0.923 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ir2S3 | ICSD | 640948 | Pbcn (60) | ✔ | 20 | 208 | 3 | 0.8351 | 0.924 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(InSe2)2 | ICSD | 151953 | P-42m (111) | ✗ | 7 | 62 | 3 | 0.9242 | 0.924 | 0.000 | (0;000) | ✗ | 07/10/16 |
SiP2 | ICSD | 30693 | Pa3 (205) | ✔ | 12 | 56 | 3 | 0.0 | 0.924 | 0.248 | (0;000) | ✗ | 27/01/17 |
CuSe2Br | ICSD | 410004 | P2_1/c (14) | ✔ | 16 | 120 | 2 | 0.8528 | 0.925 | 0.000 | (0;000) | ✗ | 02/02/17 |
SnPbS3 | ICSD | 648477 | Pnma (62) | ✔ | 20 | 184 | 2 | 0.876 | 0.925 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sb2O5 | COD | 9011205 | C2/c (15) | ✔ | 14 | 80 | 3 | 0.9086 | 0.925 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ca2SiO4 | ICSD | 182052 | P-3m1 (164) | ✔ | 14 | 96 | 1 | 0.9223 | 0.925 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ag3SI | ICSD | 93431 | R3 (146) | ✗ | 5 | 46 | 3 | 0.4794 | 0.925 | 0.000 | (0;000) | ✔ | 06/10/16 |
CuSe2Cl | ICSD | 68292 | P2_1/c (14) | ✔ | 16 | 120 | 2 | 0.7697 | 0.926 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaInTe2 | ICSD | 25346 | I4/mcm (140) | ✔ | 8 | 68 | 1 | 0.7113 | 0.926 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te6RhBr3 | ICSD | 423669 | R-3c (167) | ✔ | 20 | 148 | 3 | 0.7889 | 0.927 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3BrO | ICSD | 33920 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 0.9272 | 0.927 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sc2S3 | ICSD | 22236 | Fddd (70) | ✔ | 20 | 160 | 3 | 0.912 | 0.927 | 0.000 | (0;000) | ✗ | 29/03/17 |
ZrTl2PbSe4 | ICSD | 237508 | C2/c (15) | ✔ | 16 | 136 | 3 | 0.0 | 0.930 | 0.030 | (0;000) | ✗ | 02/02/17 |
YN | ICSD | 161079 | P6_3/mmc (194) | ✔ | 4 | 32 | 3 | 0.6511 | 0.930 | 0.000 | (0;000) | ✗ | 06/10/16 |
TlPd3O4 | ICSD | 2275 | Fm-3m (225) | ✔ | 16 | 182 | 3 | 0.9298 | 0.930 | 0.000 | (0;000) | ✗ | 02/02/17 |
KNiIO6 | ICSD | 60313 | P312 (149) | ✗ | 9 | 62 | 3 | 0.9095 | 0.930 | 0.000 | (0;000) | ✗ | 15/02/17 |
In2Te5 | ICSD | 640615 | Cc (9) | ✗ | 14 | 112 | 2 | 0.8149 | 0.931 | 0.000 | (0;000) | ✗ | 29/03/17 |
LiYMo3O8 | ICSD | 28526 | P3m1 (156) | ✗ | 13 | 104 | 3 | 0.9313 | 0.931 | 0.000 | (0;000) | ✗ | 15/02/17 |
NaBrO3 | COD | 1010058 | P2_13 (198) | ✗ | 20 | 136 | 1 | 0.9042 | 0.932 | 0.000 | (0;000) | ✗ | 21/03/17 |
Cs2As2Pd | ICSD | 69647 | Cmcm (63) | ✔ | 10 | 92 | 1 | 0.8383 | 0.933 | 0.000 | (0;000) | ✗ | 30/01/17 |
Zn(RhO2)2 | ICSD | 109298 | Fd-3m (227) | ✔ | 14 | 140 | 3 | 0.9258 | 0.934 | 0.000 | (0;000) | ✗ | 27/01/17 |
CuI | ICSD | 24772 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.9338 | 0.934 | 0.000 | (0;000) | ✗ | 06/10/16 |
PbSe | ICSD | 74334 | F2mm (42) | ✗ | 4 | 40 | 2 | 0.9339 | 0.934 | 0.000 | (0;000) | ✗ | 06/10/16 |
InBi2Se4Br | ICSD | 159465 | C2/m (12) | ✔ | 16 | 148 | 3 | 0.9314 | 0.934 | 0.000 | (0;000) | ✗ | 02/02/17 |
BiSeI | COD | 2010577 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.8997 | 0.935 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(GaTe2)2 | ICSD | 659216 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9348 | 0.935 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaTe2)2 | ICSD | 603660 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9356 | 0.936 | 0.000 | (0;000) | ✗ | 06/10/16 |
As2Ru | ICSD | 42578 | Pmnn (58) | ✔ | 6 | 52 | 3 | 0.2439 | 0.936 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ga2HgSe4 | ICSD | 290394 | I-4 (82) | ✗ | 7 | 62 | 3 | 0.9364 | 0.936 | 0.000 | (0;000) | ✗ | 06/10/16 |