▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
FeCl3 | ICSD | 151400 | R-3 (148) | ✔ | 8 | 58 | 2 | 0.0 | 0.026 | 0.296 | (0;000) | ✗ | 06/10/16 |
Sc6FeTe2 | ICSD | 90081 | P-62m (189) | ✗ | 9 | 86 | 3 | 0.0 | 0.000 | 0.534 | ? | ✗ | 06/10/16 |
GaCl3 | ICSD | 30336 | P-1 (2) | ✔ | 8 | 68 | 1 | 0.0 | 0.013 | 0.056 | (1;000) | ✗ | 06/10/16 |
Zn(InS2)2 | ICSD | 603024 | R3m (160) | ✗ | 7 | 62 | 2 | 0.0 | 0.021 | 0.068 | (1;000) | ✔ | 06/10/16 |
NiPRh | ICSD | 646131 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.349 | ? | ✗ | 06/10/16 |
TiMnO3 | ICSD | 184650 | R3c (161) | ✗ | 10 | 90 | 3 | 0.0 | 0.000 | 0.795 | ? | ✗ | 06/10/16 |
InAs | ICSD | 165462 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.009 | (1;000) | ✔ | 06/10/16 |
CaSb2 | ICSD | 862 | P2_1/m (11) | ✔ | 6 | 40 | 1 | 0.0 | 0.070 | 0.251 | (1;011) | ✔ | 27/01/17 |
TiCl3 | ICSD | 38236 | R-3 (148) | ✔ | 8 | 66 | 2 | 0.0 | 0.009 | 0.695 | (0;000) | ✗ | 06/10/16 |
CdPt | ICSD | 102052 | P4/mmm (123) | ✔ | 2 | 22 | 3 | 0.0 | 0.008 | 0.525 | (1;110) | ✗ | 27/01/17 |
OsCl4 | ICSD | 1165 | Cmmm (65) | ✔ | 5 | 44 | 1 | 0.0 | 0.322 | 0.353 | (0;000) | ✗ | 06/10/16 |
HfSiOs | ICSD | 638753 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.790 | ? | ✗ | 06/10/16 |
MnN | ICSD | 184928 | P6_3mc (186) | ✗ | 4 | 40 | 3 | 0.0 | 0.027 | 0.121 | (0;000) | ✔ | 06/10/16 |
TaInSe2 | ICSD | 640520 | P-6m2 (187) | ✗ | 4 | 38 | 3 | 0.0 | 0.006 | 0.346 | (0;000) | ✔ | 06/10/16 |
MoCl5 | ICSD | 84620 | P-1 (2) | ✔ | 12 | 98 | 1 | 0.0 | 0.021 | 0.413 | (1;110) | ✗ | 06/10/16 |
Ge | ICSD | 636530 | I4_1/amd (141) | ✔ | 2 | 8 | 3 | 0.0 | 0.027 | 0.455 | (1;111) | ✗ | 27/01/17 |
MoC | ICSD | 183166 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.417 | (0;000) | ✔ | 06/10/16 |
ScAl | ICSD | 609299 | Pm-3m (221) | ✔ | 2 | 14 | 3 | 0.0 | 0.031 | 0.347 | (1;111) | ✗ | 05/01/17 |
YAgSb2 | ICSD | 190094 | P4/nmm (129) | ✔ | 8 | 64 | 3 | 0.0 | 0.039 | 0.354 | (1;000) | ✗ | 05/01/17 |
MnNbGe | ICSD | 42911 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.690 | ? | ✗ | 06/10/16 |
CrPS4 | ICSD | 937 | C2 (5) | ✗ | 12 | 86 | 2 | 0.0 | 0.006 | 0.359 | (0;100) | ✔ | 05/12/16 |
FeNi | COD | 9010017 | P4/mmm (123) | ✔ | 2 | 18 | 3 | 0.0 | 0.002 | 0.583 | (1;001) | ✗ | 27/01/17 |
CoSb2 | ICSD | 624899 | Pnnm (58) | ✔ | 6 | 54 | 3 | 0.0 | 0.000 | 0.933 | (0;000) | ✗ | 27/01/17 |
MoC | ICSD | 618300 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.384 | (0;100) | ✔ | 06/10/16 |
CoTe2 | ICSD | 25678 | Pmnn (58) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.783 | (0;000) | ✗ | 06/10/16 |
GaAg | COD | 1509342 | Pm-3m (221) | ✔ | 2 | 24 | 3 | 0.0 | 0.101 | 0.607 | (0;111) | ✗ | 05/01/17 |
Zr3Co | ICSD | 102741 | Cmcm (63) | ✔ | 8 | 90 | 3 | 0.0 | 0.000 | 0.848 | (1;110) | ✗ | 06/10/16 |
BaPd | ICSD | 616028 | Cmcm (63) | ✔ | 4 | 56 | 2 | 0.0 | 0.065 | 0.082 | (1;011) | ✗ | 05/01/17 |
Co2N | ICSD | 152812 | Pmnn (58) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.848 | (1;000) | ✗ | 06/10/16 |
Rb4CO4 | ICSD | 245441 | C2mm (38) | ✗ | 9 | 64 | 3 | 0.0 | 0.009 | 0.157 | (1;000) | ✔ | 06/10/16 |
CrP | ICSD | 42079 | Pmnb (62) | ✔ | 8 | 76 | 3 | 0.0 | 0.000 | 0.349 | (1;011) | ✗ | 06/10/16 |
P2W | ICSD | 37223 | Ccm2_1 (36) | ✗ | 6 | 48 | 3 | 0.0 | 0.442 | 0.255 | (1;000) | ✔ | 04/10/16 |
CrSb2 | ICSD | 246891 | Pmnn (58) | ✔ | 6 | 48 | 3 | 0.0 | 0.000 | 0.365 | (1;101) | ✗ | 06/10/16 |
O2 | ICSD | 92775 | Cmcm (63) | ✔ | 2 | 12 | 1 | 0.0 | 0.025 | 0.339 | (0;000) | ✗ | 27/01/17 |
CrTe | ICSD | 93161 | Pmnb (62) | ✔ | 8 | 80 | 3 | 0.0 | 0.004 | 0.470 | (1;000) | ✗ | 06/10/16 |
NbN | ICSD | 185442 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.0 | 0.008 | 0.291 | (1;100) | ✔ | 06/10/16 |
Cr2S3 | ICSD | 16721 | R-3 (148) | ✔ | 10 | 92 | 3 | 0.0 | 0.013 | 0.353 | (1;111) | ✗ | 06/10/16 |
MnNbGe | ICSD | 637001 | P-62m (189) | ✗ | 9 | 96 | 3 | 0.0 | 0.000 | 0.690 | ? | ✗ | 06/10/16 |
Cr2Se3 | ICSD | 106520 | R-3 (148) | ✔ | 10 | 92 | 3 | 0.0 | 0.011 | 0.356 | (1;000) | ✗ | 06/10/16 |
NbN | ICSD | 191062 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.200 | (0;100) | ✔ | 06/10/16 |
BC2N | ICSD | 191803 | C2/m (12) | ✔ | 8 | 32 | 3 | 0.0 | 0.005 | 0.202 | (0;111) | ✗ | 06/10/16 |
CuO2 | ICSD | 150913 | Ccmm (63) | ✔ | 6 | 46 | 1 | 0.0 | 0.000 | 0.927 | (0;110) | ✗ | 06/10/16 |
CuS2 | ICSD | 628782 | Pnnm (58) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.970 | (0;110) | ✗ | 27/01/17 |
OsN | ICSD | 167513 | Pmn2_1 (31) | ✗ | 4 | 42 | 3 | 0.0 | 0.000 | 0.868 | (0;001) | ✔ | 06/10/16 |
CuSe2 | ICSD | 242 | Pmnn (58) | ✔ | 6 | 46 | 3 | 0.0 | 0.000 | 0.939 | (0;000) | ✗ | 06/10/16 |
YCoC2 | ICSD | 57007 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.036 | 0.259 | (1;100) | ✔ | 06/10/16 |
YCoC2 | ICSD | 617465 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.036 | 0.259 | (1;100) | ✔ | 06/10/16 |
YCoC2 | ICSD | 617468 | C2mm (38) | ✗ | 4 | 28 | 3 | 0.0 | 0.032 | 0.257 | (0;000) | ✔ | 06/10/16 |
GeS | ICSD | 155418 | Cmcm (63) | ✔ | 4 | 20 | 3 | 0.0 | 0.012 | 0.256 | (0;000) | ✗ | 06/10/16 |
Re3N | ICSD | 188352 | P-6m2 (187) | ✗ | 4 | 50 | 3 | 0.0 | 0.000 | 0.675 | (0;100) | ✔ | 06/10/16 |
Ti5Al2C3 | ICSD | 187748 | R3m (160) | ✗ | 10 | 78 | 3 | 0.0 | 0.002 | 0.953 | ? | ✗ | 06/10/16 |
Al6C3N2 | ICSD | 14399 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.001 | 0.475 | (1;000) | ✔ | 06/10/16 |
Al6C3N2 | ICSD | 654993 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.000 | 0.475 | (0;000) | ✔ | 06/10/16 |
Zr2Al4C5 | ICSD | 173676 | R3m (160) | ✗ | 11 | 40 | 3 | 0.0 | 0.014 | 0.496 | (0;000) | ✔ | 06/10/16 |
Zr3(Al2C3)2 | ICSD | 173677 | R3m (160) | ✗ | 13 | 48 | 3 | 0.0 | 0.010 | 0.526 | ? | ✗ | 06/10/16 |
ZrCu2 | ICSD | 191405 | Cmcm (63) | ✔ | 6 | 68 | 3 | 0.0 | 0.010 | 0.168 | (1;000) | ✗ | 06/10/16 |
Cu3Ge | ICSD | 86003 | Pnmm (59) | ✔ | 8 | 74 | 3 | 0.0 | 0.000 | 0.913 | (1;000) | ✗ | 06/10/16 |
ZnSnSb2 | ICSD | 42669 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.007 | 0.020 | (1;000) | ✔ | 07/10/16 |
CaCdSn | ICSD | 58878 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.039 | 0.239 | (1;000) | ✔ | 05/12/16 |
Ca(GePt)2 | ICSD | 619327 | P2_1 (4) | ✗ | 10 | 76 | 3 | 0.0 | 0.126 | 0.862 | (0;000) | ✔ | 05/12/16 |
CaSnHg | ICSD | 602726 | P6_3mc (186) | ✗ | 6 | 72 | 3 | 0.0 | 0.049 | 0.221 | (0;000) | ✔ | 28/10/16 |
CaIrO3 | ICSD | 159030 | Cmc2_1 (36) | ✗ | 10 | 90 | 2 | 0.0 | 0.000 | 0.405 | (1;001) | ✔ | 05/12/16 |
CaIrO3 | ICSD | 159031 | Cmc2_1 (36) | ✗ | 10 | 74 | 2 | 0.0 | 0.000 | 0.393 | ? | ✗ | 06/10/16 |
CaIrO3 | ICSD | 159032 | Cmc2_1 (36) | ✗ | 10 | 74 | 2 | 0.0 | 0.000 | 0.318 | ? | ✗ | 06/10/16 |
CaMoO | ICSD | 187218 | P1 (1) | ✗ | 12 | 120 | 1 | 0.0 | 0.008 | 0.783 | (1;000) | ✔ | 05/12/16 |
CaPdPb | ICSD | 106355 | P-62m (189) | ✗ | 9 | 126 | 3 | 0.0 | 0.000 | 0.592 | (1;100) | ✔ | 05/12/16 |
CaSiPt | ICSD | 72640 | P2_13 (198) | ✗ | 12 | 96 | 3 | 0.0 | 0.000 | 0.533 | (0;000) | ✔ | 05/12/16 |
CaZnSn | ICSD | 106358 | P6_3mc (186) | ✗ | 6 | 72 | 3 | 0.0 | 0.030 | 0.241 | (0;000) | ✔ | 06/10/16 |
CsN | ICSD | 29106 | Pm-3m (221) | ✔ | 2 | 14 | 1 | 0.0 | 0.000 | 0.697 | (0;000) | ✗ | 27/01/17 |
Zn3CrSe4 | ICSD | 186188 | P-43m (215) | ✗ | 8 | 74 | 3 | 0.0 | 0.045 | 0.111 | (0;000) | ✔ | 06/10/16 |
Ca3(GaNi)4 | ICSD | 58899 | I-43m (217) | ✗ | 11 | 122 | 3 | 0.0 | 0.000 | 0.663 | ? | ✗ | 06/10/16 |
TlN | ICSD | 184575 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.012 | 0.003 | (1;000) | ✔ | 06/10/16 |
Ca3(SiIr)4 | ICSD | 95788 | I-43m (217) | ✗ | 11 | 82 | 3 | 0.0 | 0.000 | 0.576 | ? | ✗ | 06/10/16 |
Cr3CdTe4 | ICSD | 181055 | P-43m (215) | ✗ | 8 | 78 | 3 | 0.0 | 0.000 | 0.425 | ? | ✗ | 06/10/16 |
NiF2 | ICSD | 34307 | Pmnn (58) | ✔ | 6 | 48 | 3 | 0.0 | 0.017 | 0.293 | (0;000) | ✗ | 06/10/16 |
Sr(AgGe)2 | COD | 7209368 | I4/mmm (139) | ✔ | 5 | 40 | 3 | 0.0 | 0.004 | 0.758 | (1;000) | ✗ | 05/01/17 |
NiAs | ICSD | 655881 | Ccm2_1 (36) | ✗ | 4 | 30 | 3 | 0.0 | 0.000 | 0.753 | (0;110) | ✔ | 06/10/16 |
Li2ReO3 | ICSD | 200999 | R3c (161) | ✗ | 12 | 78 | 3 | 0.0 | 0.001 | 0.327 | (0;111) | ✔ | 05/12/16 |
CrCd3Te4 | ICSD | 181053 | P-43m (215) | ✗ | 8 | 74 | 3 | 0.0 | 0.032 | 0.067 | (0;000) | ✔ | 06/10/16 |
NiF3 | ICSD | 87943 | R-3 (148) | ✔ | 8 | 62 | 3 | 0.0 | 0.000 | 0.663 | (0;000) | ✗ | 27/01/17 |
VN | ICSD | 191061 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.163 | (1;100) | ✔ | 06/10/16 |
SbPdSe | ICSD | 93905 | P2_13 (198) | ✗ | 12 | 84 | 3 | 0.0 | 0.000 | 0.599 | ? | ✗ | 06/10/16 |
FeO | ICSD | 82236 | R-3m (166) | ✔ | 2 | 14 | 3 | 0.0 | 0.086 | 0.246 | (0;000) | ✗ | 06/10/16 |
LiNiN | ICSD | 247028 | P-6m2 (187) | ✗ | 3 | 18 | 3 | 0.0 | 0.000 | 0.971 | (1;100) | ✔ | 06/10/16 |
VN | ICSD | 236783 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.388 | (1;000) | ✔ | 06/10/16 |
NaSi2Pd3 | ICSD | 41686 | I2mm (44) | ✗ | 12 | 94 | 3 | 0.0 | 0.005 | 0.525 | ? | ✗ | 06/10/16 |
OsC | ICSD | 185996 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.341 | 0.015 | (0;000) | ✔ | 06/10/16 |
ScMnSi | ICSD | 86369 | P-62m (189) | ✗ | 9 | 90 | 3 | 0.0 | 0.000 | 0.732 | ? | ✗ | 06/10/16 |
HfAg | ICSD | 605330 | P4/nmm (129) | ✔ | 4 | 46 | 3 | 0.0 | 0.000 | 0.851 | (1;001) | ✗ | 05/01/17 |
BePd2 | ICSD | 107609 | I4/mmm (139) | ✔ | 3 | 40 | 3 | 0.0 | 0.020 | 0.675 | (0;000) | ✗ | 05/01/17 |
TaAs | ICSD | 44068 | I4_1md (109) | ✗ | 4 | 36 | 3 | 0.0 | 0.041 | 0.008 | (1;001) | ✔ | 06/10/16 |
MoSeS | ICSD | 191307 | P-6m2 (187) | ✗ | 6 | 52 | 2 | 0.0 | 0.046 | 0.697 | (0;000) | ✔ | 06/10/16 |
FeSe | ICSD | 182545 | Cmme (67) | ✔ | 4 | 28 | 2 | 0.0 | 0.020 | 0.084 | (0;000) | ✗ | 06/10/16 |
Y(GePt)2 | ICSD | 637662 | P2_1 (4) | ✗ | 10 | 78 | 3 | 0.0 | 0.000 | 0.977 | ? | ✗ | 06/10/16 |
NO | ICSD | 27871 | P2_1/c (14) | ✔ | 8 | 44 | 1 | 0.0 | 0.002 | 0.048 | (0;010) | ✔ | 27/01/17 |
InCuSe2 | ICSD | 154405 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.018 | 0.011 | (1;000) | ✔ | 07/10/16 |
TlCuSe2 | ICSD | 28743 | I-42d (122) | ✗ | 8 | 72 | 3 | 0.0 | 0.014 | 0.004 | (1;000) | ✔ | 07/10/16 |
LiIO3 | ICSD | 20012 | P6_322 (182) | ✗ | 10 | 56 | 3 | 0.0 | 0.562 | 0.201 | (0;000) | ✔ | 06/10/16 |
FeTe2 | ICSD | 86518 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.0 | 0.691 | 0.013 | (0;000) | ✗ | 06/10/16 |
KTeAu | COD | 1510208 | P6_3/mmc (194) | ✔ | 6 | 52 | 2 | 0.0 | 0.002 | 0.029 | (1;000) | ✗ | 05/01/17 |