▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
K2Sn(AuS2)2 | ICSD | 74022 | P-1 (2) | ✔ | 18 | 156 | 1 | 1.7411 | 1.955 | 0.000 | (0;000) | ✗ | 30/01/17 |
ZnCd3S4 | ICSD | 168374 | P-43m (215) | ✗ | 8 | 72 | 3 | 1.2943 | 1.294 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sc2SnAu2 | ICSD | 130046 | P4/mbm (127) | ✔ | 10 | 116 | 3 | 0.0 | 0.005 | 0.892 | (0;001) | ✗ | 30/01/17 |
Sr(SnAu)2 | ICSD | 427711 | P4/nmm (129) | ✔ | 10 | 120 | 3 | 0.0 | 0.020 | 0.869 | (1;000) | ✗ | 30/01/17 |
ScB2Ir3 | ICSD | 614561 | Cmmm (65) | ✔ | 6 | 68 | 3 | 0.0 | 0.011 | 0.364 | (1;001) | ✗ | 05/01/17 |
SF6 | ICSD | 214 | Im-3m (229) | ✔ | 7 | 48 | 1 | 8.4913 | 8.491 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnCd3S4 | ICSD | 169187 | P-43m (215) | ✗ | 8 | 72 | 3 | 1.364 | 1.364 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr(InAu)3 | ICSD | 245679 | Pmmn (59) | ✔ | 14 | 164 | 3 | 0.0 | 0.014 | 0.721 | (1;000) | ✗ | 30/01/17 |
Li2B2Rh3 | ICSD | 417442 | Pbam (55) | ✔ | 14 | 126 | 3 | 0.0 | 0.000 | 0.971 | (1;111) | ✗ | 05/01/17 |
Na2LiAu3 | ICSD | 152090 | P6_3/mmc (194) | ✔ | 12 | 108 | 3 | 0.0 | 0.029 | 0.398 | (1;000) | ✗ | 30/01/17 |
ZnCd3Se4 | ICSD | 188386 | P-43m (215) | ✗ | 8 | 72 | 3 | 0.425 | 0.425 | 0.000 | (0;000) | ✔ | 06/10/16 |
MgSn(BO3)2 | ICSD | 28266 | R-3 (148) | ✔ | 10 | 66 | 3 | 2.8625 | 2.973 | 0.000 | (0;000) | ✗ | 05/01/17 |
Ca3Au4 | ICSD | 54547 | R-3 (148) | ✔ | 14 | 148 | 3 | 0.0 | 0.001 | 0.290 | (1;000) | ✗ | 30/01/17 |
VN | ICSD | 236783 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.388 | (1;000) | ✔ | 06/10/16 |
FeO | ICSD | 82236 | R-3m (166) | ✔ | 2 | 14 | 3 | 0.0 | 0.086 | 0.246 | (0;000) | ✗ | 06/10/16 |
NaCdF3 | ICSD | 163866 | R3c (161) | ✗ | 10 | 84 | 3 | 3.4133 | 3.413 | 0.000 | (0;000) | ✗ | 06/10/16 |
Mn(BMo)2 | ICSD | 614755 | P4/mbm (127) | ✔ | 10 | 98 | 3 | 0.0 | 0.000 | 0.903 | (0;001) | ✗ | 05/01/17 |
NaCdF3 | ICSD | 163867 | R3c (161) | ✗ | 10 | 84 | 3 | 3.449 | 3.449 | 0.000 | (0;000) | ✗ | 06/10/16 |
Nb(BMo)2 | ICSD | 614821 | P4/mbm (127) | ✔ | 10 | 94 | 3 | 0.0 | 0.000 | 0.918 | (0;110) | ✗ | 05/01/17 |
K2BiAu | ICSD | 380341 | Cmcm (63) | ✔ | 8 | 88 | 1 | 0.8724 | 1.008 | 0.000 | (0;000) | ✗ | 30/01/17 |
FeP2 | ICSD | 15027 | Pmnn (58) | ✔ | 6 | 36 | 3 | 0.4006 | 0.861 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaS2)2 | ICSD | 106362 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.0324 | 2.034 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ta(BMo)2 | ICSD | 614842 | P4/mbm (127) | ✔ | 10 | 94 | 3 | 0.0 | 0.000 | 0.874 | (1;111) | ✗ | 05/01/17 |
B2Mo3 | ICSD | 614800 | P4/mbm (127) | ✔ | 10 | 96 | 3 | 0.0 | 0.006 | 0.688 | (0;001) | ✗ | 05/01/17 |
Cd(GaS2)2 | ICSD | 184995 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.0642 | 2.066 | 0.000 | (0;000) | ✗ | 06/10/16 |
B2Mo | ICSD | 167732 | R-3m (166) | ✔ | 6 | 40 | 3 | 0.0 | 0.020 | 0.604 | (0;111) | ✗ | 05/01/17 |
CaCdAu | ICSD | 420574 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.008 | 0.781 | (0;011) | ✗ | 30/01/17 |
Nb3B2 | ICSD | 614907 | P4/mbm (127) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.784 | (1;111) | ✗ | 05/01/17 |
TaAs | ICSD | 44068 | I4_1md (109) | ✗ | 4 | 36 | 3 | 0.0 | 0.041 | 0.008 | (1;001) | ✔ | 06/10/16 |
CsCdAuS2 | ICSD | 85581 | Cmme (67) | ✔ | 10 | 88 | 2 | 2.1236 | 2.236 | 0.000 | (0;000) | ✗ | 30/01/17 |
SrCdAu | ICSD | 426612 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.008 | 0.779 | (0;011) | ✗ | 30/01/17 |
OsC | ICSD | 185996 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.341 | 0.015 | (0;000) | ✔ | 06/10/16 |
YN | ICSD | 161077 | F-43m (216) | ✗ | 2 | 16 | 3 | 2.1509 | 2.167 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsAuCl4 | ICSD | 423233 | C2/c (15) | ✔ | 12 | 96 | 1 | 1.8939 | 1.944 | 0.000 | (0;000) | ✗ | 30/01/17 |
FeS2 | ICSD | 15012 | Pa3 (205) | ✔ | 12 | 80 | 3 | 0.5231 | 0.568 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaS2)2 | ICSD | 2286 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.628 | 1.628 | 0.000 | (0;000) | ✗ | 06/10/16 |
NbNiB2 | ICSD | 614910 | Pnma (62) | ✔ | 16 | 116 | 3 | 0.0 | 0.001 | 0.470 | (0;011) | ✗ | 05/01/17 |
Y(NiB)2 | ICSD | 615079 | C2/c (15) | ✔ | 10 | 74 | 3 | 0.0 | 0.000 | 0.617 | (1;011) | ✗ | 05/01/17 |
Cd(GaS2)2 | ICSD | 25642 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.1289 | 2.129 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeS2 | ICSD | 42415 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.8069 | 1.148 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaS2)2 | ICSD | 31354 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.0248 | 2.027 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrSn(BO3)2 | ICSD | 28267 | R-3 (148) | ✔ | 10 | 66 | 2 | 2.234 | 2.378 | 0.000 | (0;000) | ✗ | 05/01/17 |
BePd2 | ICSD | 107609 | I4/mmm (139) | ✔ | 3 | 40 | 3 | 0.0 | 0.020 | 0.675 | (0;000) | ✗ | 05/01/17 |
YB2Os | ICSD | 615149 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.000 | 0.268 | (1;011) | ✗ | 05/01/17 |
YN | ICSD | 161078 | P6_3mc (186) | ✗ | 4 | 32 | 3 | 2.4206 | 2.723 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeSb2 | ICSD | 151397 | Pmnn (58) | ✔ | 6 | 36 | 3 | 0.1637 | 0.361 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZnI2 | ICSD | 48016 | P6/mmm (191) | ✔ | 3 | 26 | 3 | 0.0 | 0.089 | 0.339 | (0;000) | ✗ | 30/01/17 |
Cd(GaS2)2 | ICSD | 52801 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2641 | 2.264 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaS2)2 | ICSD | 619872 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.2052 | 1.205 | 0.000 | (0;000) | ✗ | 06/10/16 |
YB2Rh3 | ICSD | 615340 | Cmmm (65) | ✔ | 6 | 68 | 3 | 0.0 | 0.013 | 0.452 | (0;000) | ✗ | 05/01/17 |
K3IO | ICSD | 36512 | Pm-3m (221) | ✔ | 5 | 40 | 1 | 1.1333 | 1.133 | 0.000 | (0;000) | ✗ | 30/01/17 |
KI | ICSD | 61661 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 3.6931 | 3.693 | 0.000 | (0;000) | ✗ | 30/01/17 |
FeSe | ICSD | 182545 | Cmme (67) | ✔ | 4 | 28 | 2 | 0.0 | 0.020 | 0.084 | (0;000) | ✗ | 06/10/16 |
KI | ICSD | 61661 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 3.6931 | 3.693 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cd(GaS2)2 | ICSD | 619873 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.337 | 2.338 | 0.000 | (0;000) | ✗ | 06/10/16 |
LiI | ICSD | 44781 | P6_3/mmc (194) | ✔ | 4 | 20 | 1 | 3.3576 | 3.358 | 0.000 | (0;000) | ✗ | 30/01/17 |
YB2Ru | ICSD | 615399 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.000 | 0.441 | (1;011) | ✗ | 05/01/17 |
Cd(GaS2)2 | ICSD | 619875 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.0132 | 2.015 | 0.000 | (0;000) | ✗ | 06/10/16 |
ScB2 | ICSD | 106903 | Fd-3m (227) | ✔ | 6 | 34 | 3 | 0.0 | 0.000 | 0.545 | (0;000) | ✗ | 05/01/17 |
Ta3B2 | ICSD | 615504 | P4/mbm (127) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.888 | (0;000) | ✗ | 05/01/17 |
NaPb2IO6 | ICSD | 427115 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.155 | (0;000) | ✗ | 30/01/17 |
PdC | ICSD | 183174 | F-43m (216) | ✗ | 2 | 14 | 3 | 0.0 | 0.000 | 0.717 | (1;000) | ✔ | 06/10/16 |
NO | ICSD | 27871 | P2_1/c (14) | ✔ | 8 | 44 | 1 | 0.0 | 0.002 | 0.048 | (0;010) | ✔ | 27/01/17 |
FeSe2 | ICSD | 25680 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.2853 | 0.828 | 0.000 | (0;000) | ✗ | 06/10/16 |
ScCo3C | ICSD | 76793 | Pm-3m (221) | ✔ | 5 | 66 | 3 | 0.0 | 0.000 | 0.214 | (0;111) | ✗ | 27/01/17 |
Cd(GaS2)2 | ICSD | 619878 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2573 | 2.260 | 0.000 | (0;000) | ✗ | 06/10/16 |
InPd3 | ICSD | 247188 | I4/mmm (139) | ✔ | 8 | 134 | 3 | 0.0 | 0.039 | 0.307 | (1;000) | ✗ | 30/01/17 |
TcB2 | ICSD | 615553 | P6_3/mmc (194) | ✔ | 6 | 42 | 3 | 0.0 | 0.000 | 0.686 | (1;000) | ✗ | 05/01/17 |
Cd(GaSe2)2 | ICSD | 163949 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.251 | 1.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
ZrIN | ICSD | 190381 | R-3m (166) | ✔ | 6 | 32 | 2 | 0.4372 | 1.429 | 0.000 | (0;000) | ✗ | 30/01/17 |
ZrIN | ICSD | 36119 | Pmmn (59) | ✔ | 6 | 32 | 2 | 1.1231 | 1.123 | 0.000 | (0;000) | ✗ | 30/01/17 |
LiCa4(BN2)3 | ICSD | 400339 | Im-3m (229) | ✔ | 14 | 82 | 1 | 2.2339 | 3.025 | 0.000 | (0;000) | ✗ | 05/01/17 |
Co(BMo)3 | ICSD | 613173 | Cmcm (63) | ✔ | 14 | 136 | 3 | 0.0 | 0.020 | 0.443 | (0;110) | ✗ | 05/01/17 |
GeS | ICSD | 637785 | Pmnb (62) | ✔ | 8 | 40 | 2 | 0.8942 | 1.214 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cd(GaSe2)2 | ICSD | 184996 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.3585 | 1.359 | 0.000 | (0;000) | ✗ | 06/10/16 |
TlI | ICSD | 60491 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 1.5987 | 1.599 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cd(GaSe2)2 | ICSD | 2287 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.0358 | 1.036 | 0.000 | (0;000) | ✗ | 06/10/16 |
K(BH)3 | ICSD | 65507 | Fm-3m (225) | ✔ | 14 | 42 | 2 | 4.9336 | 4.934 | 0.000 | (0;000) | ✗ | 05/01/17 |
CsAuF4 | ICSD | 152056 | Immm (71) | ✔ | 12 | 96 | 2 | 2.2813 | 2.467 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ni(BMo)3 | ICSD | 614824 | Cmcm (63) | ✔ | 14 | 122 | 3 | 0.0 | 0.000 | 0.750 | (0;110) | ✗ | 05/01/17 |
NO2 | ICSD | 164631 | P2_1/m (11) | ✔ | 12 | 68 | 1 | 1.4082 | 1.460 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeTe2 | ICSD | 86518 | Pmnn (58) | ✔ | 6 | 40 | 3 | 0.0 | 0.691 | 0.013 | (0;000) | ✗ | 06/10/16 |
Cd(GaSe2)2 | ICSD | 25644 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.3929 | 1.393 | 0.000 | (0;000) | ✗ | 06/10/16 |
Nb2B3 | ICSD | 656213 | Cmcm (63) | ✔ | 10 | 70 | 3 | 0.0 | 0.000 | 0.900 | (0;000) | ✗ | 05/01/17 |
Ni4B3 | ICSD | 150561 | C2/c (15) | ✔ | 14 | 98 | 3 | 0.0 | 0.000 | 0.801 | (0;100) | ✗ | 05/01/17 |
Cd(GaSe2)2 | ICSD | 30908 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.445 | 1.445 | 0.000 | (0;000) | ✗ | 06/10/16 |
B3Os2 | ICSD | 424879 | P6_3/mmc (194) | ✔ | 10 | 82 | 3 | 0.0 | 0.000 | 0.992 | (1;000) | ✗ | 05/01/17 |
Zr3Fe | ICSD | 106700 | Cmcm (63) | ✔ | 8 | 88 | 3 | 0.0 | 0.009 | 0.702 | (1;000) | ✗ | 06/10/16 |
Cd(GaSe2)2 | ICSD | 52802 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.4403 | 1.440 | 0.000 | (0;000) | ✗ | 06/10/16 |
K5Au(IO)2 | ICSD | 40376 | Pbam (55) | ✔ | 20 | 164 | 1 | 1.9228 | 1.959 | 0.000 | (0;000) | ✗ | 02/02/17 |
ReB3 | ICSD | 24361 | P6_3/mmc (194) | ✔ | 8 | 48 | 3 | 0.0 | 0.012 | 0.698 | (1;000) | ✗ | 05/01/17 |
B3Ru2 | ICSD | 108082 | P6_3/mmc (194) | ✔ | 10 | 82 | 3 | 0.0 | 0.000 | 0.896 | (0;000) | ✗ | 05/01/17 |
Cd(GaSe2)2 | ICSD | 619889 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.6245 | 1.625 | 0.000 | (0;000) | ✗ | 06/10/16 |
SrInAu | ICSD | 391422 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.069 | 0.359 | (1;000) | ✗ | 02/02/17 |
TiS | ICSD | 52193 | P-6m2 (187) | ✗ | 2 | 18 | 3 | 0.0 | 0.000 | 0.159 | (1;100) | ✔ | 04/10/16 |
CdAs2 | ICSD | 16037 | I4_122 (98) | ✗ | 6 | 44 | 3 | 0.2887 | 0.909 | 0.000 | (0;000) | ✔ | 06/10/16 |
PtC | ICSD | 169405 | P-6m2 (187) | ✗ | 2 | 14 | 3 | 0.0 | 0.012 | 0.443 | (1;000) | ✔ | 06/10/16 |
NO2 | ICSD | 28331 | P2_1/c (14) | ✔ | 12 | 68 | 1 | 2.5717 | 2.624 | 0.000 | (0;000) | ✗ | 27/01/17 |
K2PAuS4 | ICSD | 85679 | P2_1/m (11) | ✔ | 16 | 116 | 2 | 1.308 | 1.308 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbI | ICSD | 61523 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 3.0742 | 3.078 | 0.000 | (0;000) | ✗ | 30/01/17 |