▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ba4NaAuO8 | COD | 2002622 | I4/mmm (139) | ✔ | 14 | 108 | 1 | 0.863 | 0.981 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaAu | COD | 1510584 | Pnma (62) | ✔ | 8 | 84 | 3 | 0.0 | 0.005 | 0.453 | (1;011) | ✗ | 30/01/17 |
K2BiAu | ICSD | 380341 | Cmcm (63) | ✔ | 8 | 88 | 1 | 0.8724 | 1.008 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsAuBr3 | COD | 2206091 | I4/mmm (139) | ✔ | 10 | 82 | 3 | 0.8304 | 0.848 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbAuBr3 | COD | 1510367 | C2/m (12) | ✔ | 10 | 82 | 1 | 0.7922 | 0.849 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbAuBr4 | COD | 8103439 | P2_1/c (14) | ✔ | 12 | 96 | 1 | 1.5384 | 1.564 | 0.000 | (0;000) | ✗ | 30/01/17 |
TeAuBr8 | COD | 7209429 | P-1 (2) | ✔ | 20 | 146 | 2 | 1.0117 | 1.035 | 0.000 | (0;000) | ✗ | 30/01/17 |
AuBr | COD | 1510609 | I4_1/amd (141) | ✔ | 8 | 72 | 3 | 1.431 | 1.431 | 0.000 | (0;000) | ✗ | 30/01/17 |
AuBr | COD | 1510610 | P4_2/ncm (138) | ✔ | 8 | 72 | 2 | 1.7201 | 1.721 | 0.000 | (0;000) | ✗ | 30/01/17 |
CaCdAu | ICSD | 420574 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.008 | 0.781 | (0;011) | ✗ | 30/01/17 |
CaGaAu | COD | 1510615 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.039 | 0.506 | (1;000) | ✗ | 30/01/17 |
CaInAu | COD | 1510059 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.047 | 0.535 | (1;000) | ✗ | 30/01/17 |
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 |
AuCl2 | COD | 4027825 | P-1 (2) | ✔ | 12 | 100 | 1 | 0.7863 | 1.209 | 0.000 | (0;000) | ✗ | 30/01/17 |
AuCl3 | COD | 2310075 | P2_1/c (14) | ✔ | 16 | 128 | 1 | 1.314 | 1.408 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsAuCl4 | ICSD | 423233 | C2/c (15) | ✔ | 12 | 96 | 1 | 1.8939 | 1.944 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbAuCl4 | COD | 8103425 | C2/c (15) | ✔ | 12 | 96 | 1 | 2.0009 | 2.007 | 0.000 | (0;000) | ✗ | 30/01/17 |
TlAuCl4 | COD | 2018865 | C2/c (15) | ✔ | 12 | 104 | 1 | 1.7994 | 1.820 | 0.000 | (0;000) | ✗ | 30/01/17 |
TeAuCl7 | COD | 7209382 | P-1 (2) | ✔ | 18 | 132 | 1 | 1.6215 | 1.787 | 0.000 | (0;000) | ✗ | 30/01/17 |
AuClO | COD | 2105387 | R-3 (148) | ✔ | 18 | 144 | 3 | 1.1439 | 1.248 | 0.000 | (0;000) | ✗ | 30/01/17 |
Te2AuCl | COD | 1510090 | Cmcm (63) | ✔ | 8 | 60 | 2 | 0.0 | 0.013 | 0.259 | (1;110) | ✗ | 30/01/17 |
Cs3AuO | COD | 1510109 | P6_3/mmc (194) | ✔ | 10 | 88 | 1 | 1.5275 | 1.528 | 0.000 | (0;000) | ✗ | 30/01/17 |
BaIF | COD | 9011175 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 3.635 | 3.635 | 0.000 | (0;000) | ✗ | 30/01/17 |
MgI2 | COD | 9009108 | P-3m1 (164) | ✔ | 3 | 24 | 2 | 3.1114 | 3.286 | 0.000 | (0;000) | ✗ | 30/01/17 |
Na4I2O | COD | 9007749 | I4/mmm (139) | ✔ | 7 | 56 | 1 | 2.299 | 2.299 | 0.000 | (0;000) | ✗ | 30/01/17 |
NiI2 | COD | 9009133 | R-3m (166) | ✔ | 3 | 24 | 2 | 0.0 | 0.071 | 0.554 | (0;000) | ✗ | 30/01/17 |
PbI2 | COD | 1011333 | P-3m1 (164) | ✔ | 3 | 28 | 2 | 1.1015 | 2.099 | 0.000 | (0;000) | ✗ | 30/01/17 |
PbI2 | COD | 9009142 | R-3m (166) | ✔ | 3 | 28 | 2 | 1.436 | 1.436 | 0.000 | (0;000) | ✗ | 30/01/17 |
ZnI2 | ICSD | 48016 | P6/mmm (191) | ✔ | 3 | 26 | 3 | 0.0 | 0.089 | 0.339 | (0;000) | ✗ | 30/01/17 |
ZnI2 | COD | 9009122 | P-3m1 (164) | ✔ | 3 | 26 | 2 | 1.4754 | 1.561 | 0.000 | (0;000) | ✗ | 30/01/17 |
ZnI2 | COD | 9009137 | R-3m (166) | ✔ | 3 | 26 | 2 | 1.1064 | 1.334 | 0.000 | (0;000) | ✗ | 30/01/17 |
InI | COD | 9008983 | Cmcm (63) | ✔ | 4 | 40 | 3 | 1.1696 | 1.170 | 0.000 | (0;000) | ✗ | 30/01/17 |
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 |
KI | COD | 9009735 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.6596 | 3.660 | 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 |
LiI | COD | 9008669 | Fm-3m (225) | ✔ | 2 | 10 | 1 | 3.9399 | 3.940 | 0.000 | (0;000) | ✗ | 30/01/17 |
LiI | ICSD | 44781 | P6_3/mmc (194) | ✔ | 4 | 20 | 1 | 3.3576 | 3.358 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaIO2 | COD | 1010624 | I4_1/amd (141) | ✔ | 8 | 56 | 3 | 0.0 | 0.021 | 0.110 | (1;111) | ✗ | 30/01/17 |
NaIO3 | COD | 9016104 | Cmmm (65) | ✔ | 5 | 34 | 3 | 0.0 | 0.018 | 0.496 | (0;111) | ✗ | 30/01/17 |
NaIO4 | COD | 1010016 | I4_1/a (88) | ✔ | 12 | 80 | 3 | 0.0 | 0.014 | 0.493 | (1;111) | ✗ | 30/01/17 |
NaIO4 | COD | 2106357 | I4_1/a (88) | ✔ | 12 | 80 | 1 | 2.3682 | 2.392 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaPb2IO6 | ICSD | 427115 | Fm-3m (225) | ✔ | 10 | 80 | 3 | 0.0 | 0.000 | 0.155 | (0;000) | ✗ | 30/01/17 |
NaI | COD | 9008681 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.3039 | 3.304 | 0.000 | (0;000) | ✗ | 30/01/17 |
NaI | COD | 9015919 | I4_1/amd (141) | ✔ | 4 | 32 | 1 | 1.0237 | 1.101 | 0.000 | (0;000) | ✗ | 30/01/17 |
IN | COD | 9014835 | Fm-3m (225) | ✔ | 2 | 12 | 1 | 0.0 | 0.034 | 0.639 | (0;000) | ✗ | 30/01/17 |
IN | COD | 9015547 | Pm-3m (221) | ✔ | 2 | 12 | 1 | 0.0 | 0.005 | 0.477 | (1;111) | ✗ | 30/01/17 |
InPd3 | ICSD | 247188 | I4/mmm (139) | ✔ | 8 | 134 | 3 | 0.0 | 0.039 | 0.307 | (1;000) | ✗ | 30/01/17 |
Sr2IN | COD | 1528373 | R-3m (166) | ✔ | 4 | 32 | 2 | 0.0 | 0.003 | 0.437 | (1;000) | ✗ | 30/01/17 |
Sr2IN | COD | 2215222 | R-3m (166) | ✔ | 4 | 32 | 1 | 1.861 | 1.861 | 0.000 | (0;000) | ✗ | 30/01/17 |
TiIN | ICSD | 27394 | Pmmn (59) | ✔ | 6 | 48 | 2 | 0.0301 | 0.030 | 0.000 | (0;000) | ✗ | 30/01/17 |
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 |
I | COD | 1010091 | Cmce (64) | ✔ | 4 | 28 | 1 | 0.9685 | 1.149 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbIO3 | COD | 5910051 | Pm-3m (221) | ✔ | 5 | 34 | 3 | 0.0 | 0.017 | 0.103 | (1;111) | ✗ | 30/01/17 |
I | COD | 1512512 | Cmce (64) | ✔ | 4 | 28 | 1 | 0.7424 | 0.768 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbI | ICSD | 61523 | Pm-3m (221) | ✔ | 2 | 16 | 1 | 3.0742 | 3.078 | 0.000 | (0;000) | ✗ | 30/01/17 |
RbI | COD | 9009738 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 3.5916 | 3.592 | 0.000 | (0;000) | ✗ | 30/01/17 |
TlI | ICSD | 60491 | Fm-3m (225) | ✔ | 2 | 20 | 3 | 1.5987 | 1.599 | 0.000 | (0;000) | ✗ | 30/01/17 |
TlI | COD | 9008795 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 0.7515 | 1.593 | 0.000 | (0;000) | ✗ | 30/01/17 |
TlI | COD | 9008981 | Cmcm (63) | ✔ | 4 | 40 | 2 | 1.4934 | 1.671 | 0.000 | (0;000) | ✗ | 30/01/17 |
CsAuF4 | ICSD | 152056 | Immm (71) | ✔ | 12 | 96 | 2 | 2.2813 | 2.467 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsAuI3 | COD | 2006239 | I4/mmm (139) | ✔ | 10 | 82 | 3 | 0.7154 | 0.730 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsAuO | COD | 1510102 | I4/mmm (139) | ✔ | 12 | 104 | 2 | 1.8084 | 1.808 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsAuSe3 | COD | 1510105 | C2/c (15) | ✔ | 10 | 76 | 2 | 1.1162 | 1.357 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsAuSe | COD | 1510104 | Cmcm (63) | ✔ | 6 | 52 | 1 | 1.5866 | 1.850 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsTeAu | COD | 1510107 | Pmma (51) | ✔ | 6 | 52 | 2 | 1.0182 | 1.018 | 0.000 | (0;000) | ✗ | 02/02/17 |
CuAuSe4 | COD | 4331413 | P2_1/m (11) | ✔ | 12 | 92 | 3 | 0.0 | 0.639 | 0.074 | (0;000) | ✗ | 02/02/17 |
KAuF4 | COD | 1510138 | I4/mcm (140) | ✔ | 12 | 96 | 1 | 2.2533 | 2.253 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbAuF4 | COD | 1510144 | I4/mcm (140) | ✔ | 12 | 96 | 1 | 1.9704 | 1.977 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3Ge4Au | COD | 1510174 | Pmmn (59) | ✔ | 16 | 108 | 1 | 0.709 | 0.813 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb3Ge4Au | COD | 1510175 | Pmmn (59) | ✔ | 16 | 108 | 3 | 0.8011 | 0.975 | 0.000 | (0;000) | ✗ | 02/02/17 |
K5Au(IO)2 | ICSD | 40376 | Pbam (55) | ✔ | 20 | 164 | 1 | 1.9228 | 1.959 | 0.000 | (0;000) | ✗ | 02/02/17 |
KAuI3 | COD | 7209388 | P2_1/c (14) | ✔ | 20 | 164 | 2 | 0.6758 | 0.676 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbAuI3 | COD | 2206809 | C2/m (12) | ✔ | 10 | 82 | 1 | 0.64 | 0.778 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiAuI4 | COD | 1510187 | P2_1/c (14) | ✔ | 12 | 84 | 1 | 0.4995 | 0.624 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrInAu | ICSD | 391422 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.069 | 0.359 | (1;000) | ✗ | 02/02/17 |
AuI | COD | 9008986 | P4_2/ncm (138) | ✔ | 8 | 72 | 2 | 1.3722 | 1.708 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te2AuI | COD | 1510184 | Pmma (51) | ✔ | 8 | 60 | 3 | 0.0 | 0.059 | 0.239 | (1;010) | ✗ | 02/02/17 |
TeAuI | COD | 1510182 | P2_1/c (14) | ✔ | 12 | 96 | 2 | 0.8628 | 1.046 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2PAu | COD | 1008465 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.8255 | 0.826 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2PAuS4 | ICSD | 85679 | P2_1/m (11) | ✔ | 16 | 116 | 2 | 1.308 | 1.308 | 0.000 | (0;000) | ✗ | 02/02/17 |
K2SbAu | ICSD | 380340 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.863 | 0.965 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3AuSe2 | COD | 8103427 | R-3c (167) | ✔ | 12 | 100 | 1 | 2.0665 | 2.145 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3Sn4Au | ICSD | 107444 | Pmmn (59) | ✔ | 16 | 188 | 1 | 0.0 | 0.012 | 0.223 | (1;000) | ✗ | 02/02/17 |
K5P2Au | COD | 1008880 | P6_3/mmc (194) | ✔ | 16 | 132 | 1 | 0.5298 | 0.532 | 0.000 | (0;000) | ✗ | 02/02/17 |
KNa2AuO2 | ICSD | 61226 | Pnnm (58) | ✔ | 12 | 100 | 1 | 1.9334 | 1.963 | 0.000 | (0;000) | ✗ | 02/02/17 |
KPAuSe3 | ICSD | 165322 | C2/m (12) | ✔ | 12 | 86 | 1 | 1.0257 | 1.089 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2Sn2Au | ICSD | 192982 | I4_1/amd (141) | ✔ | 10 | 90 | 3 | 0.0 | 0.000 | 0.914 | (1;111) | ✗ | 02/02/17 |
Li3AuS2 | COD | 4319430 | Ibam (72) | ✔ | 12 | 64 | 1 | 1.7845 | 1.785 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiAu(S2O7)2 | ICSD | 422909 | P-1 (2) | ✔ | 20 | 122 | 1 | 2.371 | 2.380 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiAuS | COD | 4319429 | Fddd (70) | ✔ | 12 | 80 | 3 | 1.05 | 1.050 | 0.000 | (0;000) | ✗ | 02/02/17 |
Mg2Au | COD | 1510233 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.002 | 0.777 | (0;011) | ✗ | 02/02/17 |
RbNa2AuO2 | ICSD | 411460 | Pnnm (58) | ✔ | 12 | 100 | 1 | 2.0377 | 2.050 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na2SbAu | COD | 7209394 | Cmcm (63) | ✔ | 8 | 68 | 1 | 0.1268 | 0.189 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3AuS2 | COD | 1510251 | R-3c (167) | ✔ | 12 | 100 | 1 | 2.363 | 2.771 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na4TlAu | ICSD | 107428 | Fmmm (69) | ✔ | 12 | 120 | 1 | 0.0 | 0.010 | 0.653 | (0;000) | ✗ | 02/02/17 |
NaAuSe2 | COD | 1510244 | P2_1/c (14) | ✔ | 16 | 128 | 2 | 0.9668 | 1.097 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaSnAu | COD | 1510245 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.005 | 0.359 | (1;000) | ✗ | 02/02/17 |