▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▴ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TaNiP2 | ICSD | 646158 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.001 | 0.312 | (0;011) | ✗ | 02/02/17 |
SrLi3MnN3 | ICSD | 412874 | R-3 (148) | ✔ | 16 | 98 | 2 | 0.0 | 0.056 | 0.035 | (0;000) | ✗ | 27/01/17 |
NiP | COD | 9014942 | Pbca (61) | ✔ | 16 | 120 | 3 | 0.0 | 0.061 | 0.180 | (0;000) | ✗ | 02/02/17 |
LiCoSO4F | ICSD | 167202 | P-1 (2) | ✔ | 16 | 114 | 3 | 0.0 | 0.013 | 0.268 | (0;100) | ✗ | 27/01/17 |
Li2CdSnS4 | COD | 4302974 | Pmn2_1 (31) | ✗ | 16 | 112 | 2 | 2.0977 | 2.098 | 0.000 | (0;000) | ✗ | 22/03/17 |
BaMnS2 | ICSD | 615969 | Pnma (62) | ✔ | 16 | 148 | 2 | 0.0 | 0.000 | 0.707 | (1;011) | ✗ | 02/02/17 |
K5CuAs2 | COD | 1008879 | P6_3/mmc (194) | ✔ | 16 | 132 | 1 | 0.3772 | 0.473 | 0.000 | (0;000) | ✗ | 30/01/17 |
Li3SbO4 | COD | 2012121 | P2/c (13) | ✔ | 16 | 76 | 1 | 3.4604 | 3.474 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba5Sb3 | ICSD | 616108 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.631 | (0;000) | ✗ | 02/02/17 |
HgN3 | ICSD | 426345 | P2_1/c (14) | ✔ | 16 | 108 | 3 | 2.4188 | 2.423 | 0.000 | (0;000) | ✗ | 02/02/17 |
HgNO2 | ICSD | 60055 | P2_1/c (14) | ✔ | 16 | 116 | 3 | 2.1969 | 2.197 | 0.000 | (0;000) | ✗ | 02/02/17 |
V2PO5 | ICSD | 79681 | I4_1/amd (141) | ✔ | 16 | 122 | 3 | 0.0 | 0.000 | 0.725 | (1;111) | ✗ | 27/01/17 |
Sr3Hg | ICSD | 639226 | Pnma (62) | ✔ | 16 | 168 | 2 | 0.0 | 0.010 | 0.233 | (0;000) | ✗ | 02/02/17 |
Cr5Ge3 | ICSD | 626080 | I4/mcm (140) | ✔ | 16 | 164 | 3 | 0.0 | 0.001 | 0.549 | (1;000) | ✗ | 02/02/17 |
H4CSN2 | ICSD | 2400 | Pmc2_1 (26) | ✗ | 16 | 48 | 1 | 2.64 | 3.019 | 0.000 | (0;000) | ✗ | 22/03/17 |
HPbIO | ICSD | 192169 | Pnma (62) | ✔ | 16 | 112 | 3 | 2.3146 | 2.398 | 0.000 | (0;000) | ✗ | 02/02/17 |
NbNiAs2 | ICSD | 38412 | Pnma (62) | ✔ | 16 | 132 | 3 | 0.0 | 0.001 | 0.329 | (0;011) | ✗ | 30/01/17 |
H2 | ICSD | 31543 | Pnma (62) | ✔ | 16 | 16 | 1 | 0.0 | 0.001 | 0.476 | (1;000) | ✗ | 02/02/17 |
SrBe3O4 | ICSD | 26179 | P-62c (190) | ✗ | 16 | 92 | 1 | 4.1894 | 4.189 | 0.000 | (0;000) | ✗ | 15/02/17 |
LiFeSO4F | ICSD | 182944 | P-1 (2) | ✔ | 16 | 96 | 3 | 0.3415 | 0.363 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ba5As3 | ICSD | 43872 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.726 | (0;000) | ✗ | 30/01/17 |
As3Rh | COD | 9015095 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.038 | (1;000) | ✗ | 30/01/17 |
CuPtF6 | ICSD | 64660 | P-1 (2) | ✔ | 16 | 126 | 3 | 0.0 | 0.006 | 0.051 | (1;010) | ✗ | 27/01/17 |
BH5NCl | ICSD | 248875 | Cmc2_1 (36) | ✗ | 16 | 40 | 1 | 6.0688 | 6.228 | 0.000 | (0;000) | ✗ | 15/02/17 |
I3N | COD | 9014796 | Pnma (62) | ✔ | 16 | 104 | 1 | 0.0 | 0.005 | 0.530 | (0;000) | ✗ | 02/02/17 |
CdSe2O5 | COD | 2010004 | C2/c (15) | ✔ | 16 | 108 | 3 | 3.2062 | 3.475 | 0.000 | (0;000) | ✗ | 02/02/17 |
MoH2Cl2O3 | ICSD | 25031 | Pmn2_1 (31) | ✗ | 16 | 96 | 2 | 0.8466 | 0.889 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ca5As3 | ICSD | 43877 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.557 | (0;000) | ✗ | 30/01/17 |
CoAs3 | COD | 1011231 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.101 | (1;000) | ✗ | 30/01/17 |
As3Ir | COD | 9016517 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.2733 | 0.273 | 0.000 | (0;000) | ✗ | 30/01/17 |
PtI3 | ICSD | 47120 | C2/c (15) | ✔ | 16 | 124 | 3 | 0.302 | 0.302 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr5As3 | ICSD | 44067 | P6_3/mcm (193) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.492 | (0;000) | ✗ | 30/01/17 |
SbI3 | ICSD | 30906 | P2_1/c (14) | ✔ | 16 | 104 | 1 | 2.0113 | 2.049 | 0.000 | (0;000) | ✗ | 02/02/17 |
MgHOF | ICSD | 186501 | Pnma (62) | ✔ | 16 | 96 | 3 | 4.8158 | 4.816 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaFeSO4F | ICSD | 262276 | C2/c (15) | ✔ | 16 | 108 | 3 | 0.1321 | 0.161 | 0.000 | (0;000) | ✗ | 27/01/17 |
V5As3 | ICSD | 611571 | I4/mcm (140) | ✔ | 16 | 160 | 3 | 0.0 | 0.001 | 0.532 | (0;111) | ✗ | 30/01/17 |
BeSiN2 | ICSD | 25704 | Pna2_1 (33) | ✗ | 16 | 72 | 3 | 5.07 | 5.226 | 0.000 | (0;000) | ✗ | 15/02/17 |
RbI3 | ICSD | 61348 | Pnma (62) | ✔ | 16 | 120 | 1 | 1.6576 | 1.668 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaCuSO4F | ICSD | 262273 | C2/c (15) | ✔ | 16 | 114 | 3 | 0.0 | 0.000 | 0.143 | (1;101) | ✗ | 27/01/17 |
Sn2SbS2I3 | ICSD | 23344 | Cmcm (63) | ✔ | 16 | 132 | 2 | 0.3236 | 0.363 | 0.000 | (0;000) | ✗ | 02/02/17 |
Li2BeSiO4 | COD | 9013066 | Pc (7) | ✗ | 16 | 76 | 3 | 4.9988 | 4.999 | 0.000 | (0;000) | ✗ | 15/02/17 |
CuHOF | ICSD | 98698 | P2_1/c (14) | ✔ | 16 | 100 | 2 | 0.0 | 0.052 | 0.272 | (0;010) | ✗ | 27/01/17 |
LiRhO2 | ICSD | 59179 | Fd-3m (227) | ✔ | 16 | 128 | 3 | 1.5341 | 1.536 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li2BeSiO4 | ICSD | 2319 | C222_1 (20) | ✗ | 16 | 76 | 1 | 5.8062 | 5.806 | 0.000 | (0;000) | ✗ | 15/02/17 |
BH6N | ICSD | 237078 | Cmc2_1 (36) | ✗ | 16 | 28 | 1 | 5.397 | 5.563 | 0.000 | (0;000) | ✗ | 15/02/17 |
LiV2O5 | ICSD | 88639 | Pmmn (59) | ✔ | 16 | 118 | 2 | 0.0 | 0.000 | 0.987 | (0;000) | ✗ | 27/01/17 |
Y3Os | ICSD | 647869 | Pnma (62) | ✔ | 16 | 196 | 3 | 0.0 | 0.000 | 0.327 | (0;110) | ✗ | 02/02/17 |
Rb3CO3F | ICSD | 66029 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.5487 | 3.549 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsSbCl6 | ICSD | 155691 | Cc (9) | ✗ | 16 | 112 | 1 | 2.3084 | 2.309 | 0.000 | (0;000) | ✗ | 22/03/17 |
PICl6 | ICSD | 26594 | P-42_1m (113) | ✗ | 16 | 108 | 1 | 0.9841 | 1.058 | 0.000 | (0;000) | ✗ | 22/03/17 |
BH6N | ICSD | 181422 | Cmc2_1 (36) | ✗ | 16 | 28 | 1 | 6.5504 | 6.904 | 0.000 | (0;000) | ✗ | 15/02/17 |
NaAsS2 | COD | 8103561 | P2_1/c (14) | ✔ | 16 | 104 | 1 | 1.4835 | 1.565 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba3BAsO3 | ICSD | 402682 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 1.3926 | 1.694 | 0.000 | (0;000) | ✗ | 30/01/17 |
Ba2ScFeAsO3 | ICSD | 420654 | P4/nmm (129) | ✔ | 16 | 124 | 1 | 0.0 | 0.012 | 0.409 | (0;000) | ✗ | 30/01/17 |
BiAsPbO5 | ICSD | 419124 | C2/m (12) | ✔ | 16 | 128 | 3 | 1.7009 | 1.885 | 0.000 | (0;000) | ✗ | 30/01/17 |
CdSb | COD | 9008881 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.0 | 0.315 | 0.011 | (0;000) | ✗ | 02/02/17 |
MnBiAsO5 | ICSD | 59721 | P-1 (2) | ✔ | 16 | 130 | 3 | 0.0 | 0.013 | 0.174 | (1;101) | ✗ | 30/01/17 |
NiBiAsO5 | COD | 9005468 | P-1 (2) | ✔ | 16 | 120 | 3 | 0.0 | 0.024 | 0.333 | (0;011) | ✗ | 30/01/17 |
FeN3ClO3 | ICSD | 281495 | P6_3mc (186) | ✗ | 16 | 96 | 1 | 1.311 | 1.369 | 0.000 | (0;000) | ✗ | 22/03/17 |
BH6N | COD | 4116439 | Pmn2_1 (31) | ✗ | 16 | 28 | 1 | 5.5448 | 5.545 | 0.000 | (0;000) | ✗ | 15/02/17 |
AsPb2Cl2O3 | COD | 9007762 | P2_1/m (11) | ✔ | 16 | 130 | 2 | 0.0 | 0.000 | 0.849 | (0;001) | ✗ | 30/01/17 |
NaMgSO4F | ICSD | 262272 | C2/c (15) | ✔ | 16 | 112 | 3 | 5.6507 | 5.651 | 0.000 | (0;000) | ✗ | 27/01/17 |
Cu2AsClO4 | ICSD | 901 | P2_1/m (11) | ✔ | 16 | 116 | 3 | 0.0 | 0.016 | 0.602 | (0;000) | ✗ | 30/01/17 |
CIF2 | COD | 7200677 | P2_1/c (14) | ✔ | 16 | 100 | 1 | 3.1528 | 3.212 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zn2NCl | ICSD | 425734 | Pna2_1 (33) | ✗ | 16 | 144 | 3 | 2.0638 | 2.072 | 0.000 | (0;000) | ✗ | 22/03/17 |
CdAs | ICSD | 432 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.1609 | 0.448 | 0.000 | (0;000) | ✗ | 30/01/17 |
SCl | ICSD | 37016 | Fdd2 (43) | ✗ | 16 | 104 | 1 | 2.6979 | 2.765 | 0.000 | (0;000) | ✗ | 22/03/17 |
Mn3C | ICSD | 618248 | Pnma (62) | ✔ | 16 | 196 | 3 | 0.0 | 0.000 | 0.874 | (0;110) | ✗ | 22/03/17 |
PbCN2 | COD | 2310547 | Pna2_1 (33) | ✗ | 16 | 112 | 2 | 1.6961 | 1.912 | 0.000 | (0;000) | ✗ | 22/03/17 |
ClO3 | ICSD | 61334 | Cc (9) | ✗ | 16 | 100 | 1 | 1.0463 | 1.055 | 0.000 | (0;000) | ✗ | 22/03/17 |
Co2AsClO4 | ICSD | 902 | P2_1/m (11) | ✔ | 16 | 140 | 3 | 0.0 | 0.014 | 0.656 | (1;011) | ✗ | 30/01/17 |
ZnCN2 | COD | 2011885 | I-42d (122) | ✗ | 16 | 104 | 3 | 3.5423 | 3.901 | 0.000 | (0;000) | ✗ | 22/03/17 |
K3CO3F | ICSD | 66028 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.9679 | 3.968 | 0.000 | (0;000) | ✗ | 02/02/17 |
InSn2I5 | ICSD | 151996 | I4/mcm (140) | ✔ | 16 | 152 | 3 | 0.9578 | 0.958 | 0.000 | (0;000) | ✗ | 02/02/17 |
InPb2I5 | ICSD | 151997 | I4/mcm (140) | ✔ | 16 | 152 | 2 | 1.2846 | 1.323 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs2NaAsO4 | ICSD | 36533 | P2_1/m (11) | ✔ | 16 | 112 | 1 | 4.104 | 4.122 | 0.000 | (0;000) | ✗ | 30/01/17 |
Sr2CrFeAsO3 | ICSD | 180529 | P4/nmm (129) | ✔ | 16 | 130 | 1 | 0.0 | 0.000 | 0.894 | (1;001) | ✗ | 30/01/17 |
HNF2 | ICSD | 404200 | Pca2_1 (29) | ✗ | 16 | 80 | 1 | 5.0387 | 5.072 | 0.000 | (0;000) | ✗ | 15/02/17 |
CsBiS2 | ICSD | 72975 | P2_1/c (14) | ✔ | 16 | 144 | 1 | 1.5688 | 1.689 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaYPO4F | ICSD | 51463 | C2/m (12) | ✔ | 16 | 112 | 3 | 5.7036 | 5.731 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaZnSO4F | ICSD | 262274 | C2/c (15) | ✔ | 16 | 116 | 3 | 4.4205 | 4.421 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sr2ScFeAsO3 | ICSD | 180528 | P4/nmm (129) | ✔ | 16 | 124 | 1 | 0.0 | 0.016 | 0.426 | (0;000) | ✗ | 30/01/17 |
Tl3CO3F | ICSD | 2515 | P2_1/m (11) | ✔ | 16 | 136 | 3 | 2.157 | 2.424 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaAs | ICSD | 182159 | P2_1/c (14) | ✔ | 16 | 112 | 1 | 0.8758 | 0.946 | 0.000 | (0;000) | ✗ | 30/01/17 |
KAsO2 | ICSD | 413149 | Pbcm (57) | ✔ | 16 | 104 | 1 | 3.8754 | 3.965 | 0.000 | (0;000) | ✗ | 30/01/17 |
CuBiS2 | COD | 9009502 | Pnma (62) | ✔ | 16 | 152 | 3 | 0.3737 | 0.450 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiAs | COD | 9008949 | P2_1/c (14) | ✔ | 16 | 64 | 1 | 0.4721 | 0.668 | 0.000 | (0;000) | ✗ | 30/01/17 |
YCu6ClO8 | ICSD | 188351 | Fm-3m (225) | ✔ | 16 | 132 | 3 | 0.0 | 0.004 | 0.872 | (0;000) | ✗ | 27/01/17 |
Cs2CoSiO4 | ICSD | 93878 | Cmc2_1 (36) | ✗ | 16 | 126 | 3 | 0.0 | 0.000 | 0.720 | ? | ✗ | 22/03/17 |
Na2CoGeO4 | ICSD | 200680 | Pc (7) | ✗ | 16 | 126 | 3 | 0.0 | 0.000 | 0.734 | ? | ✗ | 22/03/17 |
Na2CoGeO4 | ICSD | 23425 | Pmn2_1 (31) | ✗ | 16 | 126 | 3 | 0.0 | 0.000 | 0.791 | ? | ✗ | 22/03/17 |
InCu6ClO8 | ICSD | 69612 | Fm-3m (225) | ✔ | 16 | 134 | 3 | 0.0 | 0.007 | 0.411 | (0;000) | ✗ | 27/01/17 |
BiF3 | COD | 1527437 | Pnma (62) | ✔ | 16 | 144 | 3 | 3.6893 | 3.690 | 0.000 | (0;000) | ✗ | 02/02/17 |
CO | ICSD | 40937 | R3c (161) | ✗ | 16 | 80 | 1 | 5.0941 | 5.145 | 0.000 | (0;000) | ✗ | 22/03/17 |
In3Ir | ICSD | 240201 | Pnma (62) | ✔ | 16 | 224 | 3 | 0.0 | 0.026 | 0.338 | (1;000) | ✗ | 02/02/17 |
Na4CoO3 | COD | 1523213 | Cc (9) | ✗ | 16 | 142 | 3 | 0.0 | 0.002 | 0.670 | ? | ✗ | 22/03/17 |
Sc5Pb3 | COD | 2310215 | P6_3/mcm (193) | ✔ | 16 | 194 | 3 | 0.0 | 0.000 | 0.821 | (0;000) | ✗ | 02/02/17 |
P3Rh | ICSD | 647999 | Im3 (204) | ✔ | 16 | 128 | 3 | 0.0 | 0.000 | 0.161 | (1;000) | ✗ | 02/02/17 |
HCCl2 | COD | 7106717 | P2_1/c (14) | ✔ | 16 | 76 | 1 | 5.0857 | 5.162 | 0.000 | (0;000) | ✗ | 02/02/17 |
FeCo2B | ICSD | 603579 | Pnma (62) | ✔ | 16 | 180 | 3 | 0.0 | 0.000 | 0.387 | (0;110) | ✗ | 05/01/17 |