▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Na2MgCl4 | ICSD | 69343 | Pbam (55) | ✔ | 14 | 112 | 1 | 4.8587 | 4.859 | 0.000 | (0;000) | ✗ | 02/02/17 |
OsSe2 | COD | 9012407 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.0681 | 0.199 | 0.000 | (0;000) | ✗ | 02/02/17 |
MnHO2 | COD | 9009773 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.030 | 0.465 | (0;000) | ✗ | 27/01/17 |
CS2NF5 | ICSD | 413754 | P-1 (2) | ✔ | 18 | 112 | 1 | 3.4262 | 3.430 | 0.000 | (0;000) | ✗ | 02/02/17 |
Os(SCl6)2 | ICSD | 74680 | R-3m (166) | ✔ | 15 | 112 | 1 | 0.386 | 0.445 | 0.000 | (0;000) | ✗ | 02/02/17 |
As2Se3 | COD | 9011471 | P2_1/c (14) | ✔ | 20 | 112 | 2 | 1.2699 | 1.470 | 0.000 | (0;000) | ✗ | 30/01/17 |
V3Co | ICSD | 102716 | Pm-3n (223) | ✔ | 8 | 112 | 3 | 0.0 | 0.000 | 0.567 | (1;000) | ✗ | 27/01/17 |
MgMoH2O5 | ICSD | 202695 | P-1 (2) | ✔ | 18 | 112 | 3 | 4.2496 | 4.341 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrLiBi | ICSD | 58800 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.0791 | 0.079 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cl2 | COD | 9015583 | P4_2/ncm (138) | ✔ | 16 | 112 | 1 | 0.2095 | 0.551 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbTaGeS5 | ICSD | 417874 | P-1 (2) | ✔ | 16 | 112 | 1 | 0.6998 | 0.708 | 0.000 | (0;000) | ✗ | 02/02/17 |
K3SbO4 | COD | 2012333 | P2/c (13) | ✔ | 16 | 112 | 3 | 2.5564 | 2.613 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZrP2O7 | COD | 2102118 | Pnnm (58) | ✔ | 20 | 112 | 3 | 4.355 | 4.355 | 0.000 | (0;000) | ✗ | 02/02/17 |
CuAgS | ICSD | 66581 | Pmc2_1 (26) | ✗ | 12 | 112 | 3 | 0.7052 | 0.722 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiSI | ICSD | 25575 | Pnma (62) | ✔ | 12 | 112 | 1 | 0.8593 | 1.045 | 0.000 | (0;000) | ✗ | 02/02/17 |
P2O3 | ICSD | 62026 | P2_1/m (11) | ✔ | 20 | 112 | 1 | 3.7642 | 3.787 | 0.000 | (0;000) | ✗ | 02/02/17 |
H2PbO2 | ICSD | 20701 | Pnma (62) | ✔ | 20 | 112 | 3 | 1.7355 | 1.979 | 0.000 | (0;000) | ✗ | 02/02/17 |
Fe3C | ICSD | 29341 | Pnma (62) | ✔ | 16 | 112 | 3 | 0.0 | 0.005 | 0.194 | (1;000) | ✗ | 27/01/17 |
Nb2O5 | COD | 1528678 | C2/c (15) | ✔ | 14 | 112 | 3 | 2.7685 | 2.894 | 0.000 | (0;000) | ✗ | 27/01/17 |
Sb2S2O | COD | 9012422 | P-1 (2) | ✔ | 20 | 112 | 2 | 0.0 | 1.072 | 1.000 | (0;000) | ✗ | 02/02/17 |
Sn2IF3 | ICSD | 2419 | C222_1 (20) | ✗ | 12 | 112 | 1 | 2.2326 | 2.389 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sb2O3 | ICSD | 27595 | Pccn (56) | ✔ | 20 | 112 | 2 | 0.0 | 0.129 | 1.000 | (0;000) | ✗ | 02/02/17 |
Sr3BPO3 | ICSD | 401207 | P6_3/mmc (194) | ✔ | 16 | 112 | 1 | 2.106 | 2.352 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ru(CO)4 | ICSD | 72577 | Ibam (72) | ✔ | 18 | 112 | 1 | 2.2438 | 2.285 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cr | ICSD | 625716 | Pm-3n (223) | ✔ | 8 | 112 | 3 | 0.0 | 0.005 | 0.346 | (0;000) | ✗ | 27/01/17 |
Nb3Rh | ICSD | 105216 | Pm-3n (223) | ✔ | 8 | 112 | 3 | 0.0 | 0.001 | 0.614 | (0;000) | ✗ | 27/01/17 |
V4Zn5 | COD | 1528038 | I4/mmm (139) | ✔ | 9 | 112 | 3 | 0.0 | 0.002 | 0.859 | (0;000) | ✗ | 27/01/17 |
BaNa2 | COD | 7221378 | P6_3/mmc (194) | ✔ | 12 | 112 | 1 | 0.0 | 0.002 | 0.455 | (1;000) | ✗ | 02/02/17 |
SiP2O7 | ICSD | 423437 | P2_1/c (14) | ✔ | 20 | 112 | 3 | 5.4719 | 5.472 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ag2Te | COD | 5910144 | P2_1/c (14) | ✔ | 12 | 112 | 3 | 0.0803 | 0.080 | 0.000 | (1;000) | ✗ | 30/01/17 |
As2O3 | COD | 9014252 | P2_1/c (14) | ✔ | 20 | 112 | 2 | 3.969 | 4.192 | 0.000 | (0;000) | ✗ | 30/01/17 |
K3CO3F | ICSD | 66028 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.9679 | 3.968 | 0.000 | (0;000) | ✗ | 02/02/17 |
PbF2 | COD | 2310346 | Pnma (62) | ✔ | 12 | 112 | 3 | 3.9763 | 4.204 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3ScV2O8 | ICSD | 248844 | P-3m1 (164) | ✔ | 14 | 112 | 2 | 3.1846 | 3.280 | 0.000 | (0;000) | ✗ | 02/02/17 |
Te2Os | COD | 5910143 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.724 | 0.875 | 0.000 | (0;000) | ✗ | 02/02/17 |
P2S3 | ICSD | 423037 | P2_1/m (11) | ✔ | 20 | 112 | 1 | 2.2148 | 2.293 | 0.000 | (0;000) | ✗ | 02/02/17 |
Os(SeBr6)2 | ICSD | 182315 | C2/m (12) | ✔ | 15 | 112 | 2 | 0.2779 | 0.389 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaSO2 | COD | 1524206 | Pnma (62) | ✔ | 16 | 112 | 1 | 0.999 | 1.033 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ag2S | COD | 4329107 | P2_1/c (14) | ✔ | 12 | 112 | 3 | 0.0315 | 0.032 | 0.000 | (0;000) | ✗ | 30/01/17 |
P2Pd3S8 | COD | 1527147 | P-3m1 (164) | ✔ | 13 | 112 | 3 | 1.0522 | 1.053 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb3CO3F | ICSD | 66029 | R-3c (167) | ✔ | 16 | 112 | 1 | 3.5487 | 3.549 | 0.000 | (0;000) | ✗ | 02/02/17 |
V3Rh | ICSD | 650519 | Pm-3n (223) | ✔ | 8 | 112 | 3 | 0.0 | 0.000 | 0.533 | (1;000) | ✗ | 27/01/17 |
HPbBrO | ICSD | 404573 | Pnma (62) | ✔ | 16 | 112 | 3 | 2.8066 | 2.835 | 0.000 | (0;000) | ✗ | 02/02/17 |
As2O3 | COD | 4513566 | Fd-3m (227) | ✔ | 20 | 112 | 1 | 4.1418 | 4.179 | 0.000 | (0;000) | ✗ | 30/01/17 |
PbBr2 | COD | 9009196 | Pnma (62) | ✔ | 12 | 112 | 2 | 2.537 | 2.640 | 0.000 | (0;000) | ✗ | 02/02/17 |
NbNiP | ICSD | 645088 | Pnma (62) | ✔ | 12 | 112 | 3 | 0.0 | 0.013 | 0.279 | (0;000) | ✗ | 27/01/17 |
As2O3 | COD | 4506960 | P2_1/c (14) | ✔ | 20 | 112 | 2 | 3.4753 | 3.656 | 0.000 | (0;000) | ✗ | 30/01/17 |
HfTl2Se3 | COD | 7019864 | P2_1/m (11) | ✔ | 12 | 112 | 3 | 0.4025 | 0.553 | 0.000 | (0;000) | ✗ | 02/02/17 |
V2O5 | ICSD | 43132 | Pmmn (59) | ✔ | 14 | 112 | 1 | 0.0 | 0.004 | 0.487 | (0;000) | ✗ | 27/01/17 |
Sr(AsO3)2 | ICSD | 420297 | P6_3/mcm (193) | ✔ | 18 | 112 | 2 | 3.844 | 4.081 | 0.000 | (0;000) | ✗ | 30/01/17 |