▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MgSiAs2 | ICSD | 182367 | I-42d (122) | ✗ | 8 | 48 | 3 | 1.2401 | 1.240 | 0.000 | (0;000) | ✗ | 07/10/16 |
BaHfS3 | ICSD | 615918 | Pnma (62) | ✔ | 20 | 160 | 3 | 1.2402 | 1.240 | 0.000 | (0;000) | ✗ | 02/02/17 |
S3(NO)2 | COD | 7221393 | C2/c (15) | ✔ | 14 | 80 | 1 | 1.241 | 1.348 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlBr | COD | 9008825 | Pm-3m (221) | ✔ | 2 | 20 | 1 | 1.2438 | 1.649 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaZn3Se4 | ICSD | 167831 | P-43m (215) | ✗ | 8 | 70 | 3 | 1.2442 | 1.244 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbI3Cl8 | ICSD | 26402 | P-1 (2) | ✔ | 12 | 82 | 3 | 1.2444 | 1.285 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZnS2 | ICSD | 651447 | Pa3 (205) | ✔ | 12 | 96 | 3 | 1.2446 | 1.288 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaTe | COD | 9008602 | Fm-3m (225) | ✔ | 2 | 16 | 1 | 1.2448 | 1.616 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr2In2O5 | COD | 2002271 | Ima2 (46) | ✗ | 18 | 152 | 3 | 1.2457 | 1.246 | 0.000 | (0;000) | ✗ | 29/03/17 |
Re4Cl8O9 | COD | 1524180 | P-1 (2) | ✔ | 21 | 170 | 1 | 1.2481 | 1.264 | 0.000 | (0;000) | ✗ | 07/08/17 |
LiAuF4 | COD | 1510140 | C2/c (15) | ✔ | 12 | 84 | 3 | 1.2487 | 1.249 | 0.000 | (0;000) | ✗ | 05/01/17 |
KBi(PSe3)2 | ICSD | 90153 | P2_1 (4) | ✗ | 20 | 140 | 3 | 1.2488 | 1.327 | 0.000 | (0;000) | ✗ | 21/03/17 |
Rb2SnBr6 | ICSD | 158956 | Fm-3m (225) | ✔ | 9 | 74 | 2 | 1.2508 | 1.251 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cd(GaSe2)2 | ICSD | 163949 | I-4 (82) | ✗ | 7 | 62 | 3 | 1.251 | 1.251 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs7Au5O2 | COD | 1510553 | Immm (71) | ✔ | 14 | 130 | 3 | 1.2515 | 1.352 | 0.000 | (0;000) | ✗ | 21/03/17 |
ZrBrN | ICSD | 51771 | R-3m (166) | ✔ | 6 | 32 | 2 | 1.2522 | 1.887 | 0.000 | (0;000) | ✗ | 27/01/17 |
C3N4 | ICSD | 246660 | R3m (160) | ✗ | 7 | 32 | 2 | 1.2528 | 1.275 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cs2Pt3Se4 | ICSD | 33893 | Fmmm (69) | ✔ | 9 | 72 | 1 | 1.2542 | 1.348 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca3C3Cl2 | ICSD | 33818 | Cmcm (63) | ✔ | 16 | 112 | 1 | 1.2545 | 1.336 | 0.000 | (0;000) | ✗ | 02/02/17 |
Tl2SiF6 | ICSD | 52292 | Fm-3m (225) | ✔ | 9 | 72 | 2 | 1.2547 | 1.589 | 0.000 | (0;000) | ✗ | 27/01/17 |
CsTiCu3Se4 | ICSD | 391259 | P2_1/m (11) | ✔ | 18 | 156 | 2 | 1.2556 | 1.438 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ta3N5 | COD | 1005006 | Cmcm (63) | ✔ | 16 | 128 | 3 | 1.2557 | 1.519 | 0.000 | (0;000) | ✗ | 02/02/17 |
Ca3(AlP2)2 | ICSD | 423780 | C2/c (15) | ✔ | 18 | 112 | 2 | 1.257 | 1.257 | 0.000 | (0;000) | ✗ | 30/01/17 |
Li2PbO3 | ICSD | 35182 | C2/c (15) | ✔ | 12 | 76 | 3 | 1.2573 | 1.362 | 0.000 | (0;000) | ✗ | 27/01/17 |
CaC2 | ICSD | 54185 | C2/m (12) | ✔ | 6 | 36 | 1 | 1.2582 | 1.961 | 0.000 | (0;000) | ✗ | 27/01/17 |
SrAgSF | ICSD | 183709 | P4/nmm (129) | ✔ | 8 | 68 | 1 | 1.2589 | 1.259 | 0.000 | (0;000) | ✗ | 05/01/17 |
K2PtS2 | ICSD | 26258 | Immm (71) | ✔ | 5 | 40 | 1 | 1.2612 | 1.793 | 0.000 | (0;000) | ✗ | 27/01/17 |
NaAgO | ICSD | 188524 | I-4m2 (119) | ✗ | 12 | 104 | 3 | 1.2628 | 1.270 | 0.000 | (0;000) | ✗ | 07/10/16 |
Rb2VCuS4 | ICSD | 84302 | Fddd (70) | ✔ | 16 | 132 | 1 | 1.2635 | 1.533 | 0.000 | (0;000) | ✗ | 02/02/17 |
YAgSe2 | ICSD | 605836 | P2_12_12_1 (19) | ✗ | 16 | 136 | 3 | 1.2636 | 1.264 | 0.000 | (0;000) | ✗ | 16/03/17 |
BaPdCl4 | ICSD | 411837 | Pbcn (60) | ✔ | 24 | 224 | 1 | 1.264 | 1.264 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs2Zr(AgTe2)2 | ICSD | 80195 | C222 (21) | ✗ | 9 | 68 | 2 | 1.2649 | 1.606 | 0.000 | (0;000) | ✗ | 16/03/17 |
K3Cu3P2 | COD | 7221376 | R-3m (166) | ✔ | 8 | 70 | 2 | 1.2649 | 1.324 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiMgAs | ICSD | 107954 | F-43m (216) | ✗ | 3 | 18 | 3 | 1.2653 | 1.565 | 0.000 | (0;000) | ✗ | 15/02/17 |
ZnSiP2 | ICSD | 657290 | I-42d (122) | ✗ | 8 | 52 | 3 | 1.2666 | 1.267 | 0.000 | (0;000) | ✗ | 15/02/17 |
Cs3Sb2I9 | COD | 1520793 | P-3m1 (164) | ✔ | 14 | 100 | 2 | 1.2671 | 1.279 | 0.000 | (0;000) | ✗ | 02/02/17 |
SiS2 | COD | 9016349 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 1.268 | 1.837 | 0.000 | (0;000) | ✗ | 29/03/17 |
YBi2ClO4 | ICSD | 92405 | P4/mmm (123) | ✔ | 8 | 72 | 2 | 1.2683 | 1.494 | 0.000 | (0;000) | ✗ | 05/01/17 |
KCuO | ICSD | 40158 | I4/mmm (139) | ✔ | 12 | 104 | 2 | 1.2693 | 1.361 | 0.000 | (0;000) | ✗ | 02/02/17 |
LiCa2HC3 | ICSD | 261184 | P4/mbm (127) | ✔ | 14 | 72 | 1 | 1.2698 | 1.552 | 0.000 | (0;000) | ✗ | 27/01/17 |
As2Se3 | COD | 9011471 | P2_1/c (14) | ✔ | 20 | 112 | 2 | 1.2699 | 1.470 | 0.000 | (0;000) | ✗ | 30/01/17 |
BiI3 | ICSD | 78791 | R-3 (148) | ✔ | 8 | 72 | 2 | 1.2702 | 1.298 | 0.000 | (0;000) | ✗ | 02/02/17 |
CsTlI4 | ICSD | 59110 | P2_1/c (14) | ✔ | 24 | 200 | 1 | 1.2714 | 1.337 | 0.000 | (0;000) | ✗ | 04/08/17 |
KTlO | COD | 1528008 | C2/m (12) | ✔ | 6 | 56 | 1 | 1.2719 | 1.734 | 0.000 | (0;000) | ✗ | 27/01/17 |
Bi2O3 | ICSD | 169685 | P31c (159) | ✗ | 20 | 112 | 3 | 1.2724 | 1.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiSCl | COD | 8103601 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.2731 | 1.362 | 0.000 | (0;000) | ✗ | 02/02/17 |
PdSeO4 | ICSD | 416646 | C2/c (15) | ✔ | 12 | 96 | 3 | 1.2734 | 1.404 | 0.000 | (0;000) | ✗ | 27/01/17 |
AgHgAsS3 | COD | 9000870 | Cc (9) | ✗ | 12 | 92 | 3 | 1.2735 | 1.278 | 0.000 | (0;000) | ✗ | 16/03/17 |
BiSeCl | ICSD | 40862 | Pnma (62) | ✔ | 12 | 112 | 1 | 1.2742 | 1.277 | 0.000 | (0;000) | ✗ | 02/02/17 |
Cs(SbS2)2 | ICSD | 67976 | P-1 (2) | ✔ | 14 | 86 | 3 | 1.2748 | 1.768 | 0.000 | (0;000) | ✗ | 02/02/17 |