▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▴ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sb2PbO6 | ICSD | 16852 | P-31m (162) | ✔ | 9 | 60 | 3 | 2.242 | 2.378 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlCuBr4 | COD | 4322712 | P-42c (112) | ✗ | 12 | 84 | 3 | 2.2424 | 2.363 | 0.000 | (0;000) | ✗ | 16/03/17 |
NaAu(IO3)4 | ICSD | 250786 | P1 (1) | ✗ | 18 | 120 | 1 | 2.2426 | 2.263 | 0.000 | (0;000) | ✗ | 21/03/17 |
OsO3F2 | ICSD | 73732 | P2_1/c (14) | ✔ | 24 | 192 | 1 | 2.2427 | 2.305 | 0.000 | (0;000) | ✗ | 04/08/17 |
GeS2 | COD | 1010520 | Fdd2 (43) | ✗ | 18 | 96 | 3 | 2.2429 | 2.345 | 0.000 | (0;000) | ✗ | 22/03/17 |
Ru(CO)4 | ICSD | 72577 | Ibam (72) | ✔ | 18 | 112 | 1 | 2.2438 | 2.285 | 0.000 | (0;000) | ✗ | 02/02/17 |
BaY2PdO5 | COD | 1000242 | P4/mbm (127) | ✔ | 18 | 160 | 3 | 2.2474 | 2.377 | 0.000 | (0;000) | ✗ | 02/02/17 |
SrO2 | COD | 1100026 | I4/mmm (139) | ✔ | 3 | 22 | 1 | 2.2477 | 2.248 | 0.000 | (0;000) | ✗ | 27/01/17 |
ScTa(PbO3)2 | ICSD | 77739 | Fm-3m (225) | ✔ | 10 | 88 | 3 | 2.2483 | 2.248 | 0.000 | (0;000) | ✗ | 27/01/17 |
SiC | COD | 9011661 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 2.2495 | 3.971 | 0.000 | (0;000) | ✗ | 15/02/17 |
Li4RuH6 | ICSD | 638272 | R-3c (167) | ✔ | 22 | 68 | 1 | 2.2498 | 2.250 | 0.000 | (0;000) | ✗ | 04/08/17 |
BrNO3 | ICSD | 407765 | P2_12_12_1 (19) | ✗ | 20 | 120 | 1 | 2.25 | 2.269 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ge3N4 | ICSD | 637157 | P6_3/m (176) | ✔ | 14 | 64 | 3 | 2.2501 | 2.250 | 0.000 | (0;000) | ✗ | 27/01/17 |
RbNaO | ICSD | 61092 | P4/nmm (129) | ✔ | 6 | 48 | 1 | 2.2509 | 2.368 | 0.000 | (0;000) | ✗ | 27/01/17 |
K3TcC4(N2O)2 | ICSD | 260824 | P-1 (2) | ✔ | 14 | 90 | 1 | 2.2512 | 2.257 | 0.000 | (0;000) | ✗ | 02/02/17 |
Rb4CO4 | ICSD | 245439 | I222 (23) | ✗ | 9 | 64 | 3 | 2.2513 | 2.375 | 0.000 | (0;000) | ✗ | 06/10/16 |
SnO2 | ICSD | 56677 | Pa3 (205) | ✔ | 12 | 104 | 3 | 2.2532 | 2.319 | 0.000 | (0;000) | ✗ | 27/01/17 |
KAuF4 | COD | 1510138 | I4/mcm (140) | ✔ | 12 | 96 | 1 | 2.2533 | 2.253 | 0.000 | (0;000) | ✗ | 02/02/17 |
KAu(IO3)4 | ICSD | 417267 | P1 (1) | ✗ | 18 | 120 | 1 | 2.254 | 2.290 | 0.000 | (0;000) | ✗ | 21/03/17 |
Ge2N2O | ICSD | 200849 | Cmc2_1 (36) | ✗ | 10 | 48 | 3 | 2.2545 | 2.593 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaPSe3 | ICSD | 412765 | P2_1/c (14) | ✔ | 20 | 132 | 1 | 2.2546 | 2.255 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2TiO4 | COD | 1517788 | I4/mmm (139) | ✔ | 7 | 56 | 2 | 2.2547 | 2.423 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiGaI3 | COD | 1530097 | P2_1/m (11) | ✔ | 20 | 148 | 1 | 2.2566 | 2.316 | 0.000 | (0;000) | ✗ | 02/02/17 |
Na3AgS2 | COD | 1509476 | Ibam (72) | ✔ | 12 | 100 | 1 | 2.2573 | 2.527 | 0.000 | (0;000) | ✗ | 30/01/17 |
Cd(GaS2)2 | ICSD | 619878 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2573 | 2.260 | 0.000 | (0;000) | ✗ | 06/10/16 |
CsK2PdF5 | ICSD | 72301 | P4/mbm (127) | ✔ | 18 | 160 | 2 | 2.2574 | 2.261 | 0.000 | (0;000) | ✗ | 02/02/17 |
CO2 | ICSD | 110776 | Pnnm (58) | ✔ | 6 | 32 | 1 | 2.2578 | 3.149 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaLiH3 | ICSD | 416463 | Pm-3m (221) | ✔ | 5 | 16 | 1 | 2.2583 | 2.610 | 0.000 | (0;000) | ✗ | 05/01/17 |
ZrSO | ICSD | 31721 | P2_13 (198) | ✗ | 12 | 64 | 3 | 2.2593 | 2.612 | 0.000 | (0;000) | ✗ | 06/10/16 |
K2HgS2 | ICSD | 74500 | Pbcm (57) | ✔ | 20 | 168 | 1 | 2.2608 | 2.261 | 0.000 | (0;000) | ✗ | 02/02/17 |
NaTaO3 | COD | 2002945 | P4/mbm (127) | ✔ | 10 | 80 | 3 | 2.2609 | 2.385 | 0.000 | (0;000) | ✗ | 27/01/17 |
Ga2I3 | ICSD | 24822 | P2_1/c (14) | ✔ | 20 | 188 | 1 | 2.2613 | 2.288 | 0.000 | (0;000) | ✗ | 02/02/17 |
RbTl(SO4)2 | ICSD | 21087 | R32 (155) | ✗ | 12 | 82 | 2 | 2.2618 | 2.284 | 0.000 | (0;000) | ✗ | 15/02/17 |
Cr(OF)2 | COD | 4339750 | P2_1/c (14) | ✔ | 20 | 160 | 2 | 2.262 | 2.278 | 0.000 | (0;000) | ✗ | 07/08/17 |
Cd(GaS2)2 | ICSD | 52801 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2641 | 2.264 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 168810 | R3m (160) | ✗ | 10 | 56 | 2 | 2.2643 | 2.309 | 0.000 | (0;000) | ✗ | 06/10/16 |
CaTeO4 | ICSD | 8097 | Pbcn (60) | ✔ | 24 | 160 | 1 | 2.2643 | 2.264 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbYS2 | COD | 2105804 | R-3m (166) | ✔ | 4 | 32 | 2 | 2.2654 | 2.916 | 0.000 | (0;000) | ✗ | 27/01/17 |
InBrO | ICSD | 24059 | Pmmn (59) | ✔ | 6 | 52 | 2 | 2.2656 | 2.325 | 0.000 | (0;000) | ✗ | 27/01/17 |
ZnPtF6 | ICSD | 37444 | R-3 (148) | ✔ | 8 | 64 | 3 | 2.2658 | 2.266 | 0.000 | (0;000) | ✗ | 27/01/17 |
Na2Tl | COD | 2310211 | C222_1 (20) | ✗ | 24 | 248 | 1 | 2.2658 | 0.018 | 1.000 | (0;000) | ✗ | 07/08/17 |
ZnMoO4 | COD | 2240887 | P2/c (13) | ✔ | 12 | 100 | 3 | 2.2669 | 2.267 | 0.000 | (0;000) | ✗ | 27/01/17 |
BaO | ICSD | 173921 | P6_3/mmc (194) | ✔ | 4 | 32 | 1 | 2.2677 | 2.285 | 0.000 | (0;000) | ✗ | 05/01/17 |
BaNb2V2O11 | ICSD | 165097 | R-3m (166) | ✔ | 16 | 128 | 2 | 2.2681 | 2.270 | 0.000 | (0;000) | ✗ | 02/02/17 |
Zn(GaS2)2 | ICSD | 635305 | I-4 (82) | ✗ | 7 | 62 | 3 | 2.2683 | 2.268 | 0.000 | (0;000) | ✗ | 06/10/16 |
Sr3(BS3)2 | COD | 1510829 | C2/c (15) | ✔ | 22 | 144 | 1 | 2.2685 | 2.290 | 0.000 | (0;000) | ✗ | 07/08/17 |
LiCdBO3 | ICSD | 20191 | P-6 (174) | ✗ | 18 | 108 | 3 | 2.2699 | 2.533 | 0.000 | (0;000) | ✗ | 15/02/17 |
NaTaO3 | ICSD | 28617 | Pm-3m (221) | ✔ | 5 | 40 | 3 | 2.2699 | 2.960 | 0.000 | (0;000) | ✗ | 27/01/17 |
TlBr2 | COD | 1527495 | Pnna (52) | ✔ | 24 | 216 | 1 | 2.2705 | 2.271 | 0.000 | (0;000) | ✗ | 04/08/17 |
LiMoIO6 | ICSD | 156006 | P2_1 (4) | ✗ | 18 | 120 | 2 | 2.2705 | 2.378 | 0.000 | (0;000) | ✗ | 29/03/17 |