▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▴ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
NaFeO2 | COD | 1009034 | Pna2_1 (33) | ✗ | 16 | 116 | 3 | 0.0 | 0.002 | 0.324 | (0;101) | ✔ | 11/04/17 |
FeWO4 | COD | 9000223 | P2/c (13) | ✔ | 12 | 120 | 3 | 0.0 | 0.055 | 0.027 | (0;000) | ✗ | 11/04/17 |
KGa3 | COD | 1523230 | I-4m2 (119) | ✗ | 12 | 144 | 3 | 0.2203 | 0.391 | 0.000 | (0;000) | ✔ | 11/04/17 |
RbGa3 | ICSD | 103943 | I-4m2 (119) | ✗ | 12 | 144 | 3 | 0.2287 | 0.411 | 0.000 | (0;000) | ✔ | 11/04/17 |
GaPt | ICSD | 635132 | P2_13 (198) | ✗ | 8 | 92 | 3 | 0.0 | 0.000 | 0.380 | (0;111) | ✔ | 11/04/17 |
Ge2W | ICSD | 638115 | Pnma (62) | ✔ | 12 | 144 | 3 | 0.0 | 0.031 | 0.172 | (1;000) | ✗ | 11/04/17 |
Ge3W5 | ICSD | 638118 | I4/mcm (140) | ✔ | 16 | 304 | 3 | 0.0 | 0.010 | 0.719 | (0;000) | ✗ | 11/04/17 |
Ge3W5 | ICSD | 638119 | I4/mcm (140) | ✔ | 16 | 304 | 3 | 0.0 | 0.006 | 0.673 | (1;000) | ✗ | 11/04/17 |
Tl2HgGeTe4 | COD | 4000659 | I-42m (121) | ✗ | 8 | 66 | 3 | 0.0 | 0.076 | 0.127 | (0;000) | ✔ | 11/04/17 |
GePt2 | ICSD | 637640 | P-62m (189) | ✗ | 9 | 72 | 3 | 0.0 | 0.000 | 0.334 | (0;000) | ✔ | 11/04/17 |
Hg2WO4 | ICSD | 90085 | C2/c (15) | ✔ | 14 | 152 | 3 | 2.0554 | 2.398 | 0.000 | (0;000) | ✗ | 11/04/17 |
Ti3AlC2 | COD | 7221324 | P6_3/mmc (194) | ✔ | 12 | 94 | 3 | 0.0 | 0.000 | 0.995 | (1;000) | ✗ | 27/01/17 |
Ni3GeC | ICSD | 77001 | Pm-3m (221) | ✔ | 5 | 38 | 3 | 0.0 | 0.016 | 0.341 | (0;111) | ✗ | 27/01/17 |
Ni4W | ICSD | 105452 | I4/m (87) | ✔ | 5 | 54 | 3 | 0.0 | 0.023 | 0.698 | (1;000) | ✗ | 06/10/16 |
RbIn(WO4)2 | ICSD | 24859 | P-3m1 (164) | ✔ | 12 | 126 | 3 | 3.1873 | 3.221 | 0.000 | (0;000) | ✗ | 11/04/17 |
CdTe | ICSD | 108238 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.528 | 0.528 | 0.000 | (0;000) | ✗ | 06/10/16 |
Ir3W | COD | 1523682 | P6_3/mmc (194) | ✔ | 8 | 158 | 3 | 0.0 | 0.000 | 0.976 | (1;000) | ✗ | 11/04/17 |
MnInNi2 | ICSD | 639954 | Fm-3m (225) | ✔ | 4 | 48 | 3 | 0.0 | 0.000 | 0.630 | (0;000) | ✗ | 27/01/17 |
LiVCuO4 | ICSD | 290739 | Imma (74) | ✔ | 14 | 102 | 3 | 0.0 | 0.001 | 0.627 | (1;100) | ✗ | 27/01/17 |
Ti4O5 | ICSD | 174033 | I4/m (87) | ✔ | 9 | 78 | 3 | 0.0 | 0.003 | 0.821 | (1;111) | ✗ | 06/10/16 |
KCuSe | COD | 7221372 | P6_3/mmc (194) | ✔ | 6 | 52 | 3 | 0.242 | 0.242 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg3In | ICSD | 639928 | P6_3/mmc (194) | ✔ | 8 | 86 | 3 | 0.0 | 0.000 | 0.635 | (0;000) | ✗ | 27/01/17 |
MnWO4 | COD | 9013910 | P2/c (13) | ✔ | 12 | 134 | 3 | 0.0 | 0.000 | 0.730 | (1;100) | ✗ | 11/04/17 |
Be(B6C)2 | ICSD | 612548 | R-3m (166) | ✔ | 15 | 48 | 3 | 0.0 | 0.000 | 0.279 | (1;000) | ✗ | 27/01/17 |
Na2W4O13 | ICSD | 6141 | P-1 (2) | ✔ | 19 | 208 | 3 | 2.5331 | 2.834 | 0.000 | (0;000) | ✗ | 11/04/17 |
TaCuN2 | ICSD | 190938 | R-3m (166) | ✔ | 4 | 34 | 3 | 0.0 | 0.088 | 0.607 | (1;111) | ✗ | 27/01/17 |
NiWO4 | COD | 2310619 | P2/c (13) | ✔ | 12 | 124 | 3 | 0.0 | 0.037 | 0.108 | (1;000) | ✗ | 11/04/17 |
NiP2W | ICSD | 646178 | P6_3/mmc (194) | ✔ | 8 | 96 | 3 | 0.0 | 0.005 | 0.299 | (1;000) | ✗ | 11/04/17 |
NiP3W2 | ICSD | 41818 | C2/m (12) | ✔ | 12 | 162 | 3 | 0.0 | 0.036 | 0.478 | (1;001) | ✗ | 11/04/17 |
SiNi | COD | 2300376 | P2_13 (198) | ✗ | 8 | 56 | 3 | 0.0 | 0.000 | 0.360 | (1;000) | ✔ | 11/04/17 |
NaInO2 | ICSD | 31932 | R-3m (166) | ✔ | 4 | 34 | 3 | 0.5146 | 0.664 | 0.000 | (0;000) | ✗ | 27/01/17 |
IrS2 | ICSD | 640949 | Pa3 (205) | ✔ | 12 | 116 | 3 | 0.0 | 0.000 | 0.528 | (1;111) | ✗ | 27/01/17 |
CuMoO4 | ICSD | 39439 | P-1 (2) | ✔ | 12 | 98 | 3 | 0.0 | 0.027 | 0.324 | (0;110) | ✗ | 27/01/17 |
Zr3Te | ICSD | 81539 | I-4 (82) | ✗ | 16 | 72 | 3 | 0.0 | 0.005 | 0.568 | ? | ✗ | 29/03/17 |
WO3 | COD | 1010618 | P2_1/m (11) | ✔ | 16 | 184 | 3 | 0.0 | 0.005 | 0.532 | (0;001) | ✗ | 11/04/17 |
WO3 | ICSD | 86144 | P-42_1m (113) | ✗ | 16 | 184 | 3 | 0.7896 | 0.923 | 0.000 | (0;000) | ✗ | 11/04/17 |
WO3 | COD | 1521532 | P4/ncc (130) | ✔ | 16 | 184 | 3 | 0.7681 | 0.769 | 0.000 | (0;000) | ✗ | 11/04/17 |
WO3 | COD | 1521533 | P4/nmm (129) | ✔ | 8 | 92 | 3 | 0.5769 | 0.585 | 0.000 | (0;000) | ✗ | 11/04/17 |
LiCuO | ICSD | 40156 | I4/mmm (139) | ✔ | 12 | 80 | 3 | 1.5296 | 1.711 | 0.000 | (0;000) | ✗ | 27/01/17 |
Mg(BC)2 | ICSD | 421839 | Pnnm (58) | ✔ | 10 | 48 | 3 | 1.1081 | 1.531 | 0.000 | (0;000) | ✗ | 27/01/17 |
MnInPd2 | ICSD | 51988 | Fm-3m (225) | ✔ | 4 | 64 | 3 | 0.0 | 0.000 | 0.584 | (1;000) | ✗ | 27/01/17 |
Tl2WO4 | ICSD | 8212 | P-3m1 (164) | ✔ | 14 | 156 | 3 | 2.8141 | 2.944 | 0.000 | (0;000) | ✗ | 11/04/17 |
ZnWO4 | COD | 2101675 | P2/c (13) | ✔ | 12 | 128 | 3 | 2.9526 | 2.975 | 0.000 | (0;000) | ✗ | 11/04/17 |
ZnWO4 | COD | 2101686 | P-1 (2) | ✔ | 12 | 128 | 3 | 2.6316 | 2.818 | 0.000 | (0;000) | ✗ | 11/04/17 |
Pb2WO5 | ICSD | 61399 | C2/m (12) | ✔ | 16 | 172 | 3 | 1.4939 | 1.542 | 0.000 | (0;000) | ✗ | 11/04/17 |
Sb2WO6 | ICSD | 75595 | P1 (1) | ✗ | 18 | 148 | 3 | 0.0 | 1.132 | 1.000 | ? | ✗ | 11/04/17 |
W3O8 | COD | 2101049 | C222 (21) | ✗ | 11 | 132 | 3 | 0.0 | 0.000 | 0.791 | ? | ✗ | 11/04/17 |
W3O | ICSD | 150496 | Pm-3n (223) | ✔ | 8 | 180 | 3 | 0.0 | 0.007 | 0.611 | (1;000) | ✗ | 11/04/17 |
Zr3O | ICSD | 23402 | R32 (155) | ✗ | 16 | 72 | 3 | 0.0 | 0.000 | 0.299 | (0;111) | ✔ | 11/04/17 |
PW3 | ICSD | 648282 | I-4 (82) | ✗ | 16 | 356 | 3 | 0.0 | 0.006 | 0.668 | ? | ✗ | 11/04/17 |
RbSbSe2 | ICSD | 602244 | P1 (1) | ✗ | 16 | 104 | 3 | 0.0 | 0.017 | 0.026 | (0;101) | ✔ | 11/04/17 |
Sc(BC)2 | ICSD | 23834 | Pbam (55) | ✔ | 20 | 100 | 3 | 0.0 | 0.010 | 0.583 | (1;000) | ✗ | 27/01/17 |
Y(BC)2 | ICSD | 427155 | P4/mbm (127) | ✔ | 10 | 50 | 3 | 0.0 | 0.000 | 0.546 | (0;000) | ✗ | 27/01/17 |
NaIn | ICSD | 640032 | Fd-3m (227) | ✔ | 4 | 44 | 3 | 0.0 | 0.000 | 0.390 | (0;000) | ✗ | 27/01/17 |
MnCuP | ICSD | 72411 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.293 | (1;011) | ✗ | 27/01/17 |
TlSbSe2 | ICSD | 36537 | P2_1 (4) | ✗ | 16 | 120 | 3 | 0.475 | 0.475 | 0.000 | (0;000) | ✔ | 11/04/17 |
Y(BC)2 | ICSD | 612672 | P4_2/mmc (131) | ✔ | 10 | 50 | 3 | 0.0 | 0.000 | 0.731 | (0;101) | ✗ | 27/01/17 |
Si3W5 | ICSD | 73331 | I4/mcm (140) | ✔ | 16 | 304 | 3 | 0.0 | 0.005 | 0.690 | (1;000) | ✗ | 11/04/17 |
TiSi | ICSD | 166580 | Pmm2 (25) | ✗ | 8 | 64 | 3 | 0.0 | 0.005 | 0.387 | (0;000) | ✔ | 11/04/17 |
Zr3W5 | ICSD | 653434 | I4/mcm (140) | ✔ | 16 | 304 | 3 | 0.0 | 0.000 | 0.548 | (1;000) | ✗ | 11/04/17 |
AgAsSe | ICSD | 604753 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.017 | 0.318 | (0;000) | ✔ | 13/04/17 |
In5AgSe8 | COD | 1509418 | P-42m (111) | ✗ | 14 | 124 | 3 | 0.2057 | 0.231 | 0.000 | (0;000) | ✔ | 13/04/17 |
ScAgSn | COD | 4307156 | P-62m (189) | ✗ | 9 | 108 | 3 | 0.0 | 0.000 | 0.237 | (0;000) | ✔ | 13/04/17 |
MgCuP | ICSD | 8221 | Pnma (62) | ✔ | 12 | 104 | 3 | 0.0 | 0.480 | 0.019 | (0;000) | ✗ | 27/01/17 |
BaSi2 | ICSD | 2218 | P4_332 (212) | ✗ | 12 | 72 | 3 | 0.0 | 0.008 | 0.016 | (0;000) | ✔ | 13/04/17 |
InMoS2 | ICSD | 603787 | P6_3/mmc (194) | ✔ | 8 | 78 | 3 | 0.0 | 0.000 | 0.779 | (0;000) | ✗ | 27/01/17 |
Bi2PdO4 | COD | 2002219 | I4cm (108) | ✗ | 14 | 144 | 3 | 0.0 | 0.002 | 0.167 | (0;000) | ✔ | 13/04/17 |
BiIrSe | ICSD | 616741 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.4071 | 0.913 | 0.000 | (0;000) | ✔ | 13/04/17 |
Ag2SnHgSe4 | ICSD | 95094 | Pmn2_1 (31) | ✗ | 16 | 144 | 3 | 0.0 | 0.042 | 0.026 | (1;000) | ✔ | 24/04/17 |
MnCuO2 | COD | 9011834 | C2/m (12) | ✔ | 4 | 38 | 3 | 0.0 | 0.040 | 0.274 | (0;000) | ✗ | 27/01/17 |
BiRhS | ICSD | 617013 | P2_13 (198) | ✗ | 12 | 152 | 3 | 0.2752 | 0.801 | 0.000 | (0;000) | ✔ | 24/04/17 |
Al5C3N | COD | 2310415 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.0 | 0.726 | 0.092 | (0;000) | ✔ | 24/04/17 |
Cr4InCuSe8 | ICSD | 250246 | F-43m (216) | ✗ | 14 | 128 | 3 | 0.0 | 0.001 | 0.263 | (0;001) | ✔ | 24/04/17 |
CsSO3 | COD | 9015381 | P-62c (190) | ✗ | 20 | 132 | 3 | 0.0 | 0.025 | 0.071 | (0;000) | ✔ | 24/04/17 |
Cu3PSe4 | COD | 1531879 | Pmn2_1 (31) | ✗ | 16 | 124 | 3 | 0.2365 | 0.237 | 0.000 | (0;000) | ✔ | 24/04/17 |
Ge3Ru2 | ICSD | 95589 | P-4c2 (116) | ✗ | 20 | 176 | 3 | 0.3075 | 0.314 | 0.000 | (0;000) | ✔ | 24/04/17 |
W3O10 | COD | 9014468 | Fmm2 (42) | ✗ | 13 | 144 | 3 | 0.0 | 0.002 | 0.261 | (0;010) | ✔ | 24/04/17 |
SiPd2 | ICSD | 648857 | P-62m (189) | ✗ | 9 | 120 | 3 | 0.0 | 0.000 | 0.277 | (1;000) | ✔ | 24/04/17 |
Rb(TeMo)3 | ICSD | 604499 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.266 | (0;000) | ✗ | 24/04/17 |
Na(TeMo)3 | ICSD | 604501 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.308 | (0;000) | ✗ | 24/04/17 |
In(TeMo)3 | ICSD | 53100 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.299 | (0;000) | ✗ | 24/04/17 |
In(TeMo)3 | ICSD | 640025 | P6_3/m (176) | ✔ | 14 | 146 | 3 | 0.0 | 0.000 | 0.527 | (1;000) | ✗ | 24/04/17 |
Mn2CuO4 | COD | 1530385 | Fd-3m (227) | ✔ | 14 | 130 | 3 | 0.0 | 0.000 | 0.868 | (0;000) | ✗ | 27/01/17 |
K(MoS)3 | ICSD | 641249 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.286 | (0;000) | ✗ | 24/04/17 |
K(MoSe)3 | ICSD | 604517 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.294 | (0;000) | ✗ | 24/04/17 |
K(TeMo)3 | ICSD | 603671 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.307 | (0;000) | ✗ | 24/04/17 |
Na(MoSe)3 | ICSD | 643974 | P6_3/m (176) | ✔ | 14 | 138 | 3 | 0.0 | 0.000 | 0.320 | (0;000) | ✗ | 24/04/17 |
ZnAg2GeO4 | ICSD | 81328 | Pc (7) | ✗ | 16 | 124 | 3 | 0.0 | 0.152 | 0.012 | (0;000) | ✔ | 26/04/17 |
Ag3AsO4 | COD | 1510036 | P-43n (218) | ✗ | 16 | 124 | 3 | 0.068 | 0.150 | 0.000 | (0;000) | ✔ | 26/04/17 |
Ag3PO4 | COD | 1010324 | P-43n (218) | ✗ | 16 | 124 | 3 | 0.0 | 0.108 | 0.029 | (0;000) | ✔ | 26/04/17 |
Ag8S | COD | 2105382 | Imm2 (44) | ✗ | 9 | 94 | 3 | 0.0 | 0.003 | 0.259 | (1;100) | ✔ | 26/04/17 |
AgAsS | ICSD | 604740 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.029 | 0.147 | (1;000) | ✔ | 26/04/17 |
Al4Cu2O7 | COD | 2002328 | F-43m (216) | ✗ | 13 | 76 | 3 | 0.0 | 0.000 | 0.247 | (1;000) | ✔ | 26/04/17 |
Ba(GeAs)2 | COD | 2101579 | P4_2mc (105) | ✗ | 20 | 112 | 3 | 0.034 | 0.116 | 0.000 | (0;000) | ✔ | 26/04/17 |
BaAsPt | ICSD | 59192 | P2_13 (198) | ✗ | 12 | 100 | 3 | 0.0 | 0.000 | 0.396 | (0;111) | ✔ | 26/04/17 |
CuTeAs | ICSD | 610367 | Pna2_1 (33) | ✗ | 12 | 88 | 3 | 0.0 | 0.014 | 0.239 | (0;000) | ✔ | 26/04/17 |
Te2Au | COD | 9011456 | Pc (7) | ✗ | 12 | 92 | 3 | 0.0 | 0.134 | 0.109 | (0;000) | ✔ | 26/04/17 |
Ba2In2O5 | COD | 1522063 | Ima2 (46) | ✗ | 18 | 152 | 3 | 0.0 | 0.007 | 0.243 | (0;111) | ✔ | 26/04/17 |
InN | ICSD | 41501 | Fm-3m (225) | ✔ | 2 | 18 | 3 | 0.5638 | 1.567 | 0.000 | (0;000) | ✗ | 27/01/17 |
Al5C3N | COD | 1010635 | P6_3mc (186) | ✗ | 18 | 64 | 3 | 0.176 | 1.164 | 0.000 | (0;000) | ✔ | 26/04/17 |