▹ Formula | ▴ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TaSe2 | COD | 1521538 | P6_3/mmc (194) | ✔ | 12 | 100 | 2 | 0.0 | 0.013 | 0.869 | (0;000) | ✗ | 02/02/17 |
RuSe2 | COD | 9012406 | Pa3 (205) | ✔ | 12 | 112 | 3 | 0.4043 | 0.707 | 0.000 | (0;000) | ✗ | 02/02/17 |
TlRe | COD | 9015220 | Imma (74) | ✔ | 4 | 56 | 1 | 0.0 | 0.002 | 0.224 | (0;000) | ✗ | 02/02/17 |
Sn7Ru3 | COD | 2200583 | Im-3m (229) | ✔ | 20 | 292 | 3 | 0.0 | 0.000 | 0.394 | (1;111) | ✗ | 02/02/17 |
ZnSb | COD | 9008882 | Pbca (61) | ✔ | 16 | 136 | 3 | 0.0 | 0.431 | 0.011 | (0;000) | ✗ | 02/02/17 |
ZrSnS3 | COD | 2001131 | Pnma (62) | ✔ | 20 | 144 | 2 | 0.8146 | 0.816 | 0.000 | (0;000) | ✗ | 02/02/17 |
Sr2Sb | COD | 9008353 | I4/mmm (139) | ✔ | 6 | 50 | 1 | 0.0 | 0.013 | 0.055 | (0;111) | ✗ | 02/02/17 |
CO2 | COD | 9015590 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 5.8337 | 5.985 | 0.000 | (0;000) | ✗ | 15/02/17 |
Li2InAu | COD | 1510190 | F-43m (216) | ✗ | 4 | 30 | 3 | 0.0 | 0.000 | 0.860 | ? | ✗ | 15/02/17 |
FeAgS2 | COD | 1509337 | I-42d (122) | ✗ | 8 | 62 | 3 | 0.0 | 0.000 | 0.737 | ? | ✗ | 15/02/17 |
Sr2Sn | COD | 1528200 | Pnma (62) | ✔ | 12 | 136 | 1 | 0.1881 | 0.188 | 0.000 | (0;000) | ✗ | 02/02/17 |
VSn2 | COD | 1528218 | Fddd (70) | ✔ | 12 | 164 | 3 | 0.0 | 0.010 | 0.598 | (1;111) | ✗ | 02/02/17 |
SrSn4 | COD | 4312755 | Cmcm (63) | ✔ | 10 | 132 | 3 | 0.0 | 0.023 | 0.533 | (1;110) | ✗ | 02/02/17 |
AgClO4 | COD | 1010574 | F-43m (216) | ✗ | 6 | 42 | 1 | 2.4263 | 2.431 | 0.000 | (0;000) | ✗ | 15/02/17 |
YZn3 | COD | 2106397 | Pnma (62) | ✔ | 16 | 188 | 3 | 0.0 | 0.000 | 0.763 | (1;011) | ✗ | 02/02/17 |
CdAgSb | COD | 1509176 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.392 | (0;000) | ✔ | 15/02/17 |
Li2GaAu | COD | 1510151 | F-43m (216) | ✗ | 4 | 30 | 3 | 0.0 | 0.116 | 0.858 | ? | ✗ | 15/02/17 |
KAlSiO6 | COD | 9009725 | P6_3 (173) | ✗ | 18 | 104 | 3 | 0.0 | 0.041 | 0.008 | (0;000) | ✔ | 15/02/17 |
Li2AgSb | COD | 1509445 | F-43m (216) | ✗ | 4 | 22 | 3 | 0.0583 | 0.058 | 0.000 | (0;000) | ✔ | 15/02/17 |
AlHO2 | COD | 2211226 | Pmn2_1 (31) | ✗ | 8 | 32 | 3 | 5.4848 | 5.593 | 0.000 | (0;000) | ✗ | 15/02/17 |
CdSbAu | COD | 1510079 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.356 | (0;000) | ✔ | 15/02/17 |
LiAlTe2 | COD | 4321120 | P3m1 (156) | ✗ | 4 | 18 | 1 | 0.0 | 0.021 | 0.162 | (0;000) | ✔ | 15/02/17 |
CaSnAu | COD | 2019618 | Imm2 (44) | ✗ | 6 | 70 | 3 | 0.0 | 0.035 | 0.553 | ? | ✗ | 15/02/17 |
CO2 | COD | 9014868 | P3_221 (154) | ✗ | 9 | 48 | 3 | 6.8671 | 7.441 | 0.000 | (0;000) | ✗ | 15/02/17 |
H4C9OF4 | COD | 7204880 | P1 (1) | ✗ | 18 | 74 | 1 | 3.4283 | 3.555 | 0.000 | (0;000) | ✗ | 15/02/17 |
BH6N | COD | 4116439 | Pmn2_1 (31) | ✗ | 16 | 28 | 1 | 5.5448 | 5.545 | 0.000 | (0;000) | ✗ | 15/02/17 |
BaCa(GaO2)4 | COD | 2008101 | Imm2 (44) | ✗ | 14 | 120 | 3 | 3.2657 | 3.266 | 0.000 | (0;000) | ✗ | 15/02/17 |
RbBH4 | COD | 4315655 | I-42m (121) | ✗ | 12 | 32 | 1 | 5.4855 | 5.531 | 0.000 | (0;000) | ✗ | 15/02/17 |
LiH5C5N2O5 | COD | 2200233 | P1 (1) | ✗ | 18 | 68 | 1 | 2.9567 | 3.022 | 0.000 | (0;000) | ✗ | 15/02/17 |
H3C2N | COD | 1504384 | Cmc2_1 (36) | ✗ | 12 | 32 | 1 | 7.2799 | 7.387 | 0.000 | (0;000) | ✗ | 15/02/17 |
H3C5I2N | COD | 2012993 | Fmm2 (42) | ✗ | 11 | 42 | 1 | 3.0403 | 3.220 | 0.000 | (0;000) | ✗ | 15/02/17 |
NaCNO | COD | 1010310 | R3m (160) | ✗ | 4 | 24 | 1 | 4.1504 | 4.294 | 0.000 | (0;000) | ✗ | 15/02/17 |
H4CN2O | COD | 1008785 | P-42_1m (113) | ✗ | 16 | 48 | 1 | 5.1508 | 5.151 | 0.000 | (0;000) | ✗ | 15/02/17 |
CdClO | COD | 9016472 | P6_3mc (186) | ✗ | 6 | 50 | 2 | 0.0 | 0.000 | 0.749 | ? | ✗ | 15/02/17 |
H2CN4 | COD | 2006099 | P1 (1) | ✗ | 7 | 26 | 1 | 4.8806 | 5.045 | 0.000 | (0;000) | ✗ | 15/02/17 |
TlClO4 | COD | 1010570 | F-43m (216) | ✗ | 6 | 44 | 1 | 1.3448 | 1.345 | 0.000 | (0;000) | ✗ | 15/02/17 |
HCl | COD | 9016437 | Cmc2_1 (36) | ✗ | 4 | 16 | 1 | 5.8258 | 5.826 | 0.000 | (0;000) | ✗ | 15/02/17 |
RbClO4 | COD | 1010571 | F-43m (216) | ✗ | 6 | 40 | 1 | 1.1696 | 1.170 | 0.000 | (0;000) | ✗ | 15/02/17 |
Sc3B2Rh5 | COD | 1510816 | P4/mbm (127) | ✔ | 20 | 248 | 3 | 0.0 | 0.002 | 0.496 | (1;000) | ✗ | 21/03/17 |
CS2 | COD | 9015270 | P3_221 (154) | ✗ | 9 | 48 | 3 | 0.0 | 0.007 | 0.167 | (0;000) | ✔ | 15/03/17 |
KNaSO4 | COD | 9007638 | P3m1 (156) | ✗ | 14 | 96 | 1 | 5.0638 | 5.136 | 0.000 | (0;000) | ✗ | 15/02/17 |
Na3SO4F | COD | 9000296 | R3m (160) | ✗ | 9 | 64 | 3 | 3.735 | 3.735 | 0.000 | (0;000) | ✗ | 15/02/17 |
HfCuP | COD | 4031203 | P3m1 (156) | ✗ | 3 | 28 | 3 | 0.0 | 0.001 | 0.057 | (1;100) | ✔ | 15/02/17 |
FeCu2SnS4 | COD | 1011151 | I-42m (121) | ✗ | 8 | 68 | 3 | 0.0 | 0.001 | 0.361 | (1;111) | ✔ | 15/02/17 |
Hf2CuSb3 | COD | 1526691 | P-4m2 (115) | ✗ | 6 | 50 | 3 | 0.0 | 0.003 | 0.820 | ? | ✗ | 15/02/17 |
H4NF | COD | 2106401 | P6_3mc (186) | ✗ | 12 | 32 | 1 | 5.8885 | 5.974 | 0.000 | (0;000) | ✗ | 15/02/17 |
RhF3 | COD | 1010417 | P321 (150) | ✗ | 12 | 114 | 2 | 0.0331 | 0.052 | 0.000 | (0;000) | ✔ | 15/02/17 |
TiFeSn | COD | 1527700 | F-43m (216) | ✗ | 3 | 34 | 3 | 0.0 | 0.000 | 0.622 | ? | ✗ | 15/02/17 |
MnSnIr | COD | 1522487 | F-43m (216) | ✗ | 3 | 46 | 3 | 0.0 | 0.000 | 0.947 | ? | ✗ | 15/02/17 |
Li2ZnGe | COD | 1528672 | F-43m (216) | ✗ | 4 | 22 | 3 | 0.0 | 0.419 | 0.069 | (0;000) | ✔ | 15/02/17 |