▹ Formula | ▹ Source | ▹ ID | ▴ space group | ▹ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sb2S3 | COD | 9007243 | Pnma (62) | ✔ | 20 | 112 | 2 | 1.0863 | 1.086 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrPbS3 | ICSD | 2439 | Pnma (62) | ✔ | 20 | 144 | 3 | 0.958 | 0.958 | 0.000 | (0;000) | ✗ | 02/02/17 |
ZrNbP | ICSD | 75008 | Pnma (62) | ✔ | 12 | 88 | 3 | 0.0 | 0.003 | 0.244 | (1;000) | ✗ | 02/02/17 |
SrOsO3 | ICSD | 237732 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.0 | 0.006 | 0.582 | (0;000) | ✗ | 02/02/17 |
SrSnPt | ICSD | 412012 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.061 | 0.369 | (1;000) | ✗ | 02/02/17 |
SrSnS3 | ICSD | 651032 | Pnma (62) | ✔ | 20 | 168 | 2 | 1.0794 | 1.289 | 0.000 | (0;000) | ✗ | 02/02/17 |
Y2S3 | ICSD | 651407 | Pnma (62) | ✔ | 20 | 160 | 3 | 0.7809 | 0.781 | 0.000 | (0;000) | ✗ | 02/02/17 |
TaNi2TeSe | ICSD | 86174 | Pnma (62) | ✔ | 20 | 180 | 2 | 0.0 | 0.001 | 0.907 | (0;011) | ✗ | 02/02/17 |
NaClO4 | COD | 2209646 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.9383 | 4.968 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsSnI3 | COD | 4117956 | Pnma (62) | ✔ | 20 | 176 | 2 | 1.8777 | 1.938 | 0.000 | (0;000) | ✗ | 22/03/17 |
LiClO4 | COD | 4313930 | Pnma (62) | ✔ | 24 | 136 | 1 | 6.3338 | 6.366 | 0.000 | (0;000) | ✗ | 04/08/17 |
KClO4 | COD | 9011079 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.1057 | 6.136 | 0.000 | (0;000) | ✗ | 04/08/17 |
KClO4 | COD | 1010611 | Pnma (62) | ✔ | 24 | 160 | 1 | 0.0 | 0.022 | 0.014 | (0;000) | ✗ | 04/08/17 |
Rb2CO3 | ICSD | 414122 | Pnma (62) | ✔ | 24 | 160 | 1 | 3.1677 | 3.168 | 0.000 | (0;000) | ✗ | 04/08/17 |
CoBW | COD | 1511056 | Pnma (62) | ✔ | 12 | 136 | 3 | 1.5852 | 0.022 | 1.000 | (0;000) | ✗ | 21/03/17 |
K3CoO2 | ICSD | 73212 | Pnma (62) | ✔ | 24 | 224 | 1 | 0.0 | 0.009 | 0.038 | (0;000) | ✗ | 04/08/17 |
CsSnI3 | ICSD | 69996 | Pnma (62) | ✔ | 20 | 176 | 3 | 0.219 | 0.219 | 0.000 | (0;000) | ✗ | 22/03/17 |
Co3B | COD | 1511066 | Pnma (62) | ✔ | 16 | 216 | 3 | 0.0 | 0.018 | 0.208 | (1;000) | ✗ | 21/03/17 |
CsPbI3 | COD | 4335639 | Pnma (62) | ✔ | 20 | 176 | 2 | 1.8656 | 1.893 | 0.000 | (0;000) | ✗ | 22/03/17 |
Rb3CoO2 | COD | 1532295 | Pnma (62) | ✔ | 24 | 224 | 1 | 0.0 | 0.003 | 0.119 | (1;000) | ✗ | 04/08/17 |
CoPO4 | COD | 1529153 | Pnma (62) | ✔ | 24 | 184 | 3 | 0.0 | 0.061 | 0.041 | (0;000) | ✗ | 04/08/17 |
CoSeO4 | ICSD | 25699 | Pnma (62) | ✔ | 24 | 188 | 3 | 0.0 | 0.000 | 0.436 | (0;101) | ✗ | 04/08/17 |
CsClO4 | ICSD | 63364 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.149 | 6.169 | 0.000 | (0;000) | ✗ | 04/08/17 |
MnBiS2Cl | ICSD | 172156 | Pnma (62) | ✔ | 20 | 196 | 3 | 0.0 | 0.000 | 0.355 | (1;011) | ✗ | 21/03/17 |
CrPbO4 | COD | 9009515 | Pnma (62) | ✔ | 24 | 208 | 3 | 2.2197 | 2.237 | 0.000 | (0;000) | ✗ | 04/08/17 |
Cs2Sb | COD | 1526333 | Pnma (62) | ✔ | 24 | 184 | 3 | 0.3786 | 0.493 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsIO4 | COD | 1521182 | Pnma (62) | ✔ | 24 | 160 | 1 | 3.2435 | 3.254 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsMnO4 | COD | 1521181 | Pnma (62) | ✔ | 24 | 192 | 1 | 2.339 | 2.372 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsReO4 | ICSD | 74505 | Pnma (62) | ✔ | 24 | 192 | 1 | 4.7175 | 4.738 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbCu2I3 | ICSD | 150307 | Pnma (62) | ✔ | 24 | 208 | 1 | 1.9039 | 1.904 | 0.000 | (0;000) | ✗ | 04/08/17 |
YWC2 | ICSD | 619103 | Pnma (62) | ✔ | 16 | 188 | 3 | 0.0 | 0.000 | 0.538 | (0;011) | ✗ | 11/04/17 |
TlGaCl4 | ICSD | 419825 | Pnma (62) | ✔ | 24 | 216 | 1 | 4.2125 | 4.236 | 0.000 | (0;000) | ✗ | 04/08/17 |
RbGaCl4 | COD | 8100813 | Pnma (62) | ✔ | 24 | 200 | 1 | 4.7981 | 4.798 | 0.000 | (0;000) | ✗ | 04/08/17 |
Fe2CuS3 | COD | 9000065 | Pnma (62) | ✔ | 24 | 180 | 3 | 0.0 | 0.000 | 0.457 | (1;110) | ✗ | 04/08/17 |
Fe2CuS3 | ICSD | 159383 | Pnma (62) | ✔ | 24 | 180 | 3 | 0.0 | 0.000 | 0.594 | (1;110) | ✗ | 04/08/17 |
CuSO4 | COD | 9009830 | Pnma (62) | ✔ | 24 | 164 | 3 | 0.0 | 0.000 | 0.272 | (0;101) | ✗ | 04/08/17 |
CuSeO4 | ICSD | 109069 | Pnma (62) | ✔ | 24 | 164 | 3 | 0.0 | 0.000 | 0.314 | (0;101) | ✗ | 04/08/17 |
RbFeCl4 | COD | 4030154 | Pnma (62) | ✔ | 24 | 180 | 1 | 0.0 | 0.000 | 0.746 | (1;011) | ✗ | 04/08/17 |
FeBW | ICSD | 614256 | Pnma (62) | ✔ | 12 | 156 | 3 | 0.0 | 0.001 | 0.589 | (0;011) | ✗ | 11/04/17 |
Ge2W | ICSD | 638115 | Pnma (62) | ✔ | 12 | 144 | 3 | 0.0 | 0.031 | 0.172 | (1;000) | ✗ | 11/04/17 |
MnTlCl3 | ICSD | 32712 | Pnma (62) | ✔ | 20 | 196 | 1 | 0.0 | 0.001 | 0.161 | (0;011) | ✗ | 22/03/17 |
CsGaCl4 | COD | 7221990 | Pnma (62) | ✔ | 24 | 200 | 1 | 4.7858 | 4.786 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsFeCl4 | COD | 1527810 | Pnma (62) | ✔ | 24 | 180 | 1 | 0.0 | 0.000 | 0.545 | (1;011) | ✗ | 04/08/17 |
Rb2CuCl3 | ICSD | 150294 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.0085 | 2.009 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2CuCl3 | ICSD | 150292 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.0536 | 2.054 | 0.000 | (0;000) | ✗ | 04/08/17 |
ScCrO3 | ICSD | 85141 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.000 | 0.480 | (0;110) | ✗ | 22/03/17 |
Fe2C | COD | 9014589 | Pnma (62) | ✔ | 24 | 160 | 3 | 0.0 | 0.010 | 0.343 | (0;000) | ✗ | 04/08/17 |
FePO4 | COD | 1525576 | Pnma (62) | ✔ | 24 | 148 | 3 | 0.0 | 0.000 | 0.432 | (1;101) | ✗ | 04/08/17 |
FePO4 | ICSD | 290337 | Pnma (62) | ✔ | 24 | 148 | 3 | 0.0 | 0.001 | 0.184 | (1;011) | ✗ | 04/08/17 |
FeSO4 | COD | 2216658 | Pnma (62) | ✔ | 24 | 152 | 3 | 0.1406 | 0.141 | 0.000 | (0;000) | ✗ | 04/08/17 |
TiCoP | ICSD | 624646 | Pnma (62) | ✔ | 12 | 136 | 3 | 0.0 | 0.022 | 0.099 | (1;000) | ✗ | 22/03/17 |
KGaSb4 | ICSD | 300158 | Pnma (62) | ✔ | 24 | 168 | 3 | 0.2385 | 0.239 | 0.000 | (0;000) | ✗ | 04/08/17 |
MnGe2Pd3 | ICSD | 637060 | Pnma (62) | ✔ | 24 | 308 | 3 | 0.0 | 0.000 | 0.837 | (1;011) | ✗ | 04/08/17 |
ScCoP | ICSD | 624621 | Pnma (62) | ✔ | 12 | 132 | 3 | 0.0 | 0.000 | 0.511 | (0;011) | ✗ | 22/03/17 |
SrGe2 | ICSD | 152799 | Pnma (62) | ✔ | 24 | 144 | 1 | 0.3597 | 0.594 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaSO4 | COD | 9003569 | Pnma (62) | ✔ | 24 | 160 | 1 | 6.7502 | 6.838 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca5Ir | ICSD | 156887 | Pnma (62) | ✔ | 24 | 268 | 1 | 0.0 | 0.000 | 0.625 | (1;110) | ✗ | 04/08/17 |
Cr3C2 | ICSD | 653958 | Pnma (62) | ✔ | 20 | 200 | 3 | 0.0 | 0.004 | 0.700 | (1;000) | ✗ | 21/03/17 |
Cr3C2 | COD | 9009906 | Pnma (62) | ✔ | 20 | 200 | 3 | 0.0 | 0.003 | 0.794 | (0;000) | ✗ | 21/03/17 |
CsAlBr4 | ICSD | 83435 | Pnma (62) | ✔ | 24 | 160 | 1 | 4.4615 | 4.462 | 0.000 | (0;000) | ✗ | 04/08/17 |
InPO4 | ICSD | 85579 | Pnma (62) | ✔ | 24 | 168 | 3 | 3.2206 | 3.365 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca3Au | COD | 1510066 | Pnma (62) | ✔ | 16 | 164 | 1 | 0.0 | 0.002 | 0.531 | (0;110) | ✗ | 21/03/17 |
IrS2 | ICSD | 640950 | Pnma (62) | ✔ | 24 | 232 | 3 | 0.5893 | 0.707 | 0.000 | (0;000) | ✗ | 04/08/17 |
IrSe2 | COD | 9009096 | Pnma (62) | ✔ | 24 | 232 | 3 | 0.1504 | 0.467 | 0.000 | (0;000) | ✗ | 04/08/17 |
Te2Ir | COD | 1526502 | Pnma (62) | ✔ | 24 | 232 | 3 | 0.0 | 0.302 | 0.247 | (0;000) | ✗ | 04/08/17 |
Te2I | COD | 1527658 | Pnma (62) | ✔ | 24 | 152 | 1 | 0.0653 | 0.065 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2PbO3 | ICSD | 62138 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.5548 | 1.558 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2SnO3 | COD | 1527400 | Pnma (62) | ✔ | 24 | 200 | 1 | 2.3069 | 2.307 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2SnO3 | ICSD | 24131 | Pnma (62) | ✔ | 24 | 200 | 2 | 1.6375 | 1.638 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2ZrO3 | COD | 1527399 | Pnma (62) | ✔ | 24 | 160 | 1 | 3.7077 | 3.708 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca2CdSb2 | COD | 4109271 | Pnma (62) | ✔ | 20 | 168 | 1 | 0.1448 | 0.159 | 0.000 | (0;000) | ✗ | 21/03/17 |
ZrAu4 | COD | 1510544 | Pnma (62) | ✔ | 20 | 192 | 3 | 0.0 | 0.026 | 0.766 | (1;000) | ✗ | 21/03/17 |
ZrAu4 | COD | 1510543 | Pnma (62) | ✔ | 20 | 192 | 3 | 0.0 | 0.015 | 0.229 | (0;000) | ✗ | 21/03/17 |
HfAu4 | ICSD | 611961 | Pnma (62) | ✔ | 20 | 224 | 3 | 0.0 | 0.024 | 0.763 | (1;000) | ✗ | 21/03/17 |
NaC2N3 | COD | 4300181 | Pnma (62) | ✔ | 24 | 128 | 1 | 4.1109 | 4.141 | 0.000 | (0;000) | ✗ | 04/08/17 |
KC2N3 | ICSD | 411932 | Pnma (62) | ✔ | 24 | 128 | 1 | 3.8498 | 3.850 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ca3Hg | ICSD | 619363 | Pnma (62) | ✔ | 16 | 168 | 2 | 0.0 | 0.019 | 0.464 | (0;000) | ✗ | 21/03/17 |
Ca3Pd | ICSD | 619504 | Pnma (62) | ✔ | 16 | 192 | 1 | 0.0 | 0.007 | 0.320 | (1;000) | ✗ | 21/03/17 |
CaCd2Pd | ICSD | 425509 | Pnma (62) | ✔ | 16 | 208 | 3 | 0.0 | 0.005 | 0.653 | (0;000) | ✗ | 21/03/17 |
Sr(InAu)2 | COD | 4308152 | Pnma (62) | ✔ | 20 | 232 | 3 | 0.0 | 0.009 | 0.886 | (0;000) | ✗ | 21/03/17 |
AgC2N3 | COD | 9007855 | Pnma (62) | ✔ | 24 | 136 | 3 | 3.3948 | 3.569 | 0.000 | (0;000) | ✗ | 04/08/17 |
Te2Br | COD | 1527657 | Pnma (62) | ✔ | 24 | 152 | 1 | 0.0 | 0.462 | 0.060 | (0;000) | ✗ | 04/08/17 |
TlBrO4 | ICSD | 65659 | Pnma (62) | ✔ | 24 | 176 | 1 | 3.7139 | 3.827 | 0.000 | (0;000) | ✗ | 04/08/17 |
KBrO4 | COD | 4343799 | Pnma (62) | ✔ | 24 | 160 | 1 | 3.8377 | 3.880 | 0.000 | (0;000) | ✗ | 04/08/17 |
MgSO4 | COD | 2214531 | Pnma (62) | ✔ | 24 | 160 | 3 | 5.9674 | 6.011 | 0.000 | (0;000) | ✗ | 04/08/17 |
MgSeO4 | ICSD | 109068 | Pnma (62) | ✔ | 24 | 160 | 3 | 4.585 | 4.603 | 0.000 | (0;000) | ✗ | 04/08/17 |
Ba(InAu)2 | COD | 4308151 | Pnma (62) | ✔ | 20 | 232 | 3 | 0.0 | 0.006 | 0.938 | (0;000) | ✗ | 21/03/17 |
MnPO4 | COD | 1529150 | Pnma (62) | ✔ | 24 | 176 | 3 | 0.0 | 0.001 | 0.506 | (0;000) | ✗ | 04/08/17 |
MnSeO4 | ICSD | 25698 | Pnma (62) | ✔ | 24 | 180 | 3 | 0.0 | 0.000 | 0.546 | (0;101) | ✗ | 04/08/17 |
NaGaBr4 | ICSD | 69650 | Pnma (62) | ✔ | 24 | 200 | 1 | 3.6083 | 3.608 | 0.000 | (0;000) | ✗ | 04/08/17 |
CsGaBr4 | ICSD | 4037 | Pnma (62) | ✔ | 24 | 200 | 1 | 3.931 | 3.931 | 0.000 | (0;000) | ✗ | 04/08/17 |
Rb2CuBr3 | ICSD | 150295 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.8467 | 1.847 | 0.000 | (0;000) | ✗ | 04/08/17 |
K2CuBr3 | ICSD | 150293 | Pnma (62) | ✔ | 24 | 200 | 1 | 1.9025 | 1.903 | 0.000 | (0;000) | ✗ | 04/08/17 |
ScSiRu | ICSD | 420417 | Pnma (62) | ✔ | 12 | 124 | 3 | 0.0 | 0.000 | 0.711 | (1;011) | ✗ | 29/03/17 |
Ca3AsN | COD | 1005008 | Pnma (62) | ✔ | 20 | 160 | 1 | 0.8756 | 0.876 | 0.000 | (0;000) | ✗ | 21/03/17 |
SrBPd4 | ICSD | 247263 | Pnma (62) | ✔ | 24 | 340 | 3 | 0.0 | 0.000 | 0.582 | (1;011) | ✗ | 04/08/17 |
SbRh2 | ICSD | 650253 | Pnma (62) | ✔ | 12 | 156 | 3 | 32.2587 | 0.002 | 1.000 | (0;000) | ✗ | 29/03/17 |
Na3TlO2 | COD | 1530970 | Pnma (62) | ✔ | 24 | 208 | 1 | 1.8583 | 2.207 | 0.000 | (0;000) | ✗ | 04/08/17 |
NaP5 | ICSD | 99177 | Pnma (62) | ✔ | 24 | 136 | 1 | 1.3261 | 1.339 | 0.000 | (0;000) | ✗ | 04/08/17 |
CaMnO3 | ICSD | 92083 | Pnma (62) | ✔ | 20 | 172 | 3 | 0.0 | 0.001 | 0.550 | (0;110) | ✗ | 22/03/17 |