▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▴ centered | ▹ nat | ▹ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CuI | ICSD | 84217 | P3m1 (156) | ✗ | 4 | 36 | 2 | 1.3365 | 1.337 | 0.000 | (0;000) | ✗ | 06/10/16 |
AlAs | ICSD | 67771 | P6_3mc (186) | ✗ | 4 | 16 | 3 | 1.599 | 1.705 | 0.000 | (0;000) | ✗ | 06/10/16 |
BaTe3 | ICSD | 36366 | P-42_1m (113) | ✗ | 8 | 56 | 1 | 0.719 | 0.730 | 0.000 | (0;000) | ✗ | 06/10/16 |
Cu2Se | ICSD | 30230 | F-43m (216) | ✗ | 3 | 28 | 3 | 0.0 | 0.000 | 0.097 | (1;000) | ✔ | 06/10/16 |
TlF | ICSD | 16112 | Pma2 (28) | ✗ | 8 | 80 | 2 | 1.4283 | 1.431 | 0.000 | (0;000) | ✗ | 06/10/16 |
MgF2 | ICSD | 51242 | Cm2m (38) | ✗ | 3 | 24 | 1 | 0.86 | 0.994 | 0.000 | (0;000) | ✗ | 06/10/16 |
SbF3 | ICSD | 16142 | Cc2m (40) | ✗ | 8 | 52 | 3 | 4.4474 | 4.748 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeF4 | ICSD | 202558 | I-43m (217) | ✗ | 5 | 32 | 1 | 6.2961 | 6.758 | 0.000 | (0;000) | ✗ | 06/10/16 |
IrF4 | ICSD | 23483 | F2dd (43) | ✗ | 10 | 74 | 3 | 0.0 | 0.000 | 0.301 | (1;000) | ✔ | 06/10/16 |
PdF4 | ICSD | 1555 | F2dd (43) | ✗ | 10 | 76 | 3 | 0.6264 | 0.669 | 0.000 | (0;000) | ✗ | 06/10/16 |
PtF4 | ICSD | 71579 | F2dd (43) | ✗ | 10 | 76 | 3 | 1.3016 | 1.324 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiF4 | ICSD | 14122 | I-43m (217) | ✗ | 5 | 32 | 1 | 8.056 | 8.625 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeGe | ICSD | 103492 | P2_13 (198) | ✗ | 8 | 48 | 3 | 0.0653 | 0.087 | 0.000 | (0;000) | ✔ | 06/10/16 |
BePo | ICSD | 58730 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.8057 | 1.059 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeS | ICSD | 68847 | Cmc2_1 (36) | ✗ | 4 | 28 | 3 | 0.0 | 0.028 | 0.242 | (0;000) | ✔ | 06/10/16 |
FeS2 | ICSD | 42726 | P2nn (34) | ✗ | 6 | 40 | 3 | 0.7907 | 1.143 | 0.000 | (0;000) | ✗ | 06/10/16 |
FeSb2 | ICSD | 15003 | P2nn (34) | ✗ | 6 | 36 | 3 | 0.0 | 0.112 | 0.057 | (0;000) | ✔ | 06/10/16 |
FeSi | ICSD | 36188 | P2_13 (198) | ✗ | 8 | 48 | 3 | 0.1202 | 0.156 | 0.000 | (0;000) | ✔ | 06/10/16 |
FeTe2 | ICSD | 42727 | P2nn (34) | ✗ | 6 | 40 | 3 | 0.0 | 0.598 | 0.025 | (0;000) | ✔ | 06/10/16 |
BeTe | ICSD | 183375 | F-43m (216) | ✗ | 2 | 10 | 1 | 1.572 | 3.253 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaN | ICSD | 156260 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.9043 | 1.904 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaN | ICSD | 159250 | P6_3mc (186) | ✗ | 4 | 36 | 2 | 0.0 | 0.015 | 0.236 | (1;000) | ✔ | 06/10/16 |
GaP | ICSD | 103795 | F-43m (216) | ✗ | 2 | 18 | 3 | 1.5678 | 1.791 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaP | ICSD | 190425 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 1.3812 | 1.457 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaSb | ICSD | 190414 | F-43m (216) | ✗ | 2 | 18 | 3 | 0.3208 | 0.324 | 0.000 | (0;000) | ✔ | 06/10/16 |
GaSb | ICSD | 190426 | P6_3mc (186) | ✗ | 4 | 36 | 3 | 0.0 | 0.008 | 0.010 | (0;000) | ✔ | 06/10/16 |
GaSe | ICSD | 601159 | P-6m2 (187) | ✗ | 8 | 76 | 2 | 1.0062 | 1.006 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaSe | ICSD | 73388 | R3m (160) | ✗ | 4 | 38 | 2 | 1.036 | 1.036 | 0.000 | (0;000) | ✗ | 06/10/16 |
GaBi | ICSD | 167768 | F-43m (216) | ✗ | 2 | 28 | 3 | 0.0 | 0.000 | 0.253 | (1;000) | ✔ | 06/10/16 |
Ga2Se3 | ICSD | 35028 | Cc (9) | ✗ | 10 | 88 | 3 | 1.0285 | 1.029 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeI2 | ICSD | 27674 | P-6m2 (187) | ✗ | 3 | 18 | 3 | 0.7466 | 0.838 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeO2 | ICSD | 16577 | P3_221 (154) | ✗ | 9 | 48 | 3 | 3.7257 | 3.809 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeO2 | ICSD | 200730 | P3_121 (152) | ✗ | 9 | 48 | 3 | 3.7477 | 3.872 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeO2 | ICSD | 23783 | P4_12_12 (92) | ✗ | 12 | 64 | 3 | 3.2366 | 3.237 | 0.000 | (0;000) | ✗ | 06/10/16 |
BiSe | ICSD | 72197 | F2mm (42) | ✗ | 4 | 42 | 2 | 0.0 | 0.033 | 0.537 | (1;110) | ✔ | 06/10/16 |
GeRu | ICSD | 637744 | P2_13 (198) | ✗ | 8 | 80 | 3 | 0.0317 | 0.132 | 0.000 | (0;000) | ✔ | 06/10/16 |
GeS2 | ICSD | 167194 | I-42d (122) | ✗ | 6 | 32 | 3 | 2.3808 | 2.735 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeSe2 | ICSD | 50761 | I-42d (122) | ✗ | 6 | 32 | 3 | 1.4346 | 1.788 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeSe2 | ICSD | 90956 | I-4 (82) | ✗ | 6 | 32 | 3 | 0.9941 | 1.393 | 0.000 | (0;000) | ✗ | 06/10/16 |
GeSe2 | ICSD | 90957 | P-4 (81) | ✗ | 12 | 64 | 3 | 0.7241 | 0.727 | 0.000 | (0;000) | ✔ | 10/10/16 |
GeTe | ICSD | 159907 | R3m (160) | ✗ | 2 | 10 | 3 | 0.3876 | 0.455 | 0.000 | (0;000) | ✔ | 06/10/16 |
Bi2O3 | ICSD | 168812 | P-42_1c (114) | ✗ | 20 | 112 | 3 | 1.4533 | 1.453 | 0.000 | (0;000) | ✗ | 06/10/16 |
Bi2O3 | ICSD | 169685 | P31c (159) | ✗ | 20 | 112 | 3 | 1.2724 | 1.273 | 0.000 | (0;000) | ✗ | 06/10/16 |
CuH | ICSD | 44859 | P6_3mc (186) | ✗ | 4 | 24 | 3 | 0.5757 | 1.488 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiH8 | ICSD | 169739 | I-4m2 (119) | ✗ | 9 | 12 | 1 | 6.0135 | 6.275 | 0.000 | (0;000) | ✗ | 06/10/16 |
HfN2 | ICSD | 290427 | P-6m2 (187) | ✗ | 3 | 22 | 3 | 0.0 | 0.033 | 0.203 | (0;000) | ✔ | 06/10/16 |
Bi2O3 | ICSD | 422451 | P6_3mc (186) | ✗ | 20 | 112 | 3 | 1.424 | 1.583 | 0.000 | (0;000) | ✗ | 06/10/16 |
ReN | ICSD | 167878 | F-43m (216) | ✗ | 2 | 20 | 3 | 0.0 | 0.030 | 0.330 | (1;000) | ✔ | 04/10/16 |
HgI2 | ICSD | 22242 | Ccm2_1 (36) | ✗ | 6 | 52 | 2 | 1.8395 | 1.994 | 0.000 | (0;000) | ✗ | 06/10/16 |
SiO2 | ICSD | 170513 | R3 (146) | ✗ | 9 | 48 | 0 | 5.7129 | 5.713 | 0.000 | (0;000) | ✗ | 06/10/16 |