▹ Formula | ▹ Source | ▹ ID | ▹ space group | ▹ centered | ▹ nat | ▴ ne | ▹ dim | ▹ gap | ▹ dir. gap | ▹ met. | ▹ ν | wcc | ▹ updated |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ba2Ni3 | ICSD | 423734 | P-3m1 (164) | ✔ | 5 | 50 | 2 | 0.0 | 0.000 | 0.618 | (1;001) | ✗ | 05/01/17 |
Ba3PbO | COD | 1525464 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.013 | 0.080 | (0;000) | ✗ | 05/01/17 |
Ba3SnO | COD | 1525465 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.005 | 0.098 | (1;000) | ✗ | 05/01/17 |
Ba(FeS2)2 | ICSD | 23081 | I4/m (87) | ✔ | 7 | 50 | 1 | 0.0 | 0.002 | 0.245 | (0;111) | ✗ | 05/01/17 |
VO2 | ICSD | 89471 | P2/m (10) | ✔ | 6 | 50 | 3 | 0.0 | 0.011 | 0.940 | (0;010) | ✔ | 06/10/16 |
Ti2H | ICSD | 168323 | Pn-3m (224) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.818 | (1;000) | ✗ | 06/10/16 |
Ba(MnP)2 | COD | 7221162 | I4/mmm (139) | ✔ | 5 | 50 | 2 | 0.0 | 0.007 | 0.827 | (0;111) | ✗ | 05/01/17 |
Ba(MnSb)2 | ICSD | 32019 | I4/mmm (139) | ✔ | 5 | 50 | 2 | 0.0 | 0.002 | 0.868 | (0;111) | ✗ | 05/01/17 |
Ba(NiP2)2 | ICSD | 79105 | I4/mmm (139) | ✔ | 7 | 50 | 2 | 0.0 | 0.004 | 0.466 | (0;000) | ✗ | 05/01/17 |
LiPF6 | ICSD | 74830 | R-3 (148) | ✔ | 8 | 50 | 1 | 8.2887 | 8.289 | 0.000 | (0;000) | ✗ | 27/01/17 |
LiSbF6 | ICSD | 23924 | R-3 (148) | ✔ | 8 | 50 | 1 | 5.6983 | 5.698 | 0.000 | (0;000) | ✗ | 27/01/17 |
Li3YBi2 | ICSD | 616795 | P-3m1 (164) | ✔ | 6 | 50 | 2 | 0.0 | 0.051 | 0.212 | (1;000) | ✗ | 05/01/17 |
Ca2Sb | ICSD | 154 | I4mm (107) | ✗ | 6 | 50 | 1 | 0.0 | 0.091 | 0.055 | (0;000) | ✔ | 06/10/16 |
Ca3BiN | COD | 1527230 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.025 | 0.025 | 0.000 | (0;000) | ✗ | 05/01/17 |
NiBi | ICSD | 616868 | P6_3/mmc (194) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.814 | (1;000) | ✗ | 05/01/17 |
BiPt | COD | 9008911 | P6_3/mmc (194) | ✔ | 4 | 50 | 3 | 0.0 | 0.000 | 0.879 | (1;000) | ✗ | 05/01/17 |
AgF2 | ICSD | 20453 | P2_1/c (14) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.514 | (0;001) | ✔ | 06/10/16 |
Pd2N | ICSD | 236605 | P4/mmm (123) | ✔ | 6 | 50 | 3 | 0.0 | 0.020 | 0.753 | (0;111) | ✗ | 06/10/16 |
ScGa3 | COD | 1523115 | Pm-3m (221) | ✔ | 4 | 50 | 3 | 0.0 | 0.001 | 0.397 | (0;111) | ✗ | 27/01/17 |
Sc3BPb | COD | 1511293 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.106 | (1;000) | ✗ | 27/01/17 |
ReN2 | ICSD | 187452 | Cmmm (65) | ✔ | 6 | 50 | 3 | 0.0 | 0.024 | 0.517 | (0;001) | ✗ | 06/10/16 |
Sr2CuBrO2 | COD | 2002429 | R-3m (166) | ✔ | 6 | 50 | 1 | 2.4164 | 2.627 | 0.000 | (0;000) | ✗ | 27/01/17 |
TiBrO | COD | 1523160 | Pmmn (59) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.900 | (0;001) | ✗ | 27/01/17 |
Sc3SnB | COD | 1511324 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.112 | (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 |
Y(BC)2 | ICSD | 612672 | P4_2/mmc (131) | ✔ | 10 | 50 | 3 | 0.0 | 0.000 | 0.731 | (0;101) | ✗ | 27/01/17 |
BaSb3 | ICSD | 49000 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.0 | 0.104 | 0.361 | (1;001) | ✔ | 02/02/17 |
Zr2TlC | ICSD | 618976 | P6_3/mmc (194) | ✔ | 8 | 50 | 3 | 0.0 | 0.000 | 0.968 | (0;000) | ✗ | 27/01/17 |
Ca3PbO | COD | 1525462 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.016 | 0.004 | (0;000) | ✗ | 27/01/17 |
Ca3SnO | COD | 1525461 | Pm-3m (221) | ✔ | 5 | 50 | 1 | 0.0 | 0.019 | 0.016 | (0;000) | ✗ | 27/01/17 |
Li9S3N | ICSD | 240749 | Pm-3m (221) | ✔ | 13 | 50 | 1 | 2.4212 | 2.421 | 0.000 | (0;000) | ✗ | 27/01/17 |
Zr2Co | COD | 1524514 | I4/mcm (140) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.765 | (0;000) | ✗ | 27/01/17 |
Ca(GeRu)2 | ICSD | 52761 | I4/mmm (139) | ✔ | 5 | 50 | 3 | 0.0 | 0.002 | 0.499 | (1;000) | ✗ | 27/01/17 |
CaNiGeH | ICSD | 263028 | P4/nmm (129) | ✔ | 8 | 50 | 1 | 0.0 | 0.000 | 0.741 | (1;000) | ✗ | 27/01/17 |
Ca(MnP)2 | ICSD | 49017 | P-3m1 (164) | ✔ | 5 | 50 | 2 | 0.0 | 0.013 | 0.494 | (1;001) | ✗ | 27/01/17 |
Ca(MnSb)2 | ICSD | 416093 | P-3m1 (164) | ✔ | 5 | 50 | 2 | 0.0 | 0.008 | 0.559 | (1;001) | ✗ | 27/01/17 |
VS2 | ICSD | 77832 | Ccmm (63) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 1.000 | (1;000) | ✗ | 06/10/16 |
CaNiN | COD | 1005001 | P4_2/mmc (131) | ✔ | 6 | 50 | 3 | 0.0 | 0.001 | 0.963 | (0;101) | ✗ | 27/01/17 |
BaP3 | ICSD | 23618 | C2/m (12) | ✔ | 8 | 50 | 1 | 0.6198 | 0.781 | 0.000 | (0;000) | ✗ | 05/01/17 |
Sr(MnP)2 | ICSD | 77670 | P-3m1 (164) | ✔ | 5 | 50 | 2 | 0.0 | 0.012 | 0.406 | (1;001) | ✗ | 27/01/17 |
Sr(MnSb)2 | ICSD | 41790 | P-3m1 (164) | ✔ | 5 | 50 | 2 | 0.0 | 0.010 | 0.538 | (1;001) | ✗ | 27/01/17 |
Mn3Sb | ICSD | 163333 | Pm-3m (221) | ✔ | 4 | 50 | 3 | 0.0 | 0.001 | 0.605 | (0;000) | ✗ | 27/01/17 |
Sc3GaC | ICSD | 50162 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.113 | (1;000) | ✗ | 27/01/17 |
Y3GaC | ICSD | 56396 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.111 | (1;000) | ✗ | 27/01/17 |
CuF2 | ICSD | 26576 | P2_1/c (14) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.405 | (1;001) | ✔ | 06/10/16 |
Sc3InC | ICSD | 50163 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.108 | (1;000) | ✗ | 27/01/17 |
Y3InC | ICSD | 80955 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.099 | (1;000) | ✗ | 27/01/17 |
Sc3TlC | ICSD | 50164 | Pm-3m (221) | ✔ | 5 | 50 | 3 | 0.0 | 0.000 | 0.059 | (1;000) | ✗ | 27/01/17 |
TaSe2 | ICSD | 651956 | P6_3/mmc (194) | ✔ | 6 | 50 | 2 | 0.0 | 0.000 | 0.809 | (0;000) | ✗ | 27/01/17 |
TaO2 | ICSD | 603572 | P4_2/mnm (136) | ✔ | 6 | 50 | 3 | 0.0 | 0.000 | 0.903 | (0;000) | ✗ | 27/01/17 |