≤nAtoms≤
≤nElements≤
Space Group:
≤ Gap ≤
≤ Dir. Gap ≤
≤ Met. ≤
Formula
Composition
01ν2ν3)
Source ID

13628 materials founds

Formula Source ID space group centered nat ne dim gap dir. gap met. ν wcc updated
H2 ICSD 28344 P6_3/mmc (194) 2 2 1 0.0 0.000 0.621 (1;000) 27/01/17
H2 COD 9012915 P6_3/mmc (194) 2 2 1 0.0 0.000 0.699 (1;000) 27/01/17
C COD 4105684 I4/mmm (139) 1 4 1 0.0 0.006 0.323 (0;000) 27/01/17
Si ICSD 163246 I4/mmm (139) 1 4 1 0.0 0.027 0.613 (0;000) 27/01/17
C COD 4313211 Fm-3m (225) 1 4 1 0.0 0.005 0.580 (0;000) 27/01/17
Zr COD 9008559 Im-3m (229) 1 4 3 0.0 0.000 0.516 (0;000) 27/01/17
Ge ICSD 181070 Fm-3m (225) 1 4 1 0.0 0.117 0.611 (0;000) 27/01/17
H2 COD 9013088 P6_3/mmc (194) 4 4 1 1.4218 1.712 0.000 (0;000) 27/01/17
Si COD 9012724 Fm-3m (225) 1 4 3 0.0 0.000 0.610 (1;000) 27/01/17
Si COD 9012918 P6/mmm (191) 1 4 3 0.0 0.022 0.518 (0;001) 27/01/17
LiH COD 9008668 Fm-3m (225) 2 4 1 2.9949 2.995 0.000 (0;000) 27/01/17
Be ICSD 52708 Im-3m (229) 1 4 1 0.0 0.001 0.284 (1;000) 05/01/17
Te ICSD 52500 R-3m (166) 1 6 3 0.0 0.003 0.762 (0;000) 27/01/17
Se ICSD 52418 Pm-3m (221) 1 6 3 0.0 0.000 0.695 (0;000) 27/01/17
Se ICSD 656457 R-3m (166) 1 6 3 0.0 0.028 0.777 (0;000) 27/01/17
ZrH2 ICSD 164605 Fm-3m (225) 3 6 3 0.0 0.000 0.293 (0;000) 27/01/17
O2 ICSD 99593 P2/m (10) 1 6 1 0.0 0.034 0.399 (0;000) 27/01/17
O2 ICSD 28530 P4/mmm (123) 1 6 1 0.0 0.025 0.322 (0;000) 27/01/17
S COD 7101265 Pm-3m (221) 1 6 1 0.0 0.000 0.698 (0;000) 27/01/17
Li ICSD 20928 P6_3/mmc (194) 2 6 1 0.0 0.000 0.670 (1;000) 27/01/17
Li COD 9011003 P6_3/mmc (194) 2 6 1 0.0 0.000 0.710 (0;000) 27/01/17
S COD 9011640 R-3m (166) 1 6 3 0.0 0.000 0.717 (1;000) 27/01/17
AlAs ICSD 185081 F-43m (216) 2 8 3 1.3082 2.054 0.000 (0;000) 06/10/16
AlP ICSD 190409 F-43m (216) 2 8 3 1.5188 3.480 0.000 (0;000) 06/10/16
AlN ICSD 181066 F-43m (216) 2 8 3 3.3052 4.020 0.000 (0;000) 06/10/16
Be COD 9012017 P6_3/mmc (194) 2 8 1 0.0 0.001 0.153 (1;000) 05/01/17
BP ICSD 181291 F-43m (216) 2 8 3 1.2188 3.369 0.000 (0;000) 06/10/16
C COD 1100003 R-3m (166) 2 8 2 0.0479 0.048 0.000 (0;111) 27/01/17
Si COD 9012919 P6_3/mmc (194) 2 8 3 0.0 0.008 0.744 (0;000) 27/01/17
Si COD 9011656 Imma (74) 2 8 3 0.0 0.018 0.449 (1;000) 27/01/17
Fe COD 4113940 P4/mmm (123) 1 8 1 0.0 0.001 0.297 (0;000) 27/01/17
AlSb ICSD 151218 F-43m (216) 2 8 3 0.9754 1.422 0.000 (0;000) 06/10/16
BN ICSD 162874 F-43m (216) 2 8 3 4.4968 8.945 0.000 (0;000) 06/10/16
ZrC COD 9008777 Fm-3m (225) 2 8 3 0.0 0.011 0.192 (0;000) 27/01/17
H2Se ICSD 24584 Fm-3m (225) 3 8 1 0.0 0.000 0.366 (0;000) 27/01/17
AlN COD 1523095 Fm-3m (225) 2 8 3 5.1878 6.629 0.000 (0;000) 05/01/17
SiC ICSD 164973 F-43m (216) 2 8 3 1.3623 4.548 0.000 (0;000) 06/10/16
BAs ICSD 181292 F-43m (216) 2 8 3 1.0744 3.121 0.000 (0;000) 06/10/16
GeC ICSD 182363 F-43m (216) 2 8 3 1.5913 3.553 0.000 (0;000) 06/10/16
Ge ICSD 181073 P6_3/mmc (194) 2 8 1 0.0 0.015 0.756 (1;000) 27/01/17
GeH4 ICSD 183081 Cmmm (65) 5 8 3 0.0 0.030 0.655 (1;110) 06/10/16
Ge ICSD 636530 I4_1/amd (141) 2 8 3 0.0 0.027 0.455 (1;111) 27/01/17
H2S ICSD 24582 Fm-3m (225) 3 8 1 0.0 0.000 0.304 (1;000) 27/01/17
HCl ICSD 28844 Fmmm (69) 2 8 1 0.0 0.033 0.154 (1;000) 06/10/16
Fe COD 9014113 Fm-3m (225) 1 8 3 0.0 0.003 0.514 (0;000) 27/01/17
BiB ICSD 184569 F-43m (216) 2 8 3 0.0 0.000 0.008 (1;000) 06/10/16
BSb ICSD 184571 F-43m (216) 2 8 3 0.6393 2.485 0.000 (0;000) 06/10/16
Fe COD 9013476 Im-3m (229) 1 8 3 0.0 0.000 0.788 (0;000) 27/01/17
Ge COD 9008567 Fd-3m (227) 2 8 3 0.0302 0.030 0.000 (0;000) 27/01/17
C COD 9000046 Fmmm (69) 2 8 2 0.0 0.005 0.011 (0;110) 27/01/17
C COD 9012303 Fd-3m (227) 2 8 3 4.1576 5.595 0.000 (0;000) 27/01/17
BN ICSD 20946 Fmm2 (42) 2 8 3 0.0 1.907 0.333 (0;000) 15/02/17
Zr COD 9008523 P6_3/mmc (194) 2 8 3 0.0 0.002 0.303 (0;000) 27/01/17
Si COD 9013107 Fd-3m (227) 2 8 3 0.5742 2.519 0.000 (0;000) 27/01/17
AlBi ICSD 184567 F-43m (216) 2 8 3 0.0 0.000 0.091 (1;000) 06/10/16
LaBi ICSD 58795 Fm-3m (225) 2 8 3 0.0 0.065 0.181 (1;000) 06/10/16
Be COD 9012040 P6_3/mmc (194) 2 8 1 0.0 0.001 0.353 (1;000) 05/01/17
HCl COD 9015375 Fm-3m (225) 2 8 1 0.0 0.000 0.102 (1;000) 27/01/17
HBr COD 1010385 Fm-3m (225) 2 8 1 0.0 0.000 0.199 (0;000) 27/01/17
HBr ICSD 28842 Fmmm (69) 2 8 1 0.0 0.014 0.282 (0;000) 06/10/16
Ca COD 9012917 Pm-3m (221) 1 10 1 0.0 0.000 0.233 (0;000) 27/01/17
CsH ICSD 53235 Pm-3m (221) 2 10 3 2.5955 2.596 0.000 (0;000) 27/01/17
CsH COD 9008622 Fm-3m (225) 2 10 1 2.2162 2.216 0.000 (0;000) 27/01/17
Sr ICSD 182337 P6/mmm (191) 1 10 1 0.0 0.014 0.741 (0;000) 27/01/17
BeSe ICSD 183374 F-43m (216) 2 10 1 2.4499 4.314 0.000 (0;000) 06/10/16
Ca COD 9012731 Fm-3m (225) 1 10 1 0.0 0.012 0.456 (0;000) 27/01/17
Sr ICSD 109027 P4/mmm (123) 1 10 1 0.0 0.001 0.587 (0;000) 27/01/17
Sr ICSD 41236 P6/mmm (191) 1 10 1 0.0 0.018 0.306 (0;000) 27/01/17
BeSe ICSD 53934 Fm-3m (225) 2 10 1 0.0 2.642 0.027 (0;000) 05/01/17
ZrB2 COD 1510857 P6/mmm (191) 3 10 3 0.0 0.022 0.126 (0;001) 05/01/17
ZrH ICSD 56197 P4_2/mmc (131) 4 10 3 0.0 0.000 0.547 (0;101) 27/01/17
LiBr COD 9008664 Fm-3m (225) 2 10 1 4.7584 4.758 0.000 (0;000) 27/01/17
Ca COD 9008530 Im-3m (229) 1 10 1 0.0 0.000 0.444 (0;000) 27/01/17
Mg ICSD 642652 Im-3m (229) 1 10 3 0.0 0.000 0.457 (0;111) 27/01/17
Sr ICSD 79592 P6/mmm (191) 1 10 1 0.0 0.022 0.520 (0;000) 27/01/17
Ba ICSD 52679 Fm-3m (225) 1 10 1 0.0 0.077 0.167 (0;000) 02/02/17
Ba COD 1507757 Pm-3m (221) 1 10 3 0.0 0.000 0.092 (0;000) 05/01/17
NaH COD 9008680 Fm-3m (225) 2 10 1 3.7143 4.558 0.000 (0;000) 27/01/17
Ba COD 9008528 Im-3m (229) 1 10 1 0.0 0.000 0.399 (0;000) 05/01/17
SbAs COD 9001315 R-3m (166) 2 10 3 0.0 0.157 0.276 (0;000) 05/01/17
KH COD 9008653 Fm-3m (225) 2 10 1 3.434 3.434 0.000 (0;000) 27/01/17
Sb COD 9013464 P6_3/mmc (194) 2 10 1 0.0 0.000 0.874 (1;000) 27/01/17
P ICSD 647901 R-3m (166) 2 10 1 0.0 0.027 0.163 (0;000) 27/01/17
Pt COD 1101019 Fm-3m (225) 1 10 3 0.0 0.000 0.575 (0;000) 27/01/17
ZrO COD 9008779 Fm-3m (225) 2 10 3 0.0 0.000 0.469 (0;000) 27/01/17
Sb COD 9008575 R-3m (166) 2 10 3 0.0 0.081 0.025 (1;111) 27/01/17
BeO COD 1011325 Fm-3m (225) 2 10 1 6.5102 6.607 0.000 (0;000) 05/01/17
As COD 9008574 R-3m (166) 2 10 2 0.0 0.074 0.060 (1;111) 05/01/17
Sb COD 9013011 P6_3/mmc (194) 2 10 3 0.0 0.000 0.871 (0;000) 27/01/17
SiH ICSD 41478 P-3m1 (164) 4 10 2 2.0532 2.092 0.000 (0;000) 27/01/17
GeSe ICSD 53906 Fm-3m (225) 2 10 3 0.0362 0.036 0.000 (0;000) 27/01/17
GeTe ICSD 56037 Fm-3m (225) 2 10 3 0.2145 0.215 0.000 (0;000) 27/01/17
Ba ICSD 109031 P4/mmm (123) 1 10 1 0.0 0.004 0.524 (0;000) 05/01/17
BeO ICSD 163467 F-43m (216) 2 10 1 6.9092 7.605 0.000 (0;000) 06/10/16
N2 ICSD 95247 Imma (74) 2 10 1 0.0 0.000 0.540 (0;010) 27/01/17
RbH COD 9008709 Fm-3m (225) 2 10 1 2.9175 2.918 0.000 (0;000) 27/01/17
BeTe ICSD 183375 F-43m (216) 2 10 1 1.572 3.253 0.000 (0;000) 06/10/16
GeTe ICSD 159907 R3m (160) 2 10 3 0.3876 0.455 0.000 (0;000) 06/10/16
BeS ICSD 183373 F-43m (216) 2 10 1 3.0264 5.598 0.000 (0;000) 06/10/16
LiCl COD 1011314 Fm-3m (225) 2 10 1 6.2774 6.277 0.000 (0;000) 27/01/17