≤nAtoms≤
≤nElements≤
Space Group:
≤ Gap ≤
≤ Dir. Gap ≤
≤ Met. ≤
Formula
Composition
(ν0,ν1ν2ν3)
Source ID

13628 materials founds

▹ Formula ▹ Source ▹ ID ▹ space group ▹ centered ▹ nat ▹ ne ▹ dim ▴ gap ▹ dir. gap ▹ met. ▹ ν wcc ▹ updated
Rb2Te3 COD 1520875 Pnma (62) ✔ 20 144 1 0.6435 0.755 0.000 (0;000) ✗ 02/02/17
PdSeO3 ICSD 415955 C2/m (12) ✔ 10 84 2 0.6437 0.644 0.000 (0;000) ✗ 27/01/17
BaO2 ICSD 180398 Cmmm (65) ✔ 3 22 2 0.6441 1.164 0.000 (0;000) ✗ 05/01/17
LiZnN COD 1528616 F-43m (216) ✗ 3 20 3 0.6469 0.647 0.000 (0;000) ✗ 15/02/17
GeSe ICSD 637852 Pmnb (62) ✔ 8 40 2 0.6476 0.829 0.000 (0;000) ✗ 06/10/16
Ag2CO3 COD 1007035 P2_1/m (11) ✔ 12 88 3 0.6496 1.356 0.000 (0;000) ✗ 27/01/17
YN ICSD 161079 P6_3/mmc (194) ✔ 4 32 3 0.6511 0.930 0.000 (0;000) ✗ 06/10/16
CdHgAsBr ICSD 240354 Pmma (51) ✔ 16 144 3 0.6512 0.918 0.000 (0;000) ✗ 21/03/17
HgSe ICSD 639202 P3_221 (154) ✗ 6 54 3 0.6513 0.710 0.000 (0;000) ✗ 06/10/16
ZnCu2GeS4 ICSD 61693 I-42m (121) ✗ 8 62 3 0.6521 0.652 0.000 (0;000) ✗ 15/02/17
BaSi2 COD 1526653 Pnma (62) ✔ 24 144 1 0.6531 0.771 0.000 (0;000) ✗ 04/08/17
As2Os ICSD 42610 Pmnn (58) ✔ 6 52 3 0.6535 1.171 0.000 (0;000) ✗ 06/10/16
CsPbBr3 COD 4510745 Pnma (62) ✔ 20 176 3 0.6539 0.654 0.000 (0;000) ✗ 02/02/17
InS ICSD 15931 Pnnm (58) ✔ 8 76 3 0.6548 1.429 0.000 (0;000) ✗ 27/01/17
TiNCl ICSD 261525 Pmmn (59) ✔ 6 48 2 0.6554 0.655 0.000 (0;000) ✗ 27/01/17
SiB4 ICSD 615435 R-3m (166) ✔ 15 48 3 0.6561 1.387 0.000 (0;000) ✗ 05/01/17
ZnCu2SiSe4 ICSD 629079 Pmn2_1 (31) ✗ 16 124 3 0.6565 0.657 0.000 (0;000) ✗ 22/03/17
Rb5Au3O2 COD 1510508 Pbam (55) ✔ 20 180 1 0.6586 0.689 0.000 (0;000) ✗ 21/03/17
SnS COD 9008785 Pnma (62) ✔ 8 80 3 0.6586 0.838 0.000 (0;000) ✗ 27/01/17
Tl2SnS3 ICSD 48152 C2/m (12) ✔ 12 116 1 0.6589 0.884 0.000 (0;000) ✗ 02/02/17
VS2N3Cl2 ICSD 30742 P-1 (2) ✔ 16 108 1 0.6592 0.684 0.000 (0;000) ✗ 02/02/17
ZrTl2S3 COD 7019865 P2_1/m (11) ✔ 12 96 3 0.6608 0.670 0.000 (0;000) ✗ 02/02/17
Te3(PdBr)4 ICSD 418003 P-1 (2) ✔ 22 236 3 0.6609 0.785 0.000 (0;000) ✗ 07/08/17
SiPtSe ICSD 649595 P2_1ab (29) ✗ 12 80 3 0.661 0.803 0.000 (0;000) ✗ 06/10/16
Ba3Ir(CN)3 ICSD 424762 P6_3/m (176) ✔ 20 148 1 0.6652 1.246 0.000 (0;000) ✗ 02/02/17
Nb2Se9 ICSD 645386 P-1 (2) ✔ 22 160 3 0.6652 0.741 0.000 (0;000) ✗ 04/08/17
Cs2NaCoF6 ICSD 42157 R-3m (166) ✔ 20 172 2 0.666 0.668 0.000 (0;000) ✗ 02/02/17
HfIN ICSD 190384 R-3m (166) ✔ 6 48 2 0.6678 1.802 0.000 (0;000) ✗ 29/03/17
In2HgS4 COD 9012324 Fd-3m (227) ✔ 14 124 3 0.6681 0.867 0.000 (0;000) ✗ 02/02/17
MgP4 COD 1528274 P2_1/c (14) ✔ 10 60 1 0.6681 0.668 0.000 (0;000) ✗ 27/01/17
PbSe ICSD 648514 Pnma (62) ✔ 8 80 3 0.6688 0.905 0.000 (0;000) ✗ 02/02/17
K4CdAs2 COD 1008853 R-3m (166) ✔ 7 58 1 0.6689 0.691 0.000 (0;000) ✗ 30/01/17
Sr2ZnCu2(SO)2 ICSD 84735 I4/mmm (139) ✔ 9 78 3 0.6692 1.036 0.000 (0;000) ✗ 27/01/17
K2NaInAs2 ICSD 300137 Ibam (72) ✔ 12 100 1 0.6694 0.669 0.000 (0;000) ✗ 30/01/17
Te6IrCl3 ICSD 423672 R-3c (167) ✔ 20 148 3 0.6694 0.873 0.000 (0;000) ✗ 02/02/17
K2FeH4(SO5)2 ICSD 87958 P-1 (2) ✔ 19 102 2 0.6694 0.669 0.000 (0;000) ✗ 02/02/17
YAgTe2 ICSD 154792 P-42_1m (113) ✗ 8 68 3 0.6696 0.692 0.000 (0;000) ✗ 07/10/16
P2Rh ICSD 42615 P2_1/c (14) ✔ 12 108 3 0.6698 0.670 0.000 (0;000) ✗ 27/01/17
RbAs ICSD 412594 P2_12_12_1 (19) ✗ 16 112 1 0.67 0.670 0.000 (0;000) ✗ 21/03/17
OsOF4 ICSD 417246 P2_1/c (14) ✔ 24 200 1 0.67 0.670 0.000 (0;000) ✗ 04/08/17
V4Ag2O11 COD 1509687 C2/m (12) ✔ 17 140 3 0.6709 0.911 0.000 (0;000) ✗ 30/01/17
ZnGeO3 ICSD 183725 R3c (161) ✗ 10 68 3 0.6709 0.671 0.000 (0;000) ✗ 06/10/16
Ca6GaN5 ICSD 33795 P6_3/mcm (193) ✔ 24 196 1 0.6712 0.779 0.000 (0;000) ✗ 04/08/17
PdI2 ICSD 23169 Pnnm (58) ✔ 6 64 1 0.6718 0.969 0.000 (0;000) ✗ 02/02/17
CsTaI6 ICSD 418487 C2/c (15) ✔ 16 128 1 0.6727 0.680 0.000 (0;000) ✗ 02/02/17
GaAgO2 COD 1509345 P6_3/mmc (194) ✔ 8 72 3 0.6743 1.783 0.000 (0;000) ✗ 05/01/17
MgP4 ICSD 113 P2_1/c (14) ✔ 10 60 1 0.6744 0.674 0.000 (0;000) ✗ 06/10/16
Te2Mo COD 9009147 P6_3/mmc (194) ✔ 6 52 2 0.6746 0.974 0.000 (0;000) ✗ 27/01/17
TlInS2 ICSD 600748 I4/mcm (140) ✔ 8 76 1 0.6757 0.676 0.000 (0;000) ✗ 02/02/17
KAuI3 COD 7209388 P2_1/c (14) ✔ 20 164 2 0.6758 0.676 0.000 (0;000) ✗ 02/02/17
Ca3VN3 COD 1005013 Cmcm (63) ✔ 14 116 1 0.6765 0.984 0.000 (0;000) ✗ 02/02/17
ZnCu2GeS4 ICSD 627793 Pmn2_1 (31) ✗ 16 124 3 0.677 0.677 0.000 (0;000) ✗ 22/03/17
K2As2Pd ICSD 32009 Cmcm (63) ✔ 10 92 1 0.6777 0.686 0.000 (0;000) ✗ 30/01/17
BiI3 ICSD 187607 P2_1/c (14) ✔ 16 104 2 0.6786 0.679 0.000 (0;000) ✗ 06/10/16
In5Se5Br ICSD 414218 Pmn2_1 (31) ✗ 22 204 3 0.6795 0.833 0.000 (0;000) ✗ 07/08/17
PtCl2 ICSD 28527 R-3m (166) ✔ 18 144 2 0.6796 0.680 0.000 (0;000) ✗ 02/02/17
Sr2ZnN2 COD 1005019 I4/mmm (139) ✔ 5 42 1 0.6805 0.681 0.000 (0;000) ✗ 27/01/17
KYTe2 ICSD 419995 R-3m (166) ✔ 4 32 3 0.682 1.760 0.000 (0;000) ✗ 27/01/17
ReSe2 ICSD 66658 P-1 (2) ✔ 12 108 2 0.6829 0.814 0.000 (0;000) ✗ 06/10/16
ReSe2 ICSD 650094 P-1 (2) ✔ 12 108 2 0.683 0.811 0.000 (0;000) ✗ 02/02/17
Ca3AsN ICSD 56968 Pm-3m (221) ✔ 5 40 1 0.6838 0.684 0.000 (0;000) ✗ 05/01/17
NaAg3O2 COD 7209379 Ibam (72) ✔ 12 108 3 0.6845 0.685 0.000 (0;000) ✗ 05/01/17
AgCl ICSD 56541 P2_1/m (11) ✔ 4 36 3 0.6845 2.523 0.000 (0;000) ✗ 06/10/16
MgSiP2 ICSD 642734 I-42d (122) ✗ 8 48 3 0.6848 0.746 0.000 (0;000) ✗ 15/02/17
GaAs ICSD 190423 P6_3mc (186) ✗ 4 36 3 0.685 0.685 0.000 (0;000) ✗ 06/10/16
Na2AgAs ICSD 49007 C222_1 (20) ✗ 8 68 1 0.6852 0.685 0.000 (0;000) ✗ 06/10/16
Ag5SbS4 COD 9013429 Cmc2_1 (36) ✗ 20 168 3 0.6855 0.723 0.000 (0;000) ✗ 16/03/17
Cs2Sb2Pt ICSD 658700 Cmcm (63) ✔ 10 76 3 0.687 0.891 0.000 (0;000) ✗ 02/02/17
AlF3 COD 1010414 P321 (150) ✗ 12 72 2 0.6871 0.806 0.000 (0;000) ✗ 15/02/17
ZnSe2 ICSD 652213 Pa3 (205) ✔ 12 96 3 0.6872 0.823 0.000 (0;000) ✗ 02/02/17
NaBeSb COD 7221254 P6_3/mmc (194) ✔ 6 36 1 0.6881 1.361 0.000 (0;000) ✗ 05/01/17
K2Pt COD 9016555 Fm-3m (225) ✔ 3 28 1 0.6883 0.745 0.000 (0;000) ✗ 27/01/17
CsPbCl3 COD 1530111 Pm-3m (221) ✔ 5 44 3 0.6886 0.689 0.000 (0;000) ✗ 27/01/17
AgBiSCl2 ICSD 413290 Cmcm (63) ✔ 10 92 2 0.689 0.689 0.000 (0;000) ✗ 30/01/17
Na10CaSn12 COD 4320349 I-43m (217) ✗ 23 268 1 0.6893 0.709 0.000 (0;000) ✗ 07/08/17
VS4 ICSD 16797 C2/c (15) ✔ 20 148 2 0.6894 0.769 0.000 (0;000) ✗ 02/02/17
Te6IrI3 ICSD 423670 R-3c (167) ✔ 20 148 3 0.6895 0.711 0.000 (0;000) ✗ 02/02/17
CdS2 ICSD 620305 Pa3 (205) ✔ 12 96 3 0.6904 0.690 0.000 (0;000) ✗ 02/02/17
CuAgS ICSD 251148 Ccm2_1 (36) ✗ 6 56 3 0.6906 0.956 0.000 (0;000) ✗ 06/10/16
Ag3SeNO3 ICSD 108857 R3c (161) ✗ 16 124 3 0.6914 0.728 0.000 (0;000) ✗ 16/03/17
K2P3 ICSD 33259 Fmmm (69) ✔ 10 66 1 0.6919 0.692 0.000 (0;000) ✗ 02/02/17
Ba2GeP2 ICSD 35150 P2_1/c (14) ✔ 20 136 1 0.6927 0.821 0.000 (0;000) ✗ 02/02/17
Cd2SnO4 COD 1522049 Pbam (55) ✔ 14 124 3 0.6928 0.693 0.000 (0;000) ✗ 27/01/17
Na10SrSn12 COD 4320350 I-43m (217) ✗ 23 268 1 0.6938 0.724 0.000 (0;000) ✗ 07/08/17
SnSe2 ICSD 43857 P-3m1 (164) ✔ 3 26 2 0.6943 1.066 0.000 (0;000) ✗ 27/01/17
K2AgBi ICSD 1156 C222_1 (20) ✗ 8 68 1 0.6946 0.866 0.000 (0;000) ✗ 06/10/16
CoCuO2 COD 1008152 R-3m (166) ✔ 4 40 3 0.695 0.971 0.000 (0;000) ✗ 27/01/17
Li3P COD 2212780 P6_3/mmc (194) ✔ 8 28 1 0.695 2.117 0.000 (0;000) ✗ 27/01/17
LiNbS2 ICSD 26284 P6_3/mmc (194) ✔ 8 56 2 0.6953 1.625 0.000 (0;000) ✗ 27/01/17
ZnCu2SnS4 ICSD 185597 Pmn2_1 (31) ✗ 16 144 3 0.6953 0.695 0.000 (0;000) ✗ 22/03/17
Tl2C3O4 ICSD 260372 C2 (5) ✗ 18 124 3 0.6959 0.021 1.000 (0;000) ✗ 21/03/17
PdCl2 ICSD 421221 P2_1/c (14) ✔ 6 64 2 0.6974 1.132 0.000 (0;000) ✗ 27/01/17
P2Os COD 9012560 Pnnm (58) ✔ 6 52 3 0.6977 0.981 0.000 (0;000) ✗ 27/01/17
LiAsSe2 ICSD 248116 Cc (9) ✗ 8 40 1 0.6983 0.797 0.000 (0;000) ✗ 06/10/16
Sr3(GaAs2)2 ICSD 423785 C2/c (15) ✔ 18 152 2 0.6984 0.809 0.000 (0;000) ✗ 30/01/17
RbTaGeS5 ICSD 417874 P-1 (2) ✔ 16 112 1 0.6998 0.708 0.000 (0;000) ✗ 02/02/17
NbSeCl3 COD 2209086 P2/c (13) ✔ 20 160 1 0.7005 0.816 0.000 (0;000) ✗ 02/02/17
Tl6TeO6 ICSD 37135 R-3 (148) ✔ 13 120 3 0.7005 0.092 1.000 (0;000) ✗ 29/03/17
K2Se3 ICSD 1264 Ccm2_1 (36) ✗ 10 72 1 0.7025 0.851 0.000 (0;000) ✗ 06/10/16
CuAgS ICSD 66581 Pmc2_1 (26) ✗ 12 112 3 0.7052 0.722 0.000 (0;000) ✗ 06/10/16