TopoMat Database

▹ Formula	▹ Source	▹ ID	▹ space group	▹ centered	▹ nat	▹ ne	▹ dim	▴ gap	▹ dir. gap	▹ ν	wcc	▹ updated
NaHf₂CuSe₅	ICSD	98476	Cmcm (63)	✔	18	148	1	0.4844	0.487	(0;000)	✗	02/02/17
Ca(BC)₂	ICSD	88019	I4/mcm (140)	✔	10	48	2	0.4846	1.005	(0;000)	✗	27/01/17
Hf₂SN₂	ICSD	250915	P-3m1 (164)	✔	5	40	3	0.4848	1.577	(0;000)	✗	27/01/17
LiBeB	ICSD	191999	Im2m (44)	✗	12	40	2	0.486	0.968	(0;000)	✔	06/10/16
GeP	ICSD	637492	C2/m (12)	✔	12	54	3	0.4879	0.651	(0;000)	✗	02/02/17
BaGe₂	ICSD	409260	Pnma (62)	✔	24	144	1	0.4882	0.617	(0;000)	✗	04/08/17
CdSi(CuS₂)₂	ICSD	16924	Pmn2_1 (31)	✗	16	124	3	0.4888	0.489	(0;000)	✔	26/04/17
Ba(CuSe)₂	COD	1521194	Pnma (62)	✔	20	176	3	0.4905	0.491	(0;000)	✗	02/02/17
PtS₂	COD	5910085	P-3m1 (164)	✔	3	22	2	0.4919	1.185	(0;000)	✗	27/01/17
K₂P₂Pd	COD	7221367	Cmcm (63)	✔	10	92	2	0.4933	0.567	(0;000)	✗	02/02/17
FeSbS	COD	9000017	P2_1/c (14)	✔	12	76	3	0.4941	0.589	(0;000)	✗	27/01/17
V₂O₅	COD	9000091	C2/m (12)	✔	7	56	2	0.4944	0.760	(0;000)	✗	27/01/17
FeMoO₄	ICSD	43013	C2/m (12)	✔	24	184	3	0.4944	0.494	(0;000)	✗	04/08/17
CuBSe₂	ICSD	613591	I-42d (122)	✗	8	52	3	0.4946	0.501	(0;000)	✔	07/10/16
CdSe₂	ICSD	620416	Pa3 (205)	✔	12	96	3	0.4947	0.650	(0;000)	✗	02/02/17
SnC	ICSD	182365	F-43m (216)	✗	2	18	3	0.4951	0.495	(0;000)	✔	06/10/16
HgF₂	COD	9009017	Fm-3m (225)	✔	3	26	3	0.4966	0.497	(0;000)	✗	27/01/17
FeCl₂	COD	9014952	R-3m (166)	✔	3	22	2	0.4967	0.504	(0;000)	✗	27/01/17
SnSe	ICSD	16997	Pmcn (62)	✔	8	80	2	0.4969	0.652	(0;000)	✗	06/10/16
SnSe	COD	9008786	Pnma (62)	✔	8	80	2	0.4969	0.652	(0;000)	✗	02/02/17
SrLiSb	COD	1528545	Pnma (62)	✔	12	72	1	0.4973	0.497	(0;000)	✗	02/02/17
VPO₅	ICSD	77598	P4/n (85)	✔	14	96	2	0.4974	0.497	(0;000)	✗	27/01/17
Li₃Sb	COD	1011380	Fm-3m (225)	✔	4	14	1	0.4978	2.071	(0;000)	✗	27/01/17
Y₆PdBr₁₀	ICSD	424467	P-1 (2)	✔	17	154	3	0.498	0.589	(0;000)	✗	02/02/17
Ag₂O₃	COD	1509692	Fdd2 (43)	✗	10	80	3	0.4982	0.687	(0;000)	✔	16/03/17
SnSe	ICSD	186650	Pmnb (62)	✔	8	80	2	0.4992	0.652	(0;000)	✗	06/10/16
LiAuI₄	COD	1510187	P2_1/c (14)	✔	12	84	1	0.4995	0.624	(0;000)	✗	02/02/17
TaBi₄ClO₈	ICSD	59601	P4/mmm (123)	✔	14	128	1	0.4995	1.233	(0;000)	✗	02/02/17
SbTeOs	ICSD	647762	P2_1/c (14)	✔	12	108	3	0.5002	0.830	(0;000)	✗	02/02/17
PRuS	ICSD	648023	P2_1/c (14)	✔	12	108	3	0.5007	0.858	(0;000)	✗	27/01/17
TiFeO₃	ICSD	79278	R3c (161)	✗	10	76	3	0.5011	0.525	(0;000)	✗	06/10/16
KCO₃	COD	9010971	P2_1/c (14)	✔	20	124	1	0.5021	0.560	(0;000)	✗	02/02/17
CuSbSe₂	ICSD	418754	Pnma (62)	✔	16	112	3	0.5026	0.553	(0;000)	✗	02/02/17
KSnAs	ICSD	610765	P6_3mc (186)	✗	6	56	1	0.5034	0.530	(0;000)	✗	06/10/16
Cu₂HgI₄	ICSD	25591	I-42m (121)	✗	7	62	3	0.5039	0.504	(0;000)	✗	07/10/16
Tl₂S	ICSD	27464	P6_3/mmc (194)	✔	6	64	1	0.5041	0.613	(0;000)	✗	02/02/17
CdTe	ICSD	67862	P3_121 (152)	✗	6	54	3	0.5051	0.741	(0;000)	✗	06/10/16
ZnCdSe₂	ICSD	188387	P-4m2 (115)	✗	4	36	3	0.5052	0.505	(0;000)	✗	07/10/16
SiHgP₂	ICSD	247969	I-42d (122)	✗	8	52	3	0.507	0.507	(0;000)	✗	07/10/16
AgBi₂S₃Cl	ICSD	412372	P2_1/m (11)	✔	14	132	3	0.5086	0.764	(0;000)	✗	30/01/17
PdBr₂	ICSD	27443	C2/c (15)	✔	6	64	1	0.509	0.945	(0;000)	✗	27/01/17
CoSbS	ICSD	624862	P2_13 (198)	✗	12	112	3	0.5093	0.743	(0;000)	✗	15/02/17
AlAuO₂	COD	1531586	P6_3/mmc (194)	✔	8	52	3	0.5094	1.563	(0;000)	✗	05/01/17
NaZrCuS₃	ICSD	73887	Cmcm (63)	✔	12	84	2	0.5112	0.542	(0;000)	✗	02/02/17
Ag₂HgS₂	COD	9009717	P2_1/c (14)	✔	10	92	3	0.5114	0.511	(0;000)	✗	30/01/17
As₂Se₃	ICSD	611373	C2/m (12)	✔	10	56	1	0.5143	0.533	(0;000)	✗	30/01/17
NaInO₂	ICSD	31932	R-3m (166)	✔	4	34	3	0.5146	0.664	(0;000)	✗	27/01/17
Sn₃N₄	ICSD	89525	Fd-3m (227)	✔	14	124	3	0.5158	0.516	(0;000)	✗	27/01/17
PRuSe	ICSD	648028	P2_1/c (14)	✔	12	108	3	0.5164	0.893	(0;000)	✗	27/01/17
CuTe₂Cl	ICSD	641	P2_1/c (14)	✔	16	120	2	0.517	0.717	(0;000)	✗	02/02/17

13628 materials founds