TopoMat Database

▹ Formula	▹ Source	▹ ID	▹ space group	▹ centered	▴ nat	▹ ne	▹ dim	▹ gap	▹ dir. gap	▹ met.	▹ ν	wcc	▹ updated
ZnS	ICSD	37373	R3m (160)	✗	6	54	0	2.1341	2.134	0.000	(0;000)	✗	06/10/16
CaMnGe	ICSD	66957	P4/nmm (129)	✔	6	58	2	0.0	0.000	0.865	(1;000)	✗	27/01/17
CaMnGe	COD	9008361	P4/nmm (129)	✔	6	58	1	0.0	0.000	0.847	(0;000)	✗	27/01/17
CaNiGe	ICSD	418852	P4/nmm (129)	✔	6	48	2	0.0	0.002	0.796	(0;001)	✗	27/01/17
CaZnGe	ICSD	52772	P6_3/mmc (194)	✔	6	52	2	0.0	0.183	0.172	(0;000)	✗	27/01/17
SrS₂	ICSD	642	I4/mcm (140)	✔	6	44	1	1.3022	2.079	0.000	(0;000)	✗	27/01/17
NaPt₂	COD	2020042	Fd-3m (227)	✔	6	58	3	0.0	0.000	0.684	(0;000)	✗	27/01/17
PdCl₂	ICSD	421221	P2_1/c (14)	✔	6	64	2	0.6974	1.132	0.000	(0;000)	✗	27/01/17
NaZnP	ICSD	61083	P4/nmm (129)	✔	6	52	1	0.8574	0.857	0.000	(0;000)	✗	27/01/17
RbNaS	COD	9007814	P4/nmm (129)	✔	6	48	1	2.3693	2.442	0.000	(0;000)	✗	27/01/17
SiS₂	ICSD	16952	I-42d (122)	✗	6	32	3	2.9532	3.090	0.000	(0;000)	✗	06/10/16
CaH₂	ICSD	157943	P6_3/mmc (194)	✔	6	24	1	1.1892	3.109	0.000	(0;000)	✗	27/01/17
Sb₂Ru	ICSD	42608	Pmnn (58)	✔	6	52	3	0.0682	0.627	0.000	(0;000)	✗	06/10/16
SnS₂	ICSD	43003	P6_3mc (186)	✗	6	52	2	1.2053	1.498	0.000	(0;000)	✗	06/10/16
NaZnSb	COD	7221369	P4/nmm (129)	✔	6	52	1	0.0	0.025	0.097	(0;000)	✗	27/01/17
Te₂Ru	ICSD	106001	Pmnn (58)	✔	6	56	3	0.2399	1.040	0.000	(0;000)	✗	06/10/16
CaHgPb	COD	1527796	P6_3/mmc (194)	✔	6	72	3	0.0	0.007	0.301	(1;000)	✗	27/01/17
CaSnHg	ICSD	659596	P6_3/mmc (194)	✔	6	72	2	0.0	0.006	0.346	(1;000)	✗	27/01/17
ZnCl₂	ICSD	15916	I-42d (122)	✗	6	52	3	3.8632	3.863	0.000	(0;000)	✗	06/10/16
CaIn₂	ICSD	414232	P6_3/mmc (194)	✔	6	72	3	0.0	0.051	0.245	(1;000)	✗	27/01/17
CaIn₂	ICSD	58906	P6_3/mmc (194)	✔	6	72	3	0.0	0.009	0.299	(0;000)	✗	27/01/17
LiZnSb	ICSD	42064	P6_3mc (186)	✗	6	40	3	0.131	0.153	0.000	(0;000)	✔	06/10/16
CaIr₂	ICSD	108146	Fd-3m (227)	✔	6	88	3	0.0	0.004	0.436	(0;000)	✗	27/01/17
ScGe₂	ICSD	637839	Cmcm (63)	✔	6	38	3	0.0	0.000	0.820	(0;000)	✗	27/01/17
LiZnSb	ICSD	642350	P6_3mc (186)	✗	6	40	3	0.131	0.153	0.000	(0;000)	✔	06/10/16
Li₂Ca	ICSD	413207	Fd-3m (227)	✔	6	32	1	0.0	0.001	0.744	(0;000)	✗	27/01/17
TaAs₂	ICSD	44069	C2/m (12)	✔	6	46	3	0.0	0.122	0.088	(0;111)	✔	05/01/17
TiS₂	ICSD	181502	Pmnn (58)	✔	6	48	3	0.0	0.036	0.100	(1;000)	✗	06/10/16
ZrGe₂	COD	2310672	Cmcm (63)	✔	6	24	3	0.0	0.008	0.223	(1;110)	✗	27/01/17
YGe₂	ICSD	76344	I4_1/amd (141)	✔	6	38	3	0.0	0.000	0.648	(1;111)	✗	27/01/17
TiGe₂	ICSD	638053	Fddd (70)	✔	6	40	3	0.0	0.024	0.434	(1;111)	✗	27/01/17
VS₂	ICSD	77832	Ccmm (63)	✔	6	50	2	0.0	0.000	1.000	(1;000)	✗	06/10/16
CaMnSi	ICSD	66949	P4/nmm (129)	✔	6	58	1	0.0	0.000	0.851	(0;001)	✗	27/01/17
CaMnSi	ICSD	66955	P4/nmm (129)	✔	6	58	2	0.0	0.000	0.863	(1;000)	✗	27/01/17
CaMnSn	ICSD	66950	P4/nmm (129)	✔	6	78	1	0.0	0.000	0.845	(0;001)	✗	27/01/17
YS₂	ICSD	52216	Fd-3m (227)	✔	6	46	3	0.0	0.000	0.796	(0;000)	✗	27/01/17
CaMnSn	ICSD	66959	P4/nmm (129)	✔	6	78	2	0.0	0.000	0.924	(1;000)	✗	27/01/17
NbO₂	ICSD	56018	P4_2/mnm (136)	✔	6	50	3	0.0	0.000	0.924	(0;000)	✗	27/01/17
Hf₂Ge	ICSD	636554	I4/mcm (140)	✔	6	56	3	0.0	0.010	0.531	(0;000)	✗	27/01/17
CaNi₂	ICSD	58915	Fd-3m (227)	✔	6	60	3	0.0	0.000	0.485	(0;000)	✗	27/01/17
CaNi₅	ICSD	619447	P6/mmm (191)	✔	6	60	3	0.0	0.002	0.538	(1;001)	✗	27/01/17
CaNiN	COD	1005001	P4_2/mmc (131)	✔	6	50	3	0.0	0.001	0.963	(0;101)	✗	27/01/17
Hf₂Ge	ICSD	42524	I4/mcm (140)	✔	6	56	3	0.0	0.001	0.346	(1;000)	✗	27/01/17
YS₂	ICSD	651404	P4/nmm (129)	✔	6	46	3	0.0	0.000	0.824	(0;000)	✗	27/01/17
HfVGe	ICSD	88211	I4/mmm (139)	✔	6	58	3	0.0	0.014	0.715	(0;111)	✗	27/01/17
HfGeSe	ICSD	25741	P4/nmm (129)	✔	6	44	3	0.0	0.100	0.171	(0;001)	✗	27/01/17
NbPSe	COD	4343766	Immm (71)	✔	6	48	3	0.0	0.020	0.494	(0;000)	✗	27/01/17
NbPS	COD	4343765	Immm (71)	✔	6	48	3	0.0	0.060	0.466	(0;000)	✗	27/01/17
CaZnPb	ICSD	659603	P6_3/mmc (194)	✔	6	72	2	0.0	0.045	0.343	(1;000)	✗	27/01/17
MoSeS	ICSD	191307	P-6m2 (187)	✗	6	52	2	0.0	0.046	0.697	(0;000)	✔	06/10/16
CaPd₂	ICSD	619495	Fd-3m (227)	✔	6	92	3	0.0	0.000	0.586	(0;000)	✗	27/01/17
NbRh	ICSD	645271	P2/m (10)	✔	6	90	3	0.0	0.009	0.846	(0;110)	✗	27/01/17
CoReO₄	ICSD	72872	Cmmm (65)	✔	6	56	3	0.0	0.015	0.818	(1;001)	✗	27/01/17
CaPd₅	COD	1527060	P6/mmm (191)	✔	6	100	3	0.0	0.007	0.630	(1;001)	✗	27/01/17
CaPt₂	ICSD	108147	Fd-3m (227)	✔	6	60	3	0.0	0.011	0.504	(0;000)	✗	27/01/17
NbS₂	ICSD	43697	P6_3/mmc (194)	✔	6	50	2	0.0	0.000	0.850	(1;000)	✗	27/01/17
CaPt₅	ICSD	58929	P6/mmm (191)	✔	6	60	3	0.0	0.001	0.554	(1;000)	✗	27/01/17
NbSb₂	COD	2310580	C2/m (12)	✔	6	46	3	0.0	0.030	0.174	(0;111)	✗	27/01/17
NbSe₂	ICSD	645383	P6_3/mmc (194)	✔	6	50	2	0.0	0.000	0.896	(1;000)	✗	27/01/17
NbSe₂	COD	9014575	P6_3/mmc (194)	✔	6	50	2	0.0	0.000	0.905	(0;000)	✗	27/01/17
CaRh₂	ICSD	108145	Fd-3m (227)	✔	6	88	3	0.0	0.000	0.709	(0;000)	✗	27/01/17
HfVGe	ICSD	636594	P4/nmm (129)	✔	6	58	3	0.0	0.000	0.821	(0;000)	✗	27/01/17
HfGeS	ICSD	25742	P4/nmm (129)	✔	6	44	3	0.0	0.090	0.146	(0;001)	✗	27/01/17
CoNiSn	COD	1524150	P6_3/mmc (194)	✔	6	82	3	0.0	0.000	0.870	(1;000)	✗	27/01/17
CaSi₂	ICSD	248532	I4_1/amd (141)	✔	6	36	3	0.0	0.003	0.257	(1;111)	✗	27/01/17
CaSi₂	ICSD	52789	R-3m (166)	✔	6	36	1	0.0	0.038	0.120	(1;000)	✗	27/01/17
ScNi₂	COD	1523497	Fd-3m (227)	✔	6	62	3	0.0	0.000	0.438	(0;000)	✗	27/01/17
HfGeTe	ICSD	25743	P4/nmm (129)	✔	6	44	3	0.0	0.042	0.058	(0;001)	✗	27/01/17
SiNi₂	COD	1523551	P6_3/mmc (194)	✔	6	48	3	0.0	0.001	0.711	(0;000)	✗	27/01/17
CaZnSi	ICSD	52791	P6_3/mmc (194)	✔	6	52	2	0.0	0.382	0.187	(0;000)	✗	27/01/17
NaCN	ICSD	77172	Pmmn (59)	✔	6	36	1	5.2505	5.437	0.000	(0;000)	✗	27/01/17
CaZn₂	ICSD	418971	Imma (74)	✔	6	68	3	0.0	0.009	0.557	(0;111)	✗	27/01/17
NaSnN	ICSD	172471	P6_3mc (186)	✗	6	56	1	1.0378	1.340	0.000	(0;000)	✗	06/10/16
CaZn₅	ICSD	418614	P6/mmm (191)	✔	6	70	3	0.0	0.000	0.680	(1;000)	✗	27/01/17
YNi₂	ICSD	647087	Fd-3m (227)	✔	6	62	3	0.0	0.000	0.400	(0;000)	✗	27/01/17
ZrNi₂	COD	1523432	Fd-3m (227)	✔	6	48	3	0.0	0.000	0.403	(0;000)	✗	27/01/17
LiBC	ICSD	245288	P6_3/mmc (194)	✔	6	20	2	0.87	1.372	0.000	(0;000)	✗	27/01/17
SrCoO	ICSD	155223	P6_3/mmc (194)	✔	6	66	1	0.0	0.000	0.673	(1;000)	✗	27/01/17
YCBr	ICSD	78871	C2/m (12)	✔	6	44	2	0.0	0.017	0.505	(0;000)	✗	27/01/17
CBrN	ICSD	31694	Pmmn (59)	✔	6	32	1	4.971	5.037	0.000	(0;000)	✗	27/01/17
YBC	ICSD	42626	Cmmm (65)	✔	6	36	3	0.0	0.006	0.641	(1;110)	✗	27/01/17
BaN₂	ICSD	280681	C2/c (15)	✔	6	40	1	0.0	0.007	0.652	(0;000)	✔	06/10/16
CNCl	COD	2310595	Pmmn (59)	✔	6	32	1	5.9059	6.068	0.000	(0;000)	✗	27/01/17
TiSi₂	ICSD	1089	Fddd (70)	✔	6	40	3	0.0	0.012	0.452	(1;000)	✗	06/10/16
ZnNi₃Sb₂	ICSD	240197	P-3m1 (164)	✔	6	52	3	0.0	0.003	0.629	(0;001)	✗	27/01/17
ZnTe	ICSD	184486	P3_121 (152)	✗	6	54	3	0.2173	0.229	0.000	(0;000)	✔	06/10/16
Mg₂Ge	ICSD	636942	Fd-3m (227)	✔	6	48	3	0.0	0.398	0.458	(0;000)	✗	27/01/17
MgMnGe	ICSD	66948	P4/nmm (129)	✔	6	58	3	0.0	0.000	0.890	(0;001)	✗	27/01/17
NbGeSb	ICSD	637231	P4/nmm (129)	✔	6	44	2	0.0	0.027	0.169	(0;001)	✗	27/01/17
ZnTe	ICSD	80076	P3_1 (144)	✗	6	54	3	0.2277	1.605	0.000	(0;000)	✔	06/10/16
HfSb₂	ICSD	638876	P4/nmm (129)	✔	6	44	3	0.0	0.041	0.267	(1;000)	✗	27/01/17
HfSiSe	ICSD	25736	P4/nmm (129)	✔	6	44	3	0.0	0.041	0.134	(0;001)	✗	27/01/17
HfSi₂	ICSD	638917	Cmcm (63)	✔	6	40	3	0.0	0.065	0.327	(1;000)	✗	27/01/17
HfSiTe	ICSD	25737	P4/nmm (129)	✔	6	44	2	0.0	0.031	0.167	(0;001)	✗	27/01/17
LiHO	COD	9008958	P4/nmm (129)	✔	6	20	1	4.2789	4.279	0.000	(0;000)	✗	27/01/17
NaHO	ICSD	26833	P2_1/m (11)	✔	6	32	1	1.8213	1.821	0.000	(0;000)	✗	27/01/17
NaHO	ICSD	61045	Cmcm (63)	✔	6	32	1	3.0099	3.010	0.000	(0;000)	✗	27/01/17
SrIn₂	ICSD	414235	P6_3/mmc (194)	✔	6	72	3	0.0	0.058	0.204	(0;000)	✗	27/01/17
Sc₂In	ICSD	59522	P6_3/mmc (194)	✔	6	70	3	0.0	0.000	0.718	(1;000)	✗	27/01/17
ScIr₂	COD	2310175	Fd-3m (227)	✔	6	90	3	0.0	0.000	0.329	(0;000)	✗	27/01/17

13628 materials founds