TopoMat Database

▹ Formula	▹ Source	▹ ID	▹ space group	▹ centered	▴ nat	▹ ne	▹ dim	▹ gap	▹ dir. gap	▹ met.	▹ ν	wcc	▹ updated
BaAl₂	ICSD	246193	Fd-3m (227)	✔	6	32	3	0.0	0.000	0.593	(0;000)	✗	05/01/17
HgO	ICSD	639125	P3_221 (154)	✗	6	54	3	1.4576	1.628	0.000	(0;000)	✗	06/10/16
CaBi₂	ICSD	659277	Cmcm (63)	✔	6	80	1	0.0	0.032	0.360	(0;110)	✗	05/01/17
CaAl₂	COD	1010450	Fd-3m (227)	✔	6	32	3	0.0	0.001	0.614	(0;000)	✗	05/01/17
CO₂	COD	1517803	P4_2/mnm (136)	✔	6	32	1	5.8825	6.623	0.000	(0;000)	✗	27/01/17
KBi₂	ICSD	55068	Fd-3m (227)	✔	6	78	3	0.0	0.000	0.757	(0;000)	✗	02/02/17
Al₂Cu	COD	9012196	I4/mcm (140)	✔	6	34	3	0.0	0.000	0.914	(1;000)	✗	05/01/17
HgS	ICSD	169614	P3_221 (154)	✗	6	54	3	1.5136	1.570	0.000	(0;000)	✗	06/10/16
HgS	ICSD	31129	P3_121 (152)	✗	6	54	3	0.0	0.010	0.199	(0;000)	✔	06/10/16
NbAs₂	ICSD	18143	C2 (5)	✗	6	46	3	0.0	0.010	0.093	(0;111)	✔	04/10/16
Al₂Ru	ICSD	609228	Fddd (70)	✔	6	44	3	0.0583	1.223	0.000	(0;000)	✗	05/01/17
ScAl₂	ICSD	186475	Fd-3m (227)	✔	6	34	3	0.0	0.000	0.694	(0;000)	✗	05/01/17
SrAl₂	ICSD	246192	Fd-3m (227)	✔	6	32	3	0.0	0.005	0.597	(0;000)	✗	05/01/17
SrAl₂	ICSD	58166	Imma (74)	✔	6	32	3	0.0	0.116	0.252	(0;000)	✗	05/01/17
TiAl₂	COD	1528043	Cmmm (65)	✔	6	36	3	0.0	0.010	0.449	(1;110)	✗	05/01/17
YAl₂	ICSD	609660	Fd-3m (227)	✔	6	34	3	0.0	0.000	0.752	(0;000)	✗	05/01/17
HgSe	ICSD	639202	P3_221 (154)	✗	6	54	3	0.6513	0.710	0.000	(0;000)	✗	06/10/16
Fe₂Sn	COD	1523460	P6_3/mmc (194)	✔	6	60	3	0.0	0.007	0.858	(0;000)	✗	27/01/17
HfVSi	ICSD	638931	P4/nmm (129)	✔	6	58	3	0.0	0.000	0.815	(0;000)	✗	27/01/17
HfSiS	ICSD	25735	P4/nmm (129)	✔	6	44	3	0.0	0.101	0.125	(0;001)	✗	27/01/17
HgTe	ICSD	162603	P3_121 (152)	✗	6	54	0	0.1243	0.414	0.000	(0;000)	✔	06/10/16
HfV₂	COD	1522805	Fd-3m (227)	✔	6	76	3	0.0	0.000	0.732	(0;000)	✗	27/01/17
HfW₂	ICSD	639012	Fd-3m (227)	✔	6	80	3	0.0	0.000	0.639	(0;000)	✗	27/01/17
HfZn₂	COD	7221109	Fd-3m (227)	✔	6	72	3	0.0	0.000	0.870	(0;000)	✗	27/01/17
Fe₂Si	COD	9014528	P-3m1 (164)	✔	6	40	3	0.0	0.006	0.517	(1;001)	✗	27/01/17
KHg₂	COD	2310180	Imma (74)	✔	6	66	3	0.0	0.001	0.655	(0;100)	✗	27/01/17
CrSb₂	COD	9012573	Pnnm (58)	✔	6	48	3	0.0	0.003	0.370	(0;000)	✗	27/01/17
CrSb₂	ICSD	86811	I4/mcm (140)	✔	6	48	3	0.0	0.006	0.448	(0;000)	✗	27/01/17
SrHg₂	COD	1523311	Imma (74)	✔	6	68	3	0.0	0.050	0.437	(0;111)	✗	27/01/17
HgTe	ICSD	639251	P3_221 (154)	✗	6	54	3	0.0	0.028	0.057	(0;000)	✔	06/10/16
HfFe₂	ICSD	103498	Fd-3m (227)	✔	6	56	3	0.0	0.001	0.395	(0;000)	✗	27/01/17
TiAlAu	ICSD	57506	P6_3/mmc (194)	✔	6	52	3	0.0	0.011	0.745	(1;000)	✗	05/01/17
ScFe₂	COD	1523284	Fd-3m (227)	✔	6	54	3	0.0	0.000	0.877	(0;000)	✗	27/01/17
AlBMo	COD	1528606	Cmcm (63)	✔	6	40	3	0.0	0.020	0.209	(1;110)	✗	05/01/17
RbBi₂	ICSD	150969	Fd-3m (227)	✔	6	78	3	0.0	0.000	0.801	(0;000)	✗	02/02/17
AlClO	COD	9009194	Pmmn (59)	✔	6	32	2	3.5066	3.673	0.000	(0;000)	✗	05/01/17
YSn₂	ICSD	416771	Cmcm (63)	✔	6	78	3	0.0	0.000	0.768	(0;000)	✗	27/01/17
YFe₂	ICSD	634083	Fd-3m (227)	✔	6	54	3	0.0	0.000	0.887	(0;000)	✗	27/01/17
ZrFe₂	COD	1523305	Fd-3m (227)	✔	6	40	3	0.0	0.000	0.405	(0;000)	✗	27/01/17
Fe₂Ge	ICSD	632021	P6_3/mmc (194)	✔	6	40	3	0.0	0.012	0.772	(0;000)	✗	27/01/17
CO₂	ICSD	188893	Cmce (64)	✔	6	32	1	0.8836	1.332	0.000	(0;000)	✗	27/01/17
KAlF₄	ICSD	77913	P4/mmm (123)	✔	6	40	2	7.3093	7.704	0.000	(0;000)	✗	05/01/17
NaAlF₄	ICSD	20572	P4/mmm (123)	✔	6	40	2	6.0733	6.404	0.000	(0;000)	✗	05/01/17
RbAlF₄	COD	1000453	P4/mmm (123)	✔	6	40	2	7.1638	7.596	0.000	(0;000)	✗	05/01/17
PbI₂	ICSD	24263	P6_3mc (186)	✗	6	56	2	1.4242	1.424	0.000	(0;000)	✗	06/10/16
AlTlF₄	COD	1000222	P4/mmm (123)	✔	6	44	2	4.0014	4.158	0.000	(0;000)	✗	05/01/17
MnAlGe	COD	9008318	P4/nmm (129)	✔	6	44	3	0.0	0.005	0.212	(0;001)	✗	05/01/17
NaAlGe	COD	7221266	P4/nmm (129)	✔	6	32	1	0.0	0.008	0.128	(0;000)	✗	05/01/17
ScAlGe	ICSD	608009	Cmcm (63)	✔	6	36	3	0.0	0.009	0.328	(0;110)	✗	05/01/17
CdBr₂	ICSD	25782	P6_3mc (186)	✗	6	52	2	2.6943	2.694	0.000	(0;000)	✗	06/10/16
YAlGe	COD	9007848	Cmcm (63)	✔	6	36	3	0.0	0.021	0.319	(0;110)	✗	05/01/17
Hf₂Al	ICSD	608076	I4/mcm (140)	✔	6	54	3	0.0	0.001	0.696	(0;111)	✗	05/01/17
YCu₅	COD	2310320	P6/mmm (191)	✔	6	66	3	0.0	0.003	0.700	(0;001)	✗	27/01/17
ReN₂	ICSD	187447	Cm (8)	✗	6	50	2	0.0	0.057	0.306	(1;111)	✔	04/10/16
LiBeSb	ICSD	100114	P6_3mc (186)	✗	6	24	1	0.477	0.920	0.000	(0;000)	✔	06/10/16
CrCl₂	COD	2310476	Pnnm (58)	✔	6	56	3	0.0	0.004	0.395	(0;000)	✗	27/01/17
LiBeSb	ICSD	616318	P6_3mc (186)	✗	6	24	1	0.4792	0.920	0.000	(0;000)	✔	06/10/16
MnAlPt	ICSD	57984	P6_3/mmc (194)	✔	6	56	3	0.0	0.002	0.466	(0;000)	✗	05/01/17
SrCd₂	COD	1524728	Imma (74)	✔	6	68	3	0.0	0.012	0.472	(0;111)	✗	27/01/17
BeSO₄	ICSD	16832	I-4 (82)	✗	6	34	3	6.9194	7.081	0.000	(0;000)	✗	06/10/16
BeSO₄	ICSD	44801	I-4 (82)	✗	6	34	3	6.347	6.584	0.000	(0;000)	✗	06/10/16
NaAlSi	COD	7221265	P4/nmm (129)	✔	6	32	1	0.0	0.002	0.188	(0;000)	✗	05/01/17
BiTeCl	ICSD	79362	P6_3mc (186)	✗	6	36	2	0.264	0.280	0.000	(0;000)	✔	06/10/16
HgBr₂	ICSD	36158	Ccm2_1 (36)	✗	6	52	2	2.1612	2.218	0.000	(0;000)	✗	06/10/16
CS₂	COD	1527106	Cmce (64)	✔	6	32	1	0.3787	0.877	0.000	(0;000)	✗	27/01/17
FeGe	ICSD	632016	P6/mmm (191)	✔	6	36	3	0.0	0.005	0.874	(0;001)	✗	27/01/17
TiAlPt	ICSD	163350	P6_3/mmc (194)	✔	6	50	3	0.0	0.000	0.904	(0;000)	✗	05/01/17
Sc₂Al	ICSD	58100	P6_3/mmc (194)	✔	6	50	3	0.0	0.000	0.761	(1;000)	✗	05/01/17
YAlSi	COD	1533018	Cmcm (63)	✔	6	36	3	0.0	0.015	0.313	(0;110)	✗	05/01/17
CsCuO	ICSD	40161	Cmcm (63)	✔	6	52	3	1.0614	1.065	0.000	(0;000)	✗	27/01/17
CsCu₃S₂	ICSD	23326	P-3m1 (164)	✔	6	54	2	1.6265	2.016	0.000	(0;000)	✗	27/01/17
CaBr₂	ICSD	14220	Pmnn (58)	✔	6	48	1	4.4866	4.487	0.000	(0;000)	✗	06/10/16
CsCu₃O₂	ICSD	413342	P-3m1 (164)	✔	6	54	2	1.5592	1.641	0.000	(0;000)	✗	27/01/17
PdBr₂	ICSD	27443	C2/c (15)	✔	6	64	1	0.509	0.945	0.000	(0;000)	✗	27/01/17
YAlZn	ICSD	609667	P6_3/mmc (194)	✔	6	52	3	0.0	0.006	0.377	(0;000)	✗	05/01/17
Zr₂Al	ICSD	150774	I4/mcm (140)	✔	6	22	3	0.0	0.001	0.722	(0;111)	✗	05/01/17
Zr₂Al	ICSD	609694	P6_3/mmc (194)	✔	6	22	3	0.0	0.000	0.899	(0;000)	✗	05/01/17
BaTi₂As₂O	ICSD	169074	P4/mmm (123)	✔	6	50	2	0.0	0.008	0.589	(1;001)	✗	05/01/17
TiFeH	ICSD	602022	Pmma (51)	✔	6	42	3	0.0	0.000	0.748	(1;100)	✗	27/01/17
Co₂C	ICSD	16895	Pmnn (58)	✔	6	44	3	0.0	0.023	0.344	(0;000)	✗	06/10/16
Fe₂C	ICSD	162104	Pmnn (58)	✔	6	40	3	0.0	0.006	0.528	(1;000)	✗	06/10/16
FeGe₂	ICSD	42519	I4/mcm (140)	✔	6	32	3	0.0	0.013	0.346	(0;000)	✗	27/01/17
CaGe₂	ICSD	185655	P6_3mc (186)	✗	6	36	1	0.0	0.071	0.116	(1;000)	✔	04/10/16
CoAs₂	COD	2219402	Pnnm (58)	✔	6	54	3	0.0	0.000	0.927	(1;000)	✗	05/01/17
CO₂	ICSD	110776	Pnnm (58)	✔	6	32	1	2.2578	3.149	0.000	(0;000)	✗	06/10/16
LiFeP	COD	9008322	P4/nmm (129)	✔	6	32	2	0.0	0.011	0.513	(1;001)	✗	27/01/17
CS₂	ICSD	15672	Cmce (64)	✔	6	32	1	0.3788	0.877	0.000	(0;000)	✗	06/10/16
FeAs₂	COD	9012340	Pnnm (58)	✔	6	36	3	0.2868	0.618	0.000	(0;000)	✗	05/01/17
NbP₂	ICSD	645169	C2/m (12)	✔	6	46	3	0.0	0.044	0.088	(0;111)	✔	27/01/17
CSe₂	ICSD	60374	Cmce (64)	✔	6	32	1	1.8396	2.057	0.000	(0;000)	✗	27/01/17
CaC₂	ICSD	290834	Cmcm (63)	✔	6	36	1	0.0	0.051	0.065	(0;000)	✗	06/10/16
NbAs₂	COD	2004123	C2/m (12)	✔	6	46	3	0.0	0.026	0.083	(0;111)	✗	05/01/17
CaC₂	ICSD	66663	P-1 (2)	✔	6	36	1	2.4633	3.084	0.000	(0;000)	✗	06/10/16
NiAs₂	COD	9012572	Pnnm (58)	✔	6	40	3	0.0	0.032	0.448	(1;000)	✗	05/01/17
As₂Os	COD	9012561	Pnnm (58)	✔	6	52	3	0.6395	1.158	0.000	(0;000)	✗	05/01/17
KO₂	ICSD	38230	C2/c (15)	✔	6	42	2	0.0	0.000	0.626	(1;011)	✔	27/01/17
As₂Ru	COD	9012558	Pnnm (58)	✔	6	52	3	0.4005	1.052	0.000	(0;000)	✗	05/01/17
FeO₂	COD	9015156	Cmcm (63)	✔	6	40	2	0.0	0.022	0.728	(0;000)	✗	27/01/17
KSb₂	ICSD	80945	C2/m (12)	✔	6	38	1	0.1801	0.569	0.000	(0;000)	✔	02/02/17
BaAsAu	ICSD	420341	P6_3/mmc (194)	✔	6	52	2	0.0	0.000	0.046	(1;000)	✗	05/01/17

13628 materials founds