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kjappelbaum
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chemnlp-mp-elastic-anisotropy

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train · 6.33k rows

Unnamed: 0.1 int64 0 6.33k	Unnamed: 0 int64 0 4.43k	formula stringlengths 2 14	elastic_anisotropy float64 -1,785.73 893	split stringclasses 3 values
0	0	NbB2	0.28	test
1	1	ErF3	3.288147	test
2	2	ZrBrN	1.423804	test
3	3	ErTlTe2	1.08	test
4	4	Ti2MnIr	0.257854	test
5	5	CdIn2O4	0.595614	test
6	6	NbF4	13.765466	test
7	7	MnCo2Si	0.589725	test
8	8	CoBr2	72.504983	test
9	9	Zr4In5Co2	0.159022	test
10	10	Ba(AlTe2)2	0.407539	test
11	11	ScHCl	51.561746	test
12	12	ZnBiO3	0.162273	test
13	13	SnCl4	1.026436	test
14	14	LiBePt2	0.089484	test
15	15	Ba(LaSe2)2	-1.84	test
16	16	CoCu2O3	1.531329	test
17	17	PmCdHg2	1.22	test
18	18	Ba5Bi3	0.536771	test
19	19	AlCrO4	1.2	test
20	20	Ca4Mg4Fe3H22	0.006062	test
21	21	TlPd2Se3	3.52935	test
22	22	MgInCu4	1.830289	test
23	23	NbNiB	0.330958	test
24	24	SmPd3	0.4	test
25	25	Zr(VGa2)2	0.37	test
26	26	Rb2O	12.518364	test
27	27	GePd	2.056466	test
28	28	Y2AlZn	0.98236	test
29	29	NbInS2	3.876077	test
30	30	HfN	0.496771	test
31	31	Ba2Cd	0.127759	test
32	32	EuCl3	0.473575	test
33	33	NdFeO3	0.130052	test
34	34	KGaSb4	0.555211	test
35	35	CoPt	0.55057	test
36	36	TmBi	1.27	test
37	37	CdWO4	0.777876	test
38	38	MnSbIr	0.109305	test
39	39	Sc2CuRu	0.249877	test
40	40	Si5Pt12	1.435125	test
41	41	Fe2O3F	1.385676	test
42	42	HfAs2	0.168318	test
43	43	PaZnRu2	0.43	test
44	44	PrNdTl2	3.21	test
45	45	Cu3Pt	1.514855	test
46	46	CeNi	1.007773	test
47	47	SrMgTl2	0.17583	test
48	48	In2HgTe4	0.785155	test
49	49	HfIr3	0.841647	test
50	50	SmGa5Co	0.07	test
51	51	Ca(AlSi)2	0.267249	test
52	52	Li4WO5	3.732174	test
53	53	Y2O3	0.102477	test
54	54	Li3PS4	0.192848	test
55	55	MnSn2	0.349944	test
56	56	CuPt	0.899595	test
57	57	CsVI3	8.868483	test
58	58	Y2FeB	127.84	test
59	59	ThSe	38.3	test
60	60	Zr3As2	0.480276	test
61	61	V3(O2F)2	0.35	test
62	62	AgBr	4.68	test
63	63	ZnSbF6	2.05	test
64	64	Mo(CO)6	0.35	test
65	65	SrH2	0.085334	test
66	66	ScRh3	0.953824	test
67	67	ZnCN2	1.285624	test
68	68	Nb3Pt	0.680861	test
69	69	Ho3TlC	56.92	test
70	70	Y2NiIr	0.027146	test
71	71	Ba2YBiO6	0.19	test
72	72	SmLuIn2	15.08	test
73	73	Cu2Sb	0.13498	test
74	74	Ag2MoO4	11.655438	test
75	75	CsTiBr3	0.232902	test
76	76	SbCl5	2.830689	test
77	77	HfSnRu2	0.002532	test
78	78	Li2CdSb	4.008096	test
79	79	Li2InPd	6.354841	test
80	80	Sr4Fe4O11	0.321497	test
81	81	Hf3Si2	0.42197	test
82	82	CaCd2	1.229772	test
83	83	Ca(SiNi)2	0.245453	test
84	84	Ta3Sb	0.5675	test
85	85	Sc2BeRu	0.561714	test
86	86	Si3W	-30.463554	test
87	87	Ti2MnRh	0.52466	test
88	88	Al12W	0.000663	test
89	89	HfPt	1.298574	test
90	90	NbRhO4	1.927369	test
91	91	Mn2AlRe	0.063811	test
92	92	Li2GePbS4	0.627977	test
93	93	Eu(MnSb)2	0.799342	test
94	94	YPPt	0.300882	test
95	95	Sm3I	29.16	test
96	96	ScNbRu2	0.203129	test
97	97	CrGaFe2	5.806322	test
98	98	LiCa2Ir	0.209104	test
99	99	Ba(NO2)2	0.257697	test

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