srDFT_SC/new/C2_avdz/data/data_DFT_avdzE_relat

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2019-11-20 15:52:45 +01:00
2.0 -0.10652637 -0.1291403041 -0.1271753105 -0.1267723222 3.5546679
2.1 -0.15545958 -0.1750987512 -0.173565317 -0.1731717429 1.6412468
2.3474 -0.20390204 -0.21737992 -0.2167299255 -0.2163692255 0.5604509
2.5 -0.20257833 -0.2130537232 -0.2128151425 -0.2124786624 0.0472778
2.7 -0.18292246 -0.190271348 -0.1904409587 -0.1901511512 -0.1672794
3.0 -0.14066736 -0.1447000133 -0.1452703079 -0.1450390212 -0.2358007
3.5 -0.09433367 -0.1035163551 -0.1047466522 -0.1043709149 -0.2322656
4.0 -0.0515795 -0.0576560908 -0.0589014091 -0.0586293661 -0.1979535
5.0 -0.00266307 -0.0022530886 -0.00240689719999 -0.0023568217 -0.15638
7.0 -4.97999999993e-06 8.02308999988e-05 7.34810999992e-05 9.04322000043e-05 -0.0985603
10.0 0.0 2.29330443524e-15 -3.74700270811e-15 -6.70297151117e-15 -0.0559173