srDFT_SC/new/N2_avdz/data/data_DFT_avdzE_relat

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2019-10-01 19:13:31 +02:00
1.6 0.07317514 0.0211125668 0.0241908623 -0.0269
1.75 -0.16194179 -0.2074443377 -0.2052859586 -0.2418
1.9 -0.2768321 -0.3166414528 -0.3152796118 -0.3362
2.075 -0.32138792 -0.3556264091 -0.355022158 -0.3642
2.25 -0.31303034 -0.3426946672 -0.3426708892 -0.3458
2.75 -0.19470967 -0.2148060707 -0.2156651165 -0.2177
3.5 -0.05223212 -0.060237338 -0.0610520495 -0.0759
4.0 -0.01759574 -0.020293988 -0.020810944 -0.0353
5.0 -0.00379454 -0.004103095 -0.00421199800001 -0.00830000000001
7.0 -0.000632840000009 -0.000579198600013 -0.000594420200006 -0.000600000000006
10.0 0.0 -5.6760152134e-15 -4.06619182769e-15 0.0