srDFT_SC/new/O2_avtz/plots/data_DFT_avtzE_relat
2020-01-27 00:28:58 +01:00

9 lines
595 B
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1.95 -0.18262671 -0.1908189095 -0.1911838173 -0.1910133877 -0.1185
2.1 -0.23586035 -0.2424680315 -0.2429454267 -0.2427781538 -0.1694
2.2816 -0.25421655 -0.2593600381 -0.2599241858 -0.2597615698 -0.1855
2.4 -0.25142733 -0.255817125 -0.2564171589 -0.2562581371 -0.1809
2.6 -0.23193282 -0.2353087068 -0.235941119 -0.2357891722 -0.1599
3.0 -0.17567343 -0.1776385094 -0.1782562511 -0.1781235262 -0.104
4.0 -0.000105819999987 -0.000451736700001 -0.000528740699976 -0.0005215344 -0.0202
5.0 0.0 3.46944695195e-17 -1.35932931578e-14 7.43155537108e-15 0.0