srDFT_SC/new/O2_avtz/plots/data_DFT_avtzE_relat
2020-01-27 14:25:02 +01:00

10 lines
672 B
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1.95 -0.11096784 -0.1199099397 -0.1205553507 -0.1203114372 -0.1245
2.1 -0.16436477 -0.1717223517 -0.1724802501 -0.1722394933 -0.1754
2.2816 -0.18342091 -0.1893142983 -0.1901589492 -0.1899228493 -0.1915
2.4 -0.1812334 -0.1863730952 -0.1872536323 -0.1870211266 -0.1869
2.6 -0.16136081 -0.165486597 -0.1663995124 -0.1661740817 -0.1659
3.0 -0.10531621 -0.1080311896 -0.1089294345 -0.1087232257 -0.11
4.0 -0.00406228 -0.00461349840001 -0.0050469969 -0.0049547412 -0.0262
5.0 0.000361670000018 0.00010434060001 -0.000197240599979 -0.000124719199982 -0.006
10.0 0.0 -8.19483370051e-15 9.21485110439e-15 5.75234304634e-15 0.0