srDFT_SC/new/H2_avdz/plots/data_DFT_avdzE_relat

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2019-10-21 17:04:57 +02:00
0.8 0.01093073 0.0027366032 0.0019540501 0.001901005 -0.0201
0.9 -0.05943096 -0.0669459617 -0.0677954756 -0.0678478541 -0.0836
1.0 -0.10539874 -0.1122876403 -0.1131961812 -0.1132482231 -0.1245
1.1 -0.1347306 -0.1410453151 -0.142004185 -0.1420561716 -0.1501
1.2 -0.1524975 -0.1582850687 -0.1592855069 -0.1593375701 -0.1649
1.401 -0.16594667 -0.170798382 -0.1718571645 -0.1719089432 -0.1745
1.6 -0.162318 -0.1663914522 -0.1674782646 -0.1675283336 -0.1686
1.8 -0.15010692 -0.1535399262 -0.1546293984 -0.1546764348 -0.1551
2.0 -0.13391233 -0.1368314295 -0.1379022995 -0.1379457273 -0.1381
2.5 -0.09063039 -0.09264435 -0.0936029836 -0.0936375063 -0.0939
3.0 -0.05466758 -0.0560660035 -0.0568582233 -0.056885081 -0.0573
4.0 -0.01522445 -0.0157375908 -0.0161538059 -0.0161704441 -0.0164
5.0 -0.00345529 -0.0035587341 -0.0037014303 -0.0037102476 -0.0038
7.0 -0.00016435 -0.0001668648 -0.0001761938 -0.0001769552 -0.0002
10.0 0.0 -2.70879316735e-18 1.23244882012e-17 -5.10113681083e-17 0.0