srDFT_SC/new/H2_avtz/plots/data_DFT_full_avtzE_relat
2019-10-21 17:04:57 +02:00

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0.8 -0.0160702690753 -0.0178676318753 -0.0183562217753 -0.0183819666753 -0.0201
0.9 -0.0805196648652 -0.0820994086652 -0.0825773783652 -0.0825995266652 -0.0836
1.0 -0.122024944373 -0.123421579973 -0.123887333073 -0.123906599373 -0.1245
1.1 -0.147961989674 -0.149202317574 -0.149654887674 -0.149671803674 -0.1501
1.2 -0.163122524641 -0.164228436141 -0.164667387541 -0.164682373241 -0.1649
1.401 -0.172983426439 -0.173873045939 -0.174284747239 -0.174296836239 -0.1745
1.6 -0.16726980556 -0.16800012436 -0.16838569326 -0.16839582976 -0.1686
1.8 -0.153903401754 -0.154513148954 -0.154873366954 -0.154882107354 -0.1551
2.0 -0.137089890888 -0.137608030188 -0.137944541488 -0.137952261488 -0.1381
2.5 -0.0931058207925 -0.0934719467925 -0.0937555822925 -0.0937616346925 -0.0939
3.0 -0.0566961486663 -0.0569518238663 -0.0571806721663 -0.0571853011663 -0.0573
4.0 -0.0161164563878 -0.0161987005878 -0.0163088528878 -0.0163108325878 -0.0164
5.0 -0.00367705047889 -0.00369375407889 -0.00373103807889 -0.00373179967889 -0.0038
7.0 -0.000176707652466 -0.000177211652466 -0.000180425452466 -0.000180618852466 -0.0002
10.0 0.0 1.17338572556e-17 5.14415880536e-17 5.21926151103e-17 0.0